data_15089

#######################
#  Entry information  #
#######################

save_entry_information
   _Entry.Sf_category                    entry_information
   _Entry.Sf_framecode                   entry_information
   _Entry.ID                             15089
   _Entry.Title                         
;
Solution NMR structure of Q8ZRJ2 from Salmonella typhimurium. Northeast Structural Genomics target StR65.
;
   _Entry.Type                           macromolecule
   _Entry.Version_type                   original
   _Entry.Submission_date                2006-12-29
   _Entry.Accession_date                 2006-12-29
   _Entry.Last_release_date              .
   _Entry.Original_release_date          .
   _Entry.Origination                    author
   _Entry.NMR_STAR_version               3.1.1.61
   _Entry.Original_NMR_STAR_version      .
   _Entry.Experimental_method            NMR
   _Entry.Experimental_method_subtype    solution
   _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.Entry_ID

       1 James      Aramini  . M.   . 15089 
       2 John       Cort     . R.   . 15089 
       3 Ho         Chi      . K.   . 15089 
       4 Cunningham Kellie   . .    . 15089 
       5 Ma         Li-Chung . .    . 15089 
       6 Xiao       Rong     . .    . 15089 
       7 Liu        Jinfeng  . .    . 15089 
       8 Baran      Micheal  . C    . 15089 
       9 Swapna     Gurla    . V.T. . 15089 
      10 Acton      Thomas   . B    . 15089 
      11 Rost       Burkhard . .    . 15089 
      12 Montelione Gaetano  . T    . 15089 

   stop_

   loop_
      _SG_project.SG_project_ID
      _SG_project.Project_name
      _SG_project.Full_name_of_center
      _SG_project.Initial_of_center
      _SG_project.Entry_ID

      1 'PSI, Protein Structure Initiative' 'Northeast Structural Genomics Consortium' . 15089 

   stop_

   loop_
      _Struct_keywords.Keywords
      _Struct_keywords.Text
      _Struct_keywords.Entry_ID

       AutoStructure  . 15089 
       NESG           . 15089 
      'NMR structure' . 15089 
       PSI-2          . 15089 

   stop_

   loop_
      _Data_set.Type
      _Data_set.Count
      _Data_set.Entry_ID

      assigned_chemical_shifts 1 15089 

   stop_

   loop_
      _Datum.Type
      _Datum.Count
      _Datum.Entry_ID

      '13C chemical shifts' 483 15089 
      '15N chemical shifts' 108 15089 
      '1H chemical shifts'  768 15089 

   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 . . 2010-09-28 2006-12-29 update   author 'add peak lists'   15089 
      1 . . 2008-09-25 2006-12-29 original author 'original release' 15089 

   stop_

   loop_
      _Related_entries.Database_name
      _Related_entries.Database_accession_code
      _Related_entries.Relationship
      _Related_entries.Entry_ID

      PDB 2es9 'NESG Xray structure'        15089 
      PDB 2JN8 'BMRB Entry Tracking System' 15089 

   stop_

save_


###############
#  Citations  #
###############

save_citation_1
   _Citation.Sf_category                  citations
   _Citation.Sf_framecode                 citation_1
   _Citation.Entry_ID                     15089
   _Citation.ID                           1
   _Citation.Class                       'entry citation'
   _Citation.CAS_abstract_code            .
   _Citation.MEDLINE_UI_code              .
   _Citation.DOI                          .
   _Citation.PubMed_ID                    TBA
   _Citation.Full_citation                .
   _Citation.Title                       'Solution NMR structure of Q8ZRJ2 from Salmonella typhimurium. Northeast Structural Genomics target StR65.'
   _Citation.Status                      'in preparation'
   _Citation.Type                         journal
   _Citation.Journal_abbrev               .
   _Citation.Journal_name_full            .
   _Citation.Journal_volume               .
   _Citation.Journal_issue                .
   _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                   .
   _Citation.Page_last                    .
   _Citation.Year                         .
   _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.Entry_ID
      _Citation_author.Citation_ID

       1 James      Aramini    . M.   . 15089 1 
       2 John       Cort       . R.   . 15089 1 
       3 Ho         Chi        . K.   . 15089 1 
       4 Cunningham Kellie     . .    . 15089 1 
       5 Ma         Li-Chung   . .    . 15089 1 
       6 Xiao       Rong       . .    . 15089 1 
       7 Liu        Jinfeng    . .    . 15089 1 
       8 Baran      Micheal    . C    . 15089 1 
       9 Swapna     Gurla      . V.T. . 15089 1 
      10 Acton      Thomas     . B    . 15089 1 
      11 Rost       Burkhard   . .    . 15089 1 
      12 Gaetano    Montelione . T    . 15089 1 

   stop_

save_


#############################################
#  Molecular system (assembly) description  #
#############################################

save_assembly
   _Assembly.Sf_category                       assembly
   _Assembly.Sf_framecode                      assembly
   _Assembly.Entry_ID                          15089
   _Assembly.ID                                1
   _Assembly.Name                              StR65
   _Assembly.BMRB_code                         .
   _Assembly.Number_of_components              1
   _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                      .
   _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 StR65 1 $StR65 A . yes native no no . . . 15089 1 

   stop_

save_


    ####################################
    #  Biological polymers and ligands #
    ####################################

save_StR65
   _Entity.Sf_category                       entity
   _Entity.Sf_framecode                      StR65
   _Entity.Entry_ID                          15089
   _Entity.ID                                1
   _Entity.BMRB_code                         .
   _Entity.Name                              StR65
   _Entity.Type                              polymer
   _Entity.Polymer_common_type               .
   _Entity.Polymer_type                      polypeptide(L)
   _Entity.Polymer_type_details              .
   _Entity.Polymer_strand_ID                 A
   _Entity.Polymer_seq_one_letter_code_can   .
   _Entity.Polymer_seq_one_letter_code      
;
MVNFKDKSMPTAIEKALDFI
GGMNTSASVPHSMDESTAKG
ILKYLHDLGVPVSPEVVVAR
GEQEGWNPEFTKKVAGWAEK
VASGNRILIKNPEYFSTYMQ
EQLKELVLEHHHHHH
;
   _Entity.Target_identifier                 .
   _Entity.Polymer_author_defined_seq        .
   _Entity.Polymer_author_seq_details       'Residues 108-115 represent a non-native affinity tag.'
   _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                115
   _Entity.Number_of_nonpolymer_components   .
   _Entity.Paramagnetic                      no
   _Entity.Thiol_state                      'not present'
   _Entity.Src_method                        man
   _Entity.Parent_entity_ID                  1
   _Entity.Fragment                          .
   _Entity.Mutation                          .
   _Entity.EC_number                         .
   _Entity.Calc_isoelectric_point            .
   _Entity.Formula_weight                    12949.884
   _Entity.Formula_weight_exptl              .
   _Entity.Formula_weight_exptl_meth         .
   _Entity.Details                           .
   _Entity.DB_query_date                     .
   _Entity.DB_query_revised_last_date        2015-11-26

   loop_
      _Entity_db_link.Ordinal
      _Entity_db_link.Author_supplied
      _Entity_db_link.Database_code
      _Entity_db_link.Accession_code
      _Entity_db_link.Entry_mol_code
      _Entity_db_link.Entry_mol_name
      _Entity_db_link.Entry_experimental_method
      _Entity_db_link.Entry_structure_resolution
      _Entity_db_link.Entry_relation_type
      _Entity_db_link.Entry_details
      _Entity_db_link.Chimera_segment_ID
      _Entity_db_link.Seq_query_to_submitted_percent
      _Entity_db_link.Seq_subject_length
      _Entity_db_link.Seq_identity
      _Entity_db_link.Seq_positive
      _Entity_db_link.Seq_homology_expectation_val
      _Entity_db_link.Seq_align_begin
      _Entity_db_link.Seq_align_end
      _Entity_db_link.Seq_difference_details
      _Entity_db_link.Seq_alignment_details
      _Entity_db_link.Entry_ID
      _Entity_db_link.Entity_ID

       1 no PDB  2JN8         . "Solution Nmr Structure Of Q8zrj2 From Salmonella Typhimurium. Northeast Structural Genomics Target Str65"   . . . . . 100.00 115 100.00 100.00 1.65e-78 . . . . 15089 1 
       2 no DBJ  BAJ35334     . "putative cytoplasmic protein [Salmonella enterica subsp. enterica serovar Typhimurium str. T000240]"        . . . . .  93.04 107 100.00 100.00 5.56e-72 . . . . 15089 1 
       3 no DBJ  BAP06087     . "conserved hypothetical protein [Salmonella enterica subsp. enterica serovar Typhimurium str. L-3553]"       . . . . .  86.09  99 100.00 100.00 1.69e-65 . . . . 15089 1 
       4 no DBJ  GAL41201     . "hypothetical protein CIFRE_18_02310 [Citrobacter freundii NBRC 12681]"                                      . . . . .  93.04 107  98.13  99.07 8.14e-71 . . . . 15089 1 
       5 no DBJ  GAL45758     . "hypothetical protein CIWKM_11_03760 [Citrobacter werkmanii NBRC 105721]"                                    . . . . .  86.09  99  97.98  98.99 1.96e-64 . . . . 15089 1 
       6 no EMBL CAR31896     . "conserved hypothetical protein [Salmonella enterica subsp. enterica serovar Enteritidis str. P125109]"      . . . . .  93.04 107  97.20  98.13 6.91e-70 . . . . 15089 1 
       7 no EMBL CAR36239     . "conserved hypothetical protein [Salmonella enterica subsp. enterica serovar Gallinarum str. 287/91]"        . . . . .  93.04 107  98.13  99.07 1.89e-70 . . . . 15089 1 
       8 no EMBL CBG23406     . "conserved hypothetical protein [Salmonella enterica subsp. enterica serovar Typhimurium str. D23580]"       . . . . .  93.04 107 100.00 100.00 5.56e-72 . . . . 15089 1 
       9 no EMBL CBW16422     . "conserved hypothetical protein [Salmonella enterica subsp. enterica serovar Typhimurium str. SL1344]"       . . . . .  93.04 107 100.00 100.00 5.56e-72 . . . . 15089 1 
      10 no EMBL CBY94375     . "Uncharacterized protein yoaC [Salmonella enterica subsp. enterica serovar Weltevreden str. 2007-60-3289-1]" . . . . .  86.09  99 100.00 100.00 1.69e-65 . . . . 15089 1 
      11 no GB   AAL19281     . "putative cytoplasmic protein [Salmonella enterica subsp. enterica serovar Typhimurium str. LT2]"            . . . . .  93.04 107 100.00 100.00 5.56e-72 . . . . 15089 1 
      12 no GB   AAX64278     . "putative cytoplasmic protein [Salmonella enterica subsp. enterica serovar Choleraesuis str. SC-B67]"        . . . . .  93.04 107 100.00 100.00 5.56e-72 . . . . 15089 1 
      13 no GB   ACF65524     . "conserved hypothetical protein [Salmonella enterica subsp. enterica serovar Newport str. SL254]"            . . . . .  65.22  75 100.00 100.00 1.28e-46 . . . . 15089 1 
      14 no GB   ACN44523     . "putative cytoplasmic protein [Salmonella enterica subsp. enterica serovar Paratyphi C str. RKS4594]"        . . . . .  65.22  75 100.00 100.00 1.28e-46 . . . . 15089 1 
      15 no GB   ACY86903     . "putative cytoplasmic protein [Salmonella enterica subsp. enterica serovar Typhimurium str. 14028S]"         . . . . .  93.04 107 100.00 100.00 5.56e-72 . . . . 15089 1 
      16 no REF  NP_459322    . "cytoplasmic protein [Salmonella enterica subsp. enterica serovar Typhimurium str. LT2]"                     . . . . .  93.04 107 100.00 100.00 5.56e-72 . . . . 15089 1 
      17 no REF  WP_001141634 . "hypothetical protein [Salmonella enterica]"                                                                 . . . . .  86.09  99  96.97  97.98 1.51e-63 . . . . 15089 1 
      18 no REF  WP_001141635 . "hypothetical protein [Salmonella enterica]"                                                                 . . . . .  86.09  99  97.98  98.99 4.85e-64 . . . . 15089 1 
      19 no REF  WP_001141636 . "hypothetical protein [Salmonella enterica]"                                                                 . . . . .  86.09  99  96.97  98.99 3.03e-64 . . . . 15089 1 
      20 no REF  WP_001141637 . "MULTISPECIES: hypothetical protein [Enterobacteriaceae]"                                                    . . . . .  86.09  99  97.98  98.99 1.96e-64 . . . . 15089 1 

   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 . MET . 15089 1 
        2 . VAL . 15089 1 
        3 . ASN . 15089 1 
        4 . PHE . 15089 1 
        5 . LYS . 15089 1 
        6 . ASP . 15089 1 
        7 . LYS . 15089 1 
        8 . SER . 15089 1 
        9 . MET . 15089 1 
       10 . PRO . 15089 1 
       11 . THR . 15089 1 
       12 . ALA . 15089 1 
       13 . ILE . 15089 1 
       14 . GLU . 15089 1 
       15 . LYS . 15089 1 
       16 . ALA . 15089 1 
       17 . LEU . 15089 1 
       18 . ASP . 15089 1 
       19 . PHE . 15089 1 
       20 . ILE . 15089 1 
       21 . GLY . 15089 1 
       22 . GLY . 15089 1 
       23 . MET . 15089 1 
       24 . ASN . 15089 1 
       25 . THR . 15089 1 
       26 . SER . 15089 1 
       27 . ALA . 15089 1 
       28 . SER . 15089 1 
       29 . VAL . 15089 1 
       30 . PRO . 15089 1 
       31 . HIS . 15089 1 
       32 . SER . 15089 1 
       33 . MET . 15089 1 
       34 . ASP . 15089 1 
       35 . GLU . 15089 1 
       36 . SER . 15089 1 
       37 . THR . 15089 1 
       38 . ALA . 15089 1 
       39 . LYS . 15089 1 
       40 . GLY . 15089 1 
       41 . ILE . 15089 1 
       42 . LEU . 15089 1 
       43 . LYS . 15089 1 
       44 . TYR . 15089 1 
       45 . LEU . 15089 1 
       46 . HIS . 15089 1 
       47 . ASP . 15089 1 
       48 . LEU . 15089 1 
       49 . GLY . 15089 1 
       50 . VAL . 15089 1 
       51 . PRO . 15089 1 
       52 . VAL . 15089 1 
       53 . SER . 15089 1 
       54 . PRO . 15089 1 
       55 . GLU . 15089 1 
       56 . VAL . 15089 1 
       57 . VAL . 15089 1 
       58 . VAL . 15089 1 
       59 . ALA . 15089 1 
       60 . ARG . 15089 1 
       61 . GLY . 15089 1 
       62 . GLU . 15089 1 
       63 . GLN . 15089 1 
       64 . GLU . 15089 1 
       65 . GLY . 15089 1 
       66 . TRP . 15089 1 
       67 . ASN . 15089 1 
       68 . PRO . 15089 1 
       69 . GLU . 15089 1 
       70 . PHE . 15089 1 
       71 . THR . 15089 1 
       72 . LYS . 15089 1 
       73 . LYS . 15089 1 
       74 . VAL . 15089 1 
       75 . ALA . 15089 1 
       76 . GLY . 15089 1 
       77 . TRP . 15089 1 
       78 . ALA . 15089 1 
       79 . GLU . 15089 1 
       80 . LYS . 15089 1 
       81 . VAL . 15089 1 
       82 . ALA . 15089 1 
       83 . SER . 15089 1 
       84 . GLY . 15089 1 
       85 . ASN . 15089 1 
       86 . ARG . 15089 1 
       87 . ILE . 15089 1 
       88 . LEU . 15089 1 
       89 . ILE . 15089 1 
       90 . LYS . 15089 1 
       91 . ASN . 15089 1 
       92 . PRO . 15089 1 
       93 . GLU . 15089 1 
       94 . TYR . 15089 1 
       95 . PHE . 15089 1 
       96 . SER . 15089 1 
       97 . THR . 15089 1 
       98 . TYR . 15089 1 
       99 . MET . 15089 1 
      100 . GLN . 15089 1 
      101 . GLU . 15089 1 
      102 . GLN . 15089 1 
      103 . LEU . 15089 1 
      104 . LYS . 15089 1 
      105 . GLU . 15089 1 
      106 . LEU . 15089 1 
      107 . VAL . 15089 1 
      108 . LEU . 15089 1 
      109 . GLU . 15089 1 
      110 . HIS . 15089 1 
      111 . HIS . 15089 1 
      112 . HIS . 15089 1 
      113 . HIS . 15089 1 
      114 . HIS . 15089 1 
      115 . HIS . 15089 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

      . MET   1   1 15089 1 
      . VAL   2   2 15089 1 
      . ASN   3   3 15089 1 
      . PHE   4   4 15089 1 
      . LYS   5   5 15089 1 
      . ASP   6   6 15089 1 
      . LYS   7   7 15089 1 
      . SER   8   8 15089 1 
      . MET   9   9 15089 1 
      . PRO  10  10 15089 1 
      . THR  11  11 15089 1 
      . ALA  12  12 15089 1 
      . ILE  13  13 15089 1 
      . GLU  14  14 15089 1 
      . LYS  15  15 15089 1 
      . ALA  16  16 15089 1 
      . LEU  17  17 15089 1 
      . ASP  18  18 15089 1 
      . PHE  19  19 15089 1 
      . ILE  20  20 15089 1 
      . GLY  21  21 15089 1 
      . GLY  22  22 15089 1 
      . MET  23  23 15089 1 
      . ASN  24  24 15089 1 
      . THR  25  25 15089 1 
      . SER  26  26 15089 1 
      . ALA  27  27 15089 1 
      . SER  28  28 15089 1 
      . VAL  29  29 15089 1 
      . PRO  30  30 15089 1 
      . HIS  31  31 15089 1 
      . SER  32  32 15089 1 
      . MET  33  33 15089 1 
      . ASP  34  34 15089 1 
      . GLU  35  35 15089 1 
      . SER  36  36 15089 1 
      . THR  37  37 15089 1 
      . ALA  38  38 15089 1 
      . LYS  39  39 15089 1 
      . GLY  40  40 15089 1 
      . ILE  41  41 15089 1 
      . LEU  42  42 15089 1 
      . LYS  43  43 15089 1 
      . TYR  44  44 15089 1 
      . LEU  45  45 15089 1 
      . HIS  46  46 15089 1 
      . ASP  47  47 15089 1 
      . LEU  48  48 15089 1 
      . GLY  49  49 15089 1 
      . VAL  50  50 15089 1 
      . PRO  51  51 15089 1 
      . VAL  52  52 15089 1 
      . SER  53  53 15089 1 
      . PRO  54  54 15089 1 
      . GLU  55  55 15089 1 
      . VAL  56  56 15089 1 
      . VAL  57  57 15089 1 
      . VAL  58  58 15089 1 
      . ALA  59  59 15089 1 
      . ARG  60  60 15089 1 
      . GLY  61  61 15089 1 
      . GLU  62  62 15089 1 
      . GLN  63  63 15089 1 
      . GLU  64  64 15089 1 
      . GLY  65  65 15089 1 
      . TRP  66  66 15089 1 
      . ASN  67  67 15089 1 
      . PRO  68  68 15089 1 
      . GLU  69  69 15089 1 
      . PHE  70  70 15089 1 
      . THR  71  71 15089 1 
      . LYS  72  72 15089 1 
      . LYS  73  73 15089 1 
      . VAL  74  74 15089 1 
      . ALA  75  75 15089 1 
      . GLY  76  76 15089 1 
      . TRP  77  77 15089 1 
      . ALA  78  78 15089 1 
      . GLU  79  79 15089 1 
      . LYS  80  80 15089 1 
      . VAL  81  81 15089 1 
      . ALA  82  82 15089 1 
      . SER  83  83 15089 1 
      . GLY  84  84 15089 1 
      . ASN  85  85 15089 1 
      . ARG  86  86 15089 1 
      . ILE  87  87 15089 1 
      . LEU  88  88 15089 1 
      . ILE  89  89 15089 1 
      . LYS  90  90 15089 1 
      . ASN  91  91 15089 1 
      . PRO  92  92 15089 1 
      . GLU  93  93 15089 1 
      . TYR  94  94 15089 1 
      . PHE  95  95 15089 1 
      . SER  96  96 15089 1 
      . THR  97  97 15089 1 
      . TYR  98  98 15089 1 
      . MET  99  99 15089 1 
      . GLN 100 100 15089 1 
      . GLU 101 101 15089 1 
      . GLN 102 102 15089 1 
      . LEU 103 103 15089 1 
      . LYS 104 104 15089 1 
      . GLU 105 105 15089 1 
      . LEU 106 106 15089 1 
      . VAL 107 107 15089 1 
      . LEU 108 108 15089 1 
      . GLU 109 109 15089 1 
      . HIS 110 110 15089 1 
      . HIS 111 111 15089 1 
      . HIS 112 112 15089 1 
      . HIS 113 113 15089 1 
      . HIS 114 114 15089 1 
      . HIS 115 115 15089 1 

   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       15089
   _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.Subvariant
      _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.Cellular_location
      _Entity_natural_src.Fragment
      _Entity_natural_src.Fraction
      _Entity_natural_src.Secretion
      _Entity_natural_src.Plasmid
      _Entity_natural_src.Plasmid_details
      _Entity_natural_src.Gene_mnemonic
      _Entity_natural_src.Dev_stage
      _Entity_natural_src.Details
      _Entity_natural_src.Citation_ID
      _Entity_natural_src.Citation_label
      _Entity_natural_src.Entry_ID
      _Entity_natural_src.Entity_natural_src_list_ID

      1 1 $StR65 . 602 organism . 'Salmonella typhimurium' 'Salmonella typhimurium' . . . Bacteria . Salmonella typhimurium . . . . . . . . . . . . . . . STM0327 . . . . 15089 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       15089
   _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_subvariant
      _Entity_experimental_src.Host_org_organ
      _Entity_experimental_src.Host_org_tissue
      _Entity_experimental_src.Host_org_tissue_fraction
      _Entity_experimental_src.Host_org_cell_line
      _Entity_experimental_src.Host_org_cell_type
      _Entity_experimental_src.Host_org_cellular_location
      _Entity_experimental_src.Host_org_organelle
      _Entity_experimental_src.Host_org_gene
      _Entity_experimental_src.Host_org_culture_collection
      _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.Host_org_dev_stage
      _Entity_experimental_src.Details
      _Entity_experimental_src.Citation_ID
      _Entity_experimental_src.Citation_label
      _Entity_experimental_src.Entry_ID
      _Entity_experimental_src.Entity_experimental_src_list_ID

      1 1 $StR65 . 'recombinant technology' 'Escherichia coli' . . . . . BL21(DE3)MGK . . . . . . . . . . . . . . . StR65-21.1 . . . 
;
C-terminal tag:  LEHHHHHH  
This protein is a monomer by gel filtration chromatography and static light scattering.
; . . 15089 1 

   stop_

save_


#####################################
#  Sample contents and methodology  #
#####################################
	 
    ########################
    #  Sample description  #
    ########################

save_sample_1
   _Sample.Sf_category                      sample
   _Sample.Sf_framecode                     sample_1
   _Sample.Entry_ID                         15089
   _Sample.ID                               1
   _Sample.Type                             solution
   _Sample.Sub_type                         .
   _Sample.Details                          .
   _Sample.Aggregate_sample_number          .
   _Sample.Solvent_system                  '95% H2O/5% 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  StR65         '[U-100% 13C; U-100% 15N]' . . 1 $StR65 . .   1.17 . . mM . . . . 15089 1 
      2  MES           'natural abundance'        . .  .  .     . .  20    . . mM . . . . 15089 1 
      3  NaCl          'natural abundance'        . .  .  .     . . 100    . . mM . . . . 15089 1 
      4  CaCl2         'natural abundance'        . .  .  .     . .   5    . . mM . . . . 15089 1 
      5  DTT           'natural abundance'        . .  .  .     . .  10    . . mM . . . . 15089 1 
      6 'sodium azide' 'natural abundance'        . .  .  .     . .   0.02 . . %  . . . . 15089 1 

   stop_

save_


save_sample_2
   _Sample.Sf_category                      sample
   _Sample.Sf_framecode                     sample_2
   _Sample.Entry_ID                         15089
   _Sample.ID                               2
   _Sample.Type                             solution
   _Sample.Sub_type                         .
   _Sample.Details                          .
   _Sample.Aggregate_sample_number          .
   _Sample.Solvent_system                  '95% H2O/5% 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  StR65         '[U-5% 13C; U-100% 15N]' . . 1 $StR65 . .   0.89 . . mM . . . . 15089 2 
      2  MES           'natural abundance'      . .  .  .     . .  20    . . mM . . . . 15089 2 
      3  NaCl          'natural abundance'      . .  .  .     . . 100    . . mM . . . . 15089 2 
      4  CaCl2         'natural abundance'      . .  .  .     . .   5    . . mM . . . . 15089 2 
      5  DTT           'natural abundance'      . .  .  .     . .  10    . . mM . . . . 15089 2 
      6 'sodium azide' 'natural abundance'      . .  .  .     . .   0.02 . . %  . . . . 15089 2 

   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       15089
   _Sample_condition_list.ID             1
   _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' 100   . mM  15089 1 
       pH                6.5 . pH  15089 1 
       pressure          1   . atm 15089 1 
       temperature     293   . K   15089 1 

   stop_

save_


############################
#  Computer software used  #
############################

save_VNMR
   _Software.Sf_category    software
   _Software.Sf_framecode   VNMR
   _Software.Entry_ID       15089
   _Software.ID             1
   _Software.Name           VNMR
   _Software.Version        6.1C
   _Software.Details        .

   loop_
      _Vendor.Name
      _Vendor.Address
      _Vendor.Electronic_address
      _Vendor.Entry_ID
      _Vendor.Software_ID

      Varian . . 15089 1 

   stop_

   loop_
      _Task.Task
      _Task.Entry_ID
      _Task.Software_ID

      collection 15089 1 

   stop_

save_


save_Bruker
   _Software.Sf_category    software
   _Software.Sf_framecode   Bruker
   _Software.Entry_ID       15089
   _Software.ID             2
   _Software.Name           xwinnmr
   _Software.Version       'XWINNMR 3.5pl6'
   _Software.Details        .

   loop_
      _Vendor.Name
      _Vendor.Address
      _Vendor.Electronic_address
      _Vendor.Entry_ID
      _Vendor.Software_ID

      Bruker . . 15089 2 

   stop_

   loop_
      _Task.Task
      _Task.Entry_ID
      _Task.Software_ID

      collection 15089 2 

   stop_

save_


save_AutoAssign
   _Software.Sf_category    software
   _Software.Sf_framecode   AutoAssign
   _Software.Entry_ID       15089
   _Software.ID             3
   _Software.Name           AutoAssign
   _Software.Version        2.2.1
   _Software.Details        .

   loop_
      _Vendor.Name
      _Vendor.Address
      _Vendor.Electronic_address
      _Vendor.Entry_ID
      _Vendor.Software_ID

      'Zimmerman, Moseley, Kulikowski, Montelione' . . 15089 3 

   stop_

   loop_
      _Task.Task
      _Task.Entry_ID
      _Task.Software_ID

      'chemical shift assignment' 15089 3 

   stop_

save_


save_SPARKY
   _Software.Sf_category    software
   _Software.Sf_framecode   SPARKY
   _Software.Entry_ID       15089
   _Software.ID             4
   _Software.Name           SPARKY
   _Software.Version        3.110
   _Software.Details        .

   loop_
      _Vendor.Name
      _Vendor.Address
      _Vendor.Electronic_address
      _Vendor.Entry_ID
      _Vendor.Software_ID

      Goddard . . 15089 4 

   stop_

   loop_
      _Task.Task
      _Task.Entry_ID
      _Task.Software_ID

      'data analysis' 15089 4 
      'peak picking'  15089 4 

   stop_

save_


save_NMRPipe
   _Software.Sf_category    software
   _Software.Sf_framecode   NMRPipe
   _Software.Entry_ID       15089
   _Software.ID             5
   _Software.Name           NMRPipe
   _Software.Version        2.3
   _Software.Details        .

   loop_
      _Vendor.Name
      _Vendor.Address
      _Vendor.Electronic_address
      _Vendor.Entry_ID
      _Vendor.Software_ID

      'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 15089 5 

   stop_

   loop_
      _Task.Task
      _Task.Entry_ID
      _Task.Software_ID

      processing 15089 5 

   stop_

save_


save_AutoStructure
   _Software.Sf_category    software
   _Software.Sf_framecode   AutoStructure
   _Software.Entry_ID       15089
   _Software.ID             6
   _Software.Name           AutoStruct
   _Software.Version        2.1.1
   _Software.Details        .

   loop_
      _Vendor.Name
      _Vendor.Address
      _Vendor.Electronic_address
      _Vendor.Entry_ID
      _Vendor.Software_ID

      'Huang, Tejero, Powers and Montelione' . . 15089 6 

   stop_

   loop_
      _Task.Task
      _Task.Entry_ID
      _Task.Software_ID

       refinement          15089 6 
      'structure solution' 15089 6 

   stop_

save_


save_X-PLOR_NIH
   _Software.Sf_category    software
   _Software.Sf_framecode   X-PLOR_NIH
   _Software.Entry_ID       15089
   _Software.ID             7
   _Software.Name          'X-PLOR NIH'
   _Software.Version        2.11.2
   _Software.Details        .

   loop_
      _Vendor.Name
      _Vendor.Address
      _Vendor.Electronic_address
      _Vendor.Entry_ID
      _Vendor.Software_ID

      'Schwieters, Kuszewski, Tjandra and Clore' . . 15089 7 

   stop_

   loop_
      _Task.Task
      _Task.Entry_ID
      _Task.Software_ID

      refinement 15089 7 

   stop_

save_


save_CNS
   _Software.Sf_category    software
   _Software.Sf_framecode   CNS
   _Software.Entry_ID       15089
   _Software.ID             8
   _Software.Name           CNS
   _Software.Version        1.1
   _Software.Details        .

   loop_
      _Vendor.Name
      _Vendor.Address
      _Vendor.Electronic_address
      _Vendor.Entry_ID
      _Vendor.Software_ID

      'Brunger, Adams, Clore, Gros, Nilges and Read' . . 15089 8 

   stop_

   loop_
      _Task.Task
      _Task.Entry_ID
      _Task.Software_ID

      refinement 15089 8 

   stop_

save_


save_PDBStat
   _Software.Sf_category    software
   _Software.Sf_framecode   PDBStat
   _Software.Entry_ID       15089
   _Software.ID             9
   _Software.Name           PDBStat
   _Software.Version        4.1
   _Software.Details        .

   loop_
      _Vendor.Name
      _Vendor.Address
      _Vendor.Electronic_address
      _Vendor.Entry_ID
      _Vendor.Software_ID

      'Tejero and Montelione' . . 15089 9 

   stop_

   loop_
      _Task.Task
      _Task.Entry_ID
      _Task.Software_ID

      'data analysis' 15089 9 

   stop_

save_


save_PSVS
   _Software.Sf_category    software
   _Software.Sf_framecode   PSVS
   _Software.Entry_ID       15089
   _Software.ID             10
   _Software.Name           PSVS
   _Software.Version        1.3
   _Software.Details        .

   loop_
      _Vendor.Name
      _Vendor.Address
      _Vendor.Electronic_address
      _Vendor.Entry_ID
      _Vendor.Software_ID

      'Bhattacharya, Hang and Montelione' . . 15089 10 

   stop_

   loop_
      _Task.Task
      _Task.Entry_ID
      _Task.Software_ID

      'data analysis' 15089 10 

   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         15089
   _NMR_spectrometer.ID               1
   _NMR_spectrometer.Details          .
   _NMR_spectrometer.Manufacturer     Varian
   _NMR_spectrometer.Model            INOVA
   _NMR_spectrometer.Serial_number    .
   _NMR_spectrometer.Field_strength   750

save_


save_spectrometer_2
   _NMR_spectrometer.Sf_category      NMR_spectrometer
   _NMR_spectrometer.Sf_framecode     spectrometer_2
   _NMR_spectrometer.Entry_ID         15089
   _NMR_spectrometer.ID               2
   _NMR_spectrometer.Details          .
   _NMR_spectrometer.Manufacturer     Varian
   _NMR_spectrometer.Model            INOVA
   _NMR_spectrometer.Serial_number    .
   _NMR_spectrometer.Field_strength   600

save_


save_spectrometer_3
   _NMR_spectrometer.Sf_category      NMR_spectrometer
   _NMR_spectrometer.Sf_framecode     spectrometer_3
   _NMR_spectrometer.Entry_ID         15089
   _NMR_spectrometer.ID               3
   _NMR_spectrometer.Details          .
   _NMR_spectrometer.Manufacturer     Bruker
   _NMR_spectrometer.Model            AMX
   _NMR_spectrometer.Serial_number    .
   _NMR_spectrometer.Field_strength   600

save_


save_spectrometer_4
   _NMR_spectrometer.Sf_category      NMR_spectrometer
   _NMR_spectrometer.Sf_framecode     spectrometer_4
   _NMR_spectrometer.Entry_ID         15089
   _NMR_spectrometer.ID               4
   _NMR_spectrometer.Details          .
   _NMR_spectrometer.Manufacturer     Varian
   _NMR_spectrometer.Model            INOVA
   _NMR_spectrometer.Serial_number    .
   _NMR_spectrometer.Field_strength   500

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       15089
   _NMR_spectrometer_list.ID             1

   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 Varian INOVA . 750 . . . 15089 1 
      2 spectrometer_2 Varian INOVA . 600 . . . 15089 1 
      3 spectrometer_3 Bruker AMX   . 600 . . . 15089 1 
      4 spectrometer_4 Varian INOVA . 500 . . . 15089 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       15089
   _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 '2D 1H-15N HSQC'                 no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 15089 1 
      2 '2D 1H-13C HSQC'                 no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 15089 1 
      3 '3D 1H-15N NOESY'                no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 15089 1 
      4 '3D 1H-13C NOESY'                no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 15089 1 
      5 '3D HCCH-COSY'                   no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 15089 1 
      6 '3D HCCH-TOCSY'                  no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 4 $spectrometer_4 . . . . . . . . . . . . . . . . 15089 1 
      7 '3D TR backbone expts'           no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 15089 1 
      8 '3D TR backbone expts'           no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 3 $spectrometer_3 . . . . . . . . . . . . . . . . 15089 1 
      9 'high resolution 2D 1H-13C HSQC' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 4 $spectrometer_4 . . . . . . . . . . . . . . . . 15089 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       15089
   _Chem_shift_reference.ID             1
   _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.Indirect_shift_ratio_cit_ID
      _Chem_shift_ref.Indirect_shift_ratio_cit_label
      _Chem_shift_ref.Ref_correction_type
      _Chem_shift_ref.Correction_val
      _Chem_shift_ref.Correction_val_cit_ID
      _Chem_shift_ref.Correction_val_cit_label
      _Chem_shift_ref.Entry_ID
      _Chem_shift_ref.Chem_shift_reference_ID

      C 13 StR65 carbon   . . . . ppm 0 external indirect 0.251449530 . . . 1 $citation_1 . . 1 $citation_1 15089 1 
      H  1 StR65 protons  . . . . ppm 0 external direct   1.0         . . . 1 $citation_1 . . 1 $citation_1 15089 1 
      N 15 StR65 nitrogen . . . . ppm 0 external indirect 0.101329118 . . . 1 $citation_1 . . 1 $citation_1 15089 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                      15089
   _Assigned_chem_shift_list.ID                            1
   _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 '2D 1H-15N HSQC'                 . . . 15089 1 
      2 '2D 1H-13C HSQC'                 . . . 15089 1 
      3 '3D 1H-15N NOESY'                . . . 15089 1 
      4 '3D 1H-13C NOESY'                . . . 15089 1 
      5 '3D HCCH-COSY'                   . . . 15089 1 
      6 '3D HCCH-TOCSY'                  . . . 15089 1 
      7 '3D TR backbone expts'           . . . 15089 1 
      9 'high resolution 2D 1H-13C HSQC' . . . 15089 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

      4 $SPARKY . . 15089 1 

   stop_

   loop_
      _Atom_chem_shift.ID
      _Atom_chem_shift.Assembly_atom_ID
      _Atom_chem_shift.Entity_assembly_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.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 MET C    C 13 172.3   0.15 . 1 . . . .   1 Met C    . 15089 1 
         2 . 1 1   2   2 VAL HA   H  1   4.06  0.02 . 1 . . . .   2 Val HA   . 15089 1 
         3 . 1 1   2   2 VAL HB   H  1   1.92  0.02 . 1 . . . .   2 Val HB   . 15089 1 
         4 . 1 1   2   2 VAL HG11 H  1   0.88  0.02 . 2 . . . .   2 Val HG1  . 15089 1 
         5 . 1 1   2   2 VAL HG12 H  1   0.88  0.02 . 2 . . . .   2 Val HG1  . 15089 1 
         6 . 1 1   2   2 VAL HG13 H  1   0.88  0.02 . 2 . . . .   2 Val HG1  . 15089 1 
         7 . 1 1   2   2 VAL HG21 H  1   0.75  0.02 . 2 . . . .   2 Val HG2  . 15089 1 
         8 . 1 1   2   2 VAL HG22 H  1   0.75  0.02 . 2 . . . .   2 Val HG2  . 15089 1 
         9 . 1 1   2   2 VAL HG23 H  1   0.75  0.02 . 2 . . . .   2 Val HG2  . 15089 1 
        10 . 1 1   2   2 VAL C    C 13 175.1   0.15 . 1 . . . .   2 Val C    . 15089 1 
        11 . 1 1   2   2 VAL CA   C 13  62.4   0.15 . 1 . . . .   2 Val CA   . 15089 1 
        12 . 1 1   2   2 VAL CB   C 13  32.8   0.15 . 1 . . . .   2 Val CB   . 15089 1 
        13 . 1 1   2   2 VAL CG1  C 13  20.8   0.15 . 2 . . . .   2 Val CG1  . 15089 1 
        14 . 1 1   2   2 VAL CG2  C 13  21.1   0.15 . 2 . . . .   2 Val CG2  . 15089 1 
        15 . 1 1   3   3 ASN H    H  1   8.56  0.02 . 1 . . . .   3 Asn H    . 15089 1 
        16 . 1 1   3   3 ASN HA   H  1   4.68  0.02 . 1 . . . .   3 Asn HA   . 15089 1 
        17 . 1 1   3   3 ASN HB2  H  1   2.76  0.02 . 2 . . . .   3 Asn HB2  . 15089 1 
        18 . 1 1   3   3 ASN HB3  H  1   2.67  0.02 . 2 . . . .   3 Asn HB3  . 15089 1 
        19 . 1 1   3   3 ASN HD21 H  1   7.60  0.02 . 1 . . . .   3 Asn HD21 . 15089 1 
        20 . 1 1   3   3 ASN HD22 H  1   6.90  0.02 . 1 . . . .   3 Asn HD22 . 15089 1 
        21 . 1 1   3   3 ASN C    C 13 174.9   0.15 . 1 . . . .   3 Asn C    . 15089 1 
        22 . 1 1   3   3 ASN CA   C 13  52.9   0.15 . 1 . . . .   3 Asn CA   . 15089 1 
        23 . 1 1   3   3 ASN CB   C 13  39.3   0.15 . 1 . . . .   3 Asn CB   . 15089 1 
        24 . 1 1   3   3 ASN N    N 15 123.4   0.15 . 1 . . . .   3 Asn N    . 15089 1 
        25 . 1 1   3   3 ASN ND2  N 15 112.8   0.15 . 1 . . . .   3 Asn ND2  . 15089 1 
        26 . 1 1   4   4 PHE H    H  1   8.33  0.02 . 1 . . . .   4 Phe H    . 15089 1 
        27 . 1 1   4   4 PHE HA   H  1   4.54  0.02 . 1 . . . .   4 Phe HA   . 15089 1 
        28 . 1 1   4   4 PHE HB2  H  1   2.98  0.02 . 2 . . . .   4 Phe HB2  . 15089 1 
        29 . 1 1   4   4 PHE HB3  H  1   3.12  0.02 . 2 . . . .   4 Phe HB3  . 15089 1 
        30 . 1 1   4   4 PHE HD1  H  1   7.23  0.02 . 1 . . . .   4 Phe HD1  . 15089 1 
        31 . 1 1   4   4 PHE HD2  H  1   7.23  0.02 . 1 . . . .   4 Phe HD2  . 15089 1 
        32 . 1 1   4   4 PHE HE1  H  1   7.31  0.02 . 1 . . . .   4 Phe HE1  . 15089 1 
        33 . 1 1   4   4 PHE HE2  H  1   7.31  0.02 . 1 . . . .   4 Phe HE2  . 15089 1 
        34 . 1 1   4   4 PHE HZ   H  1   7.27  0.02 . 1 . . . .   4 Phe HZ   . 15089 1 
        35 . 1 1   4   4 PHE C    C 13 175.7   0.15 . 1 . . . .   4 Phe C    . 15089 1 
        36 . 1 1   4   4 PHE CA   C 13  58.3   0.15 . 1 . . . .   4 Phe CA   . 15089 1 
        37 . 1 1   4   4 PHE CB   C 13  39.6   0.15 . 1 . . . .   4 Phe CB   . 15089 1 
        38 . 1 1   4   4 PHE CD1  C 13 131.8   0.15 . 1 . . . .   4 Phe CD1  . 15089 1 
        39 . 1 1   4   4 PHE CD2  C 13 131.8   0.15 . 1 . . . .   4 Phe CD2  . 15089 1 
        40 . 1 1   4   4 PHE CE1  C 13 131.6   0.15 . 1 . . . .   4 Phe CE1  . 15089 1 
        41 . 1 1   4   4 PHE CE2  C 13 131.6   0.15 . 1 . . . .   4 Phe CE2  . 15089 1 
        42 . 1 1   4   4 PHE CZ   C 13 130.0   0.15 . 1 . . . .   4 Phe CZ   . 15089 1 
        43 . 1 1   4   4 PHE N    N 15 121.7   0.15 . 1 . . . .   4 Phe N    . 15089 1 
        44 . 1 1   5   5 LYS H    H  1   8.24  0.02 . 1 . . . .   5 Lys H    . 15089 1 
        45 . 1 1   5   5 LYS HA   H  1   4.22  0.02 . 1 . . . .   5 Lys HA   . 15089 1 
        46 . 1 1   5   5 LYS HB2  H  1   1.77  0.02 . 2 . . . .   5 Lys HB2  . 15089 1 
        47 . 1 1   5   5 LYS HB3  H  1   1.71  0.02 . 2 . . . .   5 Lys HB3  . 15089 1 
        48 . 1 1   5   5 LYS HG2  H  1   1.32  0.02 . 1 . . . .   5 Lys HG2  . 15089 1 
        49 . 1 1   5   5 LYS HG3  H  1   1.32  0.02 . 1 . . . .   5 Lys HG3  . 15089 1 
        50 . 1 1   5   5 LYS HD2  H  1   1.65  0.02 . 1 . . . .   5 Lys HD2  . 15089 1 
        51 . 1 1   5   5 LYS HD3  H  1   1.65  0.02 . 1 . . . .   5 Lys HD3  . 15089 1 
        52 . 1 1   5   5 LYS HE2  H  1   2.98  0.02 . 1 . . . .   5 Lys HE2  . 15089 1 
        53 . 1 1   5   5 LYS HE3  H  1   2.98  0.02 . 1 . . . .   5 Lys HE3  . 15089 1 
        54 . 1 1   5   5 LYS C    C 13 176.0   0.15 . 1 . . . .   5 Lys C    . 15089 1 
        55 . 1 1   5   5 LYS CA   C 13  56.6   0.15 . 1 . . . .   5 Lys CA   . 15089 1 
        56 . 1 1   5   5 LYS CB   C 13  33.0   0.15 . 1 . . . .   5 Lys CB   . 15089 1 
        57 . 1 1   5   5 LYS CG   C 13  24.8   0.15 . 1 . . . .   5 Lys CG   . 15089 1 
        58 . 1 1   5   5 LYS CD   C 13  29.1   0.15 . 1 . . . .   5 Lys CD   . 15089 1 
        59 . 1 1   5   5 LYS CE   C 13  42.2   0.15 . 1 . . . .   5 Lys CE   . 15089 1 
        60 . 1 1   5   5 LYS N    N 15 122.3   0.15 . 1 . . . .   5 Lys N    . 15089 1 
        61 . 1 1   6   6 ASP H    H  1   8.18  0.02 . 1 . . . .   6 Asp H    . 15089 1 
        62 . 1 1   6   6 ASP HA   H  1   4.53  0.02 . 1 . . . .   6 Asp HA   . 15089 1 
        63 . 1 1   6   6 ASP HB2  H  1   2.73  0.02 . 2 . . . .   6 Asp HB2  . 15089 1 
        64 . 1 1   6   6 ASP HB3  H  1   2.62  0.02 . 2 . . . .   6 Asp HB3  . 15089 1 
        65 . 1 1   6   6 ASP C    C 13 176.2   0.15 . 1 . . . .   6 Asp C    . 15089 1 
        66 . 1 1   6   6 ASP CA   C 13  54.5   0.15 . 1 . . . .   6 Asp CA   . 15089 1 
        67 . 1 1   6   6 ASP CB   C 13  41.4   0.15 . 1 . . . .   6 Asp CB   . 15089 1 
        68 . 1 1   6   6 ASP N    N 15 121.1   0.15 . 1 . . . .   6 Asp N    . 15089 1 
        69 . 1 1   7   7 LYS H    H  1   8.27  0.02 . 1 . . . .   7 Lys H    . 15089 1 
        70 . 1 1   7   7 LYS HA   H  1   4.31  0.02 . 1 . . . .   7 Lys HA   . 15089 1 
        71 . 1 1   7   7 LYS HB2  H  1   1.75  0.02 . 2 . . . .   7 Lys HB2  . 15089 1 
        72 . 1 1   7   7 LYS HB3  H  1   1.90  0.02 . 2 . . . .   7 Lys HB3  . 15089 1 
        73 . 1 1   7   7 LYS HG2  H  1   1.44  0.02 . 1 . . . .   7 Lys HG2  . 15089 1 
        74 . 1 1   7   7 LYS HG3  H  1   1.44  0.02 . 1 . . . .   7 Lys HG3  . 15089 1 
        75 . 1 1   7   7 LYS HD2  H  1   1.66  0.02 . 1 . . . .   7 Lys HD2  . 15089 1 
        76 . 1 1   7   7 LYS HD3  H  1   1.66  0.02 . 1 . . . .   7 Lys HD3  . 15089 1 
        77 . 1 1   7   7 LYS HE2  H  1   2.99  0.02 . 1 . . . .   7 Lys HE2  . 15089 1 
        78 . 1 1   7   7 LYS HE3  H  1   2.99  0.02 . 1 . . . .   7 Lys HE3  . 15089 1 
        79 . 1 1   7   7 LYS C    C 13 176.5   0.15 . 1 . . . .   7 Lys C    . 15089 1 
        80 . 1 1   7   7 LYS CA   C 13  56.4   0.15 . 1 . . . .   7 Lys CA   . 15089 1 
        81 . 1 1   7   7 LYS CB   C 13  32.7   0.15 . 1 . . . .   7 Lys CB   . 15089 1 
        82 . 1 1   7   7 LYS CG   C 13  24.7   0.15 . 1 . . . .   7 Lys CG   . 15089 1 
        83 . 1 1   7   7 LYS CD   C 13  29.1   0.15 . 1 . . . .   7 Lys CD   . 15089 1 
        84 . 1 1   7   7 LYS CE   C 13  42.2   0.15 . 1 . . . .   7 Lys CE   . 15089 1 
        85 . 1 1   7   7 LYS N    N 15 121.8   0.15 . 1 . . . .   7 Lys N    . 15089 1 
        86 . 1 1   8   8 SER H    H  1   8.36  0.02 . 1 . . . .   8 Ser H    . 15089 1 
        87 . 1 1   8   8 SER HA   H  1   4.39  0.02 . 1 . . . .   8 Ser HA   . 15089 1 
        88 . 1 1   8   8 SER HB2  H  1   3.85  0.02 . 1 . . . .   8 Ser HB2  . 15089 1 
        89 . 1 1   8   8 SER HB3  H  1   3.85  0.02 . 1 . . . .   8 Ser HB3  . 15089 1 
        90 . 1 1   8   8 SER C    C 13 174.1   0.15 . 1 . . . .   8 Ser C    . 15089 1 
        91 . 1 1   8   8 SER CA   C 13  58.7   0.15 . 1 . . . .   8 Ser CA   . 15089 1 
        92 . 1 1   8   8 SER CB   C 13  63.9   0.15 . 1 . . . .   8 Ser CB   . 15089 1 
        93 . 1 1   8   8 SER N    N 15 116.7   0.15 . 1 . . . .   8 Ser N    . 15089 1 
        94 . 1 1   9   9 MET H    H  1   8.31  0.02 . 1 . . . .   9 Met H    . 15089 1 
        95 . 1 1   9   9 MET HA   H  1   4.75  0.02 . 1 . . . .   9 Met HA   . 15089 1 
        96 . 1 1   9   9 MET HB2  H  1   1.99  0.02 . 1 . . . .   9 Met HB2  . 15089 1 
        97 . 1 1   9   9 MET HB3  H  1   1.99  0.02 . 1 . . . .   9 Met HB3  . 15089 1 
        98 . 1 1   9   9 MET HG2  H  1   2.51  0.02 . 1 . . . .   9 Met HG2  . 15089 1 
        99 . 1 1   9   9 MET HG3  H  1   2.51  0.02 . 1 . . . .   9 Met HG3  . 15089 1 
       100 . 1 1   9   9 MET C    C 13 173.7   0.15 . 1 . . . .   9 Met C    . 15089 1 
       101 . 1 1   9   9 MET CA   C 13  53.5   0.15 . 1 . . . .   9 Met CA   . 15089 1 
       102 . 1 1   9   9 MET CB   C 13  33.2   0.15 . 1 . . . .   9 Met CB   . 15089 1 
       103 . 1 1   9   9 MET CG   C 13  31.7   0.15 . 1 . . . .   9 Met CG   . 15089 1 
       104 . 1 1   9   9 MET N    N 15 123.3   0.15 . 1 . . . .   9 Met N    . 15089 1 
       105 . 1 1  10  10 PRO HA   H  1   4.54  0.02 . 1 . . . .  10 Pro HA   . 15089 1 
       106 . 1 1  10  10 PRO HB2  H  1   2.28  0.02 . 2 . . . .  10 Pro HB2  . 15089 1 
       107 . 1 1  10  10 PRO HB3  H  1   1.75  0.02 . 2 . . . .  10 Pro HB3  . 15089 1 
       108 . 1 1  10  10 PRO HG2  H  1   1.96  0.02 . 1 . . . .  10 Pro HG2  . 15089 1 
       109 . 1 1  10  10 PRO HG3  H  1   1.96  0.02 . 1 . . . .  10 Pro HG3  . 15089 1 
       110 . 1 1  10  10 PRO HD2  H  1   3.60  0.02 . 2 . . . .  10 Pro HD2  . 15089 1 
       111 . 1 1  10  10 PRO HD3  H  1   3.91  0.02 . 2 . . . .  10 Pro HD3  . 15089 1 
       112 . 1 1  10  10 PRO CA   C 13  63.1   0.15 . 1 . . . .  10 Pro CA   . 15089 1 
       113 . 1 1  10  10 PRO CB   C 13  32.2   0.15 . 1 . . . .  10 Pro CB   . 15089 1 
       114 . 1 1  10  10 PRO CG   C 13  27.7   0.15 . 1 . . . .  10 Pro CG   . 15089 1 
       115 . 1 1  10  10 PRO CD   C 13  50.9   0.15 . 1 . . . .  10 Pro CD   . 15089 1 
       116 . 1 1  11  11 THR H    H  1   8.52  0.02 . 1 . . . .  11 Thr H    . 15089 1 
       117 . 1 1  11  11 THR HA   H  1   4.19  0.02 . 1 . . . .  11 Thr HA   . 15089 1 
       118 . 1 1  11  11 THR HB   H  1   4.39  0.02 . 1 . . . .  11 Thr HB   . 15089 1 
       119 . 1 1  11  11 THR HG21 H  1   1.31  0.02 . 1 . . . .  11 Thr HG2  . 15089 1 
       120 . 1 1  11  11 THR HG22 H  1   1.31  0.02 . 1 . . . .  11 Thr HG2  . 15089 1 
       121 . 1 1  11  11 THR HG23 H  1   1.31  0.02 . 1 . . . .  11 Thr HG2  . 15089 1 
       122 . 1 1  11  11 THR C    C 13 176.6   0.15 . 1 . . . .  11 Thr C    . 15089 1 
       123 . 1 1  11  11 THR CA   C 13  63.5   0.15 . 1 . . . .  11 Thr CA   . 15089 1 
       124 . 1 1  11  11 THR CB   C 13  69.7   0.15 . 1 . . . .  11 Thr CB   . 15089 1 
       125 . 1 1  11  11 THR CG2  C 13  22.8   0.15 . 1 . . . .  11 Thr CG2  . 15089 1 
       126 . 1 1  12  12 ALA H    H  1   9.18  0.02 . 1 . . . .  12 Ala H    . 15089 1 
       127 . 1 1  12  12 ALA HA   H  1   3.96  0.02 . 1 . . . .  12 Ala HA   . 15089 1 
       128 . 1 1  12  12 ALA HB1  H  1   1.31  0.02 . 1 . . . .  12 Ala HB   . 15089 1 
       129 . 1 1  12  12 ALA HB2  H  1   1.31  0.02 . 1 . . . .  12 Ala HB   . 15089 1 
       130 . 1 1  12  12 ALA HB3  H  1   1.31  0.02 . 1 . . . .  12 Ala HB   . 15089 1 
       131 . 1 1  12  12 ALA C    C 13 178.5   0.15 . 1 . . . .  12 Ala C    . 15089 1 
       132 . 1 1  12  12 ALA CA   C 13  55.6   0.15 . 1 . . . .  12 Ala CA   . 15089 1 
       133 . 1 1  12  12 ALA CB   C 13  19.2   0.15 . 1 . . . .  12 Ala CB   . 15089 1 
       134 . 1 1  12  12 ALA N    N 15 122.3   0.15 . 1 . . . .  12 Ala N    . 15089 1 
       135 . 1 1  13  13 ILE H    H  1   7.18  0.02 . 1 . . . .  13 Ile H    . 15089 1 
       136 . 1 1  13  13 ILE HA   H  1   3.52  0.02 . 1 . . . .  13 Ile HA   . 15089 1 
       137 . 1 1  13  13 ILE HB   H  1   1.81  0.02 . 1 . . . .  13 Ile HB   . 15089 1 
       138 . 1 1  13  13 ILE HG12 H  1   1.57  0.02 . 2 . . . .  13 Ile HG12 . 15089 1 
       139 . 1 1  13  13 ILE HG13 H  1   1.03  0.02 . 2 . . . .  13 Ile HG13 . 15089 1 
       140 . 1 1  13  13 ILE HG21 H  1   0.94  0.02 . 1 . . . .  13 Ile HG2  . 15089 1 
       141 . 1 1  13  13 ILE HG22 H  1   0.94  0.02 . 1 . . . .  13 Ile HG2  . 15089 1 
       142 . 1 1  13  13 ILE HG23 H  1   0.94  0.02 . 1 . . . .  13 Ile HG2  . 15089 1 
       143 . 1 1  13  13 ILE HD11 H  1   0.86  0.02 . 1 . . . .  13 Ile HD1  . 15089 1 
       144 . 1 1  13  13 ILE HD12 H  1   0.86  0.02 . 1 . . . .  13 Ile HD1  . 15089 1 
       145 . 1 1  13  13 ILE HD13 H  1   0.86  0.02 . 1 . . . .  13 Ile HD1  . 15089 1 
       146 . 1 1  13  13 ILE C    C 13 177.1   0.15 . 1 . . . .  13 Ile C    . 15089 1 
       147 . 1 1  13  13 ILE CA   C 13  64.8   0.15 . 1 . . . .  13 Ile CA   . 15089 1 
       148 . 1 1  13  13 ILE CB   C 13  37.7   0.15 . 1 . . . .  13 Ile CB   . 15089 1 
       149 . 1 1  13  13 ILE CG1  C 13  29.7   0.15 . 1 . . . .  13 Ile CG1  . 15089 1 
       150 . 1 1  13  13 ILE CG2  C 13  17.9   0.15 . 1 . . . .  13 Ile CG2  . 15089 1 
       151 . 1 1  13  13 ILE CD1  C 13  13.3   0.15 . 1 . . . .  13 Ile CD1  . 15089 1 
       152 . 1 1  13  13 ILE N    N 15 114.8   0.15 . 1 . . . .  13 Ile N    . 15089 1 
       153 . 1 1  14  14 GLU H    H  1   7.41  0.02 . 1 . . . .  14 Glu H    . 15089 1 
       154 . 1 1  14  14 GLU HA   H  1   3.82  0.02 . 1 . . . .  14 Glu HA   . 15089 1 
       155 . 1 1  14  14 GLU HB2  H  1   2.05  0.02 . 1 . . . .  14 Glu HB2  . 15089 1 
       156 . 1 1  14  14 GLU HB3  H  1   2.05  0.02 . 1 . . . .  14 Glu HB3  . 15089 1 
       157 . 1 1  14  14 GLU HG2  H  1   2.23  0.02 . 2 . . . .  14 Glu HG2  . 15089 1 
       158 . 1 1  14  14 GLU HG3  H  1   2.17  0.02 . 2 . . . .  14 Glu HG3  . 15089 1 
       159 . 1 1  14  14 GLU C    C 13 178.4   0.15 . 1 . . . .  14 Glu C    . 15089 1 
       160 . 1 1  14  14 GLU CA   C 13  59.7   0.15 . 1 . . . .  14 Glu CA   . 15089 1 
       161 . 1 1  14  14 GLU CB   C 13  29.4   0.15 . 1 . . . .  14 Glu CB   . 15089 1 
       162 . 1 1  14  14 GLU CG   C 13  36.4   0.15 . 1 . . . .  14 Glu CG   . 15089 1 
       163 . 1 1  14  14 GLU N    N 15 119.3   0.15 . 1 . . . .  14 Glu N    . 15089 1 
       164 . 1 1  15  15 LYS H    H  1   8.02  0.02 . 1 . . . .  15 Lys H    . 15089 1 
       165 . 1 1  15  15 LYS HA   H  1   3.93  0.02 . 1 . . . .  15 Lys HA   . 15089 1 
       166 . 1 1  15  15 LYS HB2  H  1   1.71  0.02 . 2 . . . .  15 Lys HB2  . 15089 1 
       167 . 1 1  15  15 LYS HB3  H  1   1.58  0.02 . 2 . . . .  15 Lys HB3  . 15089 1 
       168 . 1 1  15  15 LYS HG2  H  1   1.06  0.02 . 2 . . . .  15 Lys HG2  . 15089 1 
       169 . 1 1  15  15 LYS HG3  H  1   0.83  0.02 . 2 . . . .  15 Lys HG3  . 15089 1 
       170 . 1 1  15  15 LYS HD2  H  1   1.50  0.02 . 1 . . . .  15 Lys HD2  . 15089 1 
       171 . 1 1  15  15 LYS HD3  H  1   1.50  0.02 . 1 . . . .  15 Lys HD3  . 15089 1 
       172 . 1 1  15  15 LYS HE2  H  1   2.73  0.02 . 2 . . . .  15 Lys HE2  . 15089 1 
       173 . 1 1  15  15 LYS HE3  H  1   2.63  0.02 . 2 . . . .  15 Lys HE3  . 15089 1 
       174 . 1 1  15  15 LYS C    C 13 177.7   0.15 . 1 . . . .  15 Lys C    . 15089 1 
       175 . 1 1  15  15 LYS CA   C 13  57.0   0.15 . 1 . . . .  15 Lys CA   . 15089 1 
       176 . 1 1  15  15 LYS CB   C 13  30.9   0.15 . 1 . . . .  15 Lys CB   . 15089 1 
       177 . 1 1  15  15 LYS CG   C 13  23.5   0.15 . 1 . . . .  15 Lys CG   . 15089 1 
       178 . 1 1  15  15 LYS CD   C 13  27.4   0.15 . 1 . . . .  15 Lys CD   . 15089 1 
       179 . 1 1  15  15 LYS CE   C 13  41.7   0.15 . 1 . . . .  15 Lys CE   . 15089 1 
       180 . 1 1  15  15 LYS N    N 15 117.9   0.15 . 1 . . . .  15 Lys N    . 15089 1 
       181 . 1 1  16  16 ALA H    H  1   8.05  0.02 . 1 . . . .  16 Ala H    . 15089 1 
       182 . 1 1  16  16 ALA HA   H  1   4.01  0.02 . 1 . . . .  16 Ala HA   . 15089 1 
       183 . 1 1  16  16 ALA HB1  H  1   1.53  0.02 . 1 . . . .  16 Ala HB   . 15089 1 
       184 . 1 1  16  16 ALA HB2  H  1   1.53  0.02 . 1 . . . .  16 Ala HB   . 15089 1 
       185 . 1 1  16  16 ALA HB3  H  1   1.53  0.02 . 1 . . . .  16 Ala HB   . 15089 1 
       186 . 1 1  16  16 ALA C    C 13 179.6   0.15 . 1 . . . .  16 Ala C    . 15089 1 
       187 . 1 1  16  16 ALA CA   C 13  55.9   0.15 . 1 . . . .  16 Ala CA   . 15089 1 
       188 . 1 1  16  16 ALA CB   C 13  19.1   0.15 . 1 . . . .  16 Ala CB   . 15089 1 
       189 . 1 1  16  16 ALA N    N 15 121.1   0.15 . 1 . . . .  16 Ala N    . 15089 1 
       190 . 1 1  17  17 LEU H    H  1   8.26  0.02 . 1 . . . .  17 Leu H    . 15089 1 
       191 . 1 1  17  17 LEU HA   H  1   4.22  0.02 . 1 . . . .  17 Leu HA   . 15089 1 
       192 . 1 1  17  17 LEU HB2  H  1   2.17  0.02 . 2 . . . .  17 Leu HB2  . 15089 1 
       193 . 1 1  17  17 LEU HB3  H  1   1.42  0.02 . 2 . . . .  17 Leu HB3  . 15089 1 
       194 . 1 1  17  17 LEU HG   H  1   1.99  0.02 . 1 . . . .  17 Leu HG   . 15089 1 
       195 . 1 1  17  17 LEU HD11 H  1   0.80  0.02 . 1 . . . .  17 Leu HD1  . 15089 1 
       196 . 1 1  17  17 LEU HD12 H  1   0.80  0.02 . 1 . . . .  17 Leu HD1  . 15089 1 
       197 . 1 1  17  17 LEU HD13 H  1   0.80  0.02 . 1 . . . .  17 Leu HD1  . 15089 1 
       198 . 1 1  17  17 LEU HD21 H  1   0.91  0.02 . 1 . . . .  17 Leu HD2  . 15089 1 
       199 . 1 1  17  17 LEU HD22 H  1   0.91  0.02 . 1 . . . .  17 Leu HD2  . 15089 1 
       200 . 1 1  17  17 LEU HD23 H  1   0.91  0.02 . 1 . . . .  17 Leu HD2  . 15089 1 
       201 . 1 1  17  17 LEU C    C 13 179.7   0.15 . 1 . . . .  17 Leu C    . 15089 1 
       202 . 1 1  17  17 LEU CA   C 13  57.9   0.15 . 1 . . . .  17 Leu CA   . 15089 1 
       203 . 1 1  17  17 LEU CB   C 13  41.1   0.15 . 1 . . . .  17 Leu CB   . 15089 1 
       204 . 1 1  17  17 LEU CG   C 13  26.8   0.15 . 1 . . . .  17 Leu CG   . 15089 1 
       205 . 1 1  17  17 LEU CD1  C 13  26.5   0.15 . 1 . . . .  17 Leu CD1  . 15089 1 
       206 . 1 1  17  17 LEU CD2  C 13  22.6   0.15 . 1 . . . .  17 Leu CD2  . 15089 1 
       207 . 1 1  17  17 LEU N    N 15 116.0   0.15 . 1 . . . .  17 Leu N    . 15089 1 
       208 . 1 1  18  18 ASP H    H  1   8.48  0.02 . 1 . . . .  18 Asp H    . 15089 1 
       209 . 1 1  18  18 ASP HA   H  1   4.52  0.02 . 1 . . . .  18 Asp HA   . 15089 1 
       210 . 1 1  18  18 ASP HB2  H  1   2.66  0.02 . 1 . . . .  18 Asp HB2  . 15089 1 
       211 . 1 1  18  18 ASP HB3  H  1   2.66  0.02 . 1 . . . .  18 Asp HB3  . 15089 1 
       212 . 1 1  18  18 ASP C    C 13 180.5   0.15 . 1 . . . .  18 Asp C    . 15089 1 
       213 . 1 1  18  18 ASP CA   C 13  57.3   0.15 . 1 . . . .  18 Asp CA   . 15089 1 
       214 . 1 1  18  18 ASP CB   C 13  39.7   0.15 . 1 . . . .  18 Asp CB   . 15089 1 
       215 . 1 1  18  18 ASP N    N 15 123.0   0.15 . 1 . . . .  18 Asp N    . 15089 1 
       216 . 1 1  19  19 PHE H    H  1   8.47  0.02 . 1 . . . .  19 Phe H    . 15089 1 
       217 . 1 1  19  19 PHE HA   H  1   4.74  0.02 . 1 . . . .  19 Phe HA   . 15089 1 
       218 . 1 1  19  19 PHE HB2  H  1   3.10  0.02 . 2 . . . .  19 Phe HB2  . 15089 1 
       219 . 1 1  19  19 PHE HB3  H  1   3.65  0.02 . 2 . . . .  19 Phe HB3  . 15089 1 
       220 . 1 1  19  19 PHE HD1  H  1   7.29  0.02 . 1 . . . .  19 Phe HD1  . 15089 1 
       221 . 1 1  19  19 PHE HD2  H  1   7.29  0.02 . 1 . . . .  19 Phe HD2  . 15089 1 
       222 . 1 1  19  19 PHE HE1  H  1   7.37  0.02 . 1 . . . .  19 Phe HE1  . 15089 1 
       223 . 1 1  19  19 PHE HE2  H  1   7.37  0.02 . 1 . . . .  19 Phe HE2  . 15089 1 
       224 . 1 1  19  19 PHE HZ   H  1   7.21  0.02 . 1 . . . .  19 Phe HZ   . 15089 1 
       225 . 1 1  19  19 PHE C    C 13 180.6   0.15 . 1 . . . .  19 Phe C    . 15089 1 
       226 . 1 1  19  19 PHE CA   C 13  58.6   0.15 . 1 . . . .  19 Phe CA   . 15089 1 
       227 . 1 1  19  19 PHE CB   C 13  38.3   0.15 . 1 . . . .  19 Phe CB   . 15089 1 
       228 . 1 1  19  19 PHE CD1  C 13 130.5   0.15 . 1 . . . .  19 Phe CD1  . 15089 1 
       229 . 1 1  19  19 PHE CD2  C 13 130.5   0.15 . 1 . . . .  19 Phe CD2  . 15089 1 
       230 . 1 1  19  19 PHE CE1  C 13 131.1   0.15 . 1 . . . .  19 Phe CE1  . 15089 1 
       231 . 1 1  19  19 PHE CE2  C 13 131.1   0.15 . 1 . . . .  19 Phe CE2  . 15089 1 
       232 . 1 1  19  19 PHE CZ   C 13 129.5   0.15 . 1 . . . .  19 Phe CZ   . 15089 1 
       233 . 1 1  19  19 PHE N    N 15 120.3   0.15 . 1 . . . .  19 Phe N    . 15089 1 
       234 . 1 1  20  20 ILE H    H  1   8.41  0.02 . 1 . . . .  20 Ile H    . 15089 1 
       235 . 1 1  20  20 ILE HA   H  1   4.00  0.02 . 1 . . . .  20 Ile HA   . 15089 1 
       236 . 1 1  20  20 ILE HB   H  1   2.08  0.02 . 1 . . . .  20 Ile HB   . 15089 1 
       237 . 1 1  20  20 ILE HG12 H  1   1.01  0.02 . 2 . . . .  20 Ile HG12 . 15089 1 
       238 . 1 1  20  20 ILE HG13 H  1   2.16  0.02 . 2 . . . .  20 Ile HG13 . 15089 1 
       239 . 1 1  20  20 ILE HG21 H  1   0.83  0.02 . 1 . . . .  20 Ile HG2  . 15089 1 
       240 . 1 1  20  20 ILE HG22 H  1   0.83  0.02 . 1 . . . .  20 Ile HG2  . 15089 1 
       241 . 1 1  20  20 ILE HG23 H  1   0.83  0.02 . 1 . . . .  20 Ile HG2  . 15089 1 
       242 . 1 1  20  20 ILE HD11 H  1   0.91  0.02 . 1 . . . .  20 Ile HD1  . 15089 1 
       243 . 1 1  20  20 ILE HD12 H  1   0.91  0.02 . 1 . . . .  20 Ile HD1  . 15089 1 
       244 . 1 1  20  20 ILE HD13 H  1   0.91  0.02 . 1 . . . .  20 Ile HD1  . 15089 1 
       245 . 1 1  20  20 ILE C    C 13 177.2   0.15 . 1 . . . .  20 Ile C    . 15089 1 
       246 . 1 1  20  20 ILE CA   C 13  65.0   0.15 . 1 . . . .  20 Ile CA   . 15089 1 
       247 . 1 1  20  20 ILE CB   C 13  38.2   0.15 . 1 . . . .  20 Ile CB   . 15089 1 
       248 . 1 1  20  20 ILE CG1  C 13  29.8   0.15 . 1 . . . .  20 Ile CG1  . 15089 1 
       249 . 1 1  20  20 ILE CG2  C 13  18.2   0.15 . 1 . . . .  20 Ile CG2  . 15089 1 
       250 . 1 1  20  20 ILE CD1  C 13  12.5   0.15 . 1 . . . .  20 Ile CD1  . 15089 1 
       251 . 1 1  20  20 ILE N    N 15 122.6   0.15 . 1 . . . .  20 Ile N    . 15089 1 
       252 . 1 1  21  21 GLY H    H  1   8.87  0.02 . 1 . . . .  21 Gly H    . 15089 1 
       253 . 1 1  21  21 GLY HA2  H  1   4.19  0.02 . 2 . . . .  21 Gly HA2  . 15089 1 
       254 . 1 1  21  21 GLY HA3  H  1   3.73  0.02 . 2 . . . .  21 Gly HA3  . 15089 1 
       255 . 1 1  21  21 GLY C    C 13 174.8   0.15 . 1 . . . .  21 Gly C    . 15089 1 
       256 . 1 1  21  21 GLY CA   C 13  47.0   0.15 . 1 . . . .  21 Gly CA   . 15089 1 
       257 . 1 1  21  21 GLY N    N 15 105.8   0.15 . 1 . . . .  21 Gly N    . 15089 1 
       258 . 1 1  22  22 GLY H    H  1   7.56  0.02 . 1 . . . .  22 Gly H    . 15089 1 
       259 . 1 1  22  22 GLY HA2  H  1   4.39  0.02 . 2 . . . .  22 Gly HA2  . 15089 1 
       260 . 1 1  22  22 GLY HA3  H  1   3.78  0.02 . 2 . . . .  22 Gly HA3  . 15089 1 
       261 . 1 1  22  22 GLY C    C 13 175.0   0.15 . 1 . . . .  22 Gly C    . 15089 1 
       262 . 1 1  22  22 GLY CA   C 13  45.1   0.15 . 1 . . . .  22 Gly CA   . 15089 1 
       263 . 1 1  22  22 GLY N    N 15 106.4   0.15 . 1 . . . .  22 Gly N    . 15089 1 
       264 . 1 1  23  23 MET H    H  1   7.54  0.02 . 1 . . . .  23 Met H    . 15089 1 
       265 . 1 1  23  23 MET HA   H  1   4.44  0.02 . 1 . . . .  23 Met HA   . 15089 1 
       266 . 1 1  23  23 MET HB2  H  1   2.14  0.02 . 2 . . . .  23 Met HB2  . 15089 1 
       267 . 1 1  23  23 MET HB3  H  1   1.98  0.02 . 2 . . . .  23 Met HB3  . 15089 1 
       268 . 1 1  23  23 MET HG2  H  1   2.99  0.02 . 2 . . . .  23 Met HG2  . 15089 1 
       269 . 1 1  23  23 MET HG3  H  1   2.46  0.02 . 2 . . . .  23 Met HG3  . 15089 1 
       270 . 1 1  23  23 MET C    C 13 174.3   0.15 . 1 . . . .  23 Met C    . 15089 1 
       271 . 1 1  23  23 MET CA   C 13  56.1   0.15 . 1 . . . .  23 Met CA   . 15089 1 
       272 . 1 1  23  23 MET CB   C 13  31.4   0.15 . 1 . . . .  23 Met CB   . 15089 1 
       273 . 1 1  23  23 MET CG   C 13  34.4   0.15 . 1 . . . .  23 Met CG   . 15089 1 
       274 . 1 1  23  23 MET N    N 15 120.9   0.15 . 1 . . . .  23 Met N    . 15089 1 
       275 . 1 1  24  24 ASN H    H  1   8.25  0.02 . 1 . . . .  24 Asn H    . 15089 1 
       276 . 1 1  24  24 ASN HA   H  1   4.73  0.02 . 1 . . . .  24 Asn HA   . 15089 1 
       277 . 1 1  24  24 ASN HB2  H  1   2.56  0.02 . 2 . . . .  24 Asn HB2  . 15089 1 
       278 . 1 1  24  24 ASN HB3  H  1   2.81  0.02 . 2 . . . .  24 Asn HB3  . 15089 1 
       279 . 1 1  24  24 ASN HD21 H  1   7.64  0.02 . 1 . . . .  24 Asn HD21 . 15089 1 
       280 . 1 1  24  24 ASN HD22 H  1   6.88  0.02 . 1 . . . .  24 Asn HD22 . 15089 1 
       281 . 1 1  24  24 ASN C    C 13 175.9   0.15 . 1 . . . .  24 Asn C    . 15089 1 
       282 . 1 1  24  24 ASN CA   C 13  52.7   0.15 . 1 . . . .  24 Asn CA   . 15089 1 
       283 . 1 1  24  24 ASN CB   C 13  36.2   0.15 . 1 . . . .  24 Asn CB   . 15089 1 
       284 . 1 1  24  24 ASN N    N 15 117.2   0.15 . 1 . . . .  24 Asn N    . 15089 1 
       285 . 1 1  24  24 ASN ND2  N 15 112.3   0.15 . 1 . . . .  24 Asn ND2  . 15089 1 
       286 . 1 1  25  25 THR H    H  1   7.33  0.02 . 1 . . . .  25 Thr H    . 15089 1 
       287 . 1 1  25  25 THR HA   H  1   3.45  0.02 . 1 . . . .  25 Thr HA   . 15089 1 
       288 . 1 1  25  25 THR HB   H  1   3.42  0.02 . 1 . . . .  25 Thr HB   . 15089 1 
       289 . 1 1  25  25 THR HG21 H  1   0.03  0.02 . 1 . . . .  25 Thr HG2  . 15089 1 
       290 . 1 1  25  25 THR HG22 H  1   0.03  0.02 . 1 . . . .  25 Thr HG2  . 15089 1 
       291 . 1 1  25  25 THR HG23 H  1   0.03  0.02 . 1 . . . .  25 Thr HG2  . 15089 1 
       292 . 1 1  25  25 THR C    C 13 173.9   0.15 . 1 . . . .  25 Thr C    . 15089 1 
       293 . 1 1  25  25 THR CA   C 13  61.9   0.15 . 1 . . . .  25 Thr CA   . 15089 1 
       294 . 1 1  25  25 THR CB   C 13  69.1   0.15 . 1 . . . .  25 Thr CB   . 15089 1 
       295 . 1 1  25  25 THR CG2  C 13  20.8   0.15 . 1 . . . .  25 Thr CG2  . 15089 1 
       296 . 1 1  25  25 THR N    N 15 114.2   0.15 . 1 . . . .  25 Thr N    . 15089 1 
       297 . 1 1  26  26 SER H    H  1   7.776 0.02 . 1 . . . .  26 Ser H    . 15089 1 
       298 . 1 1  26  26 SER HA   H  1   4.52  0.02 . 1 . . . .  26 Ser HA   . 15089 1 
       299 . 1 1  26  26 SER HB2  H  1   3.90  0.02 . 2 . . . .  26 Ser HB2  . 15089 1 
       300 . 1 1  26  26 SER HB3  H  1   4.03  0.02 . 2 . . . .  26 Ser HB3  . 15089 1 
       301 . 1 1  26  26 SER C    C 13 174.6   0.15 . 1 . . . .  26 Ser C    . 15089 1 
       302 . 1 1  26  26 SER CA   C 13  58.80  0.15 . 1 . . . .  26 Ser CA   . 15089 1 
       303 . 1 1  26  26 SER CB   C 13  64.033 0.15 . 1 . . . .  26 Ser CB   . 15089 1 
       304 . 1 1  26  26 SER N    N 15 114.779 0.15 . 1 . . . .  26 Ser N    . 15089 1 
       305 . 1 1  27  27 ALA H    H  1   7.17  0.02 . 1 . . . .  27 Ala H    . 15089 1 
       306 . 1 1  27  27 ALA HA   H  1   4.28  0.02 . 1 . . . .  27 Ala HA   . 15089 1 
       307 . 1 1  27  27 ALA HB1  H  1   1.36  0.02 . 1 . . . .  27 Ala HB   . 15089 1 
       308 . 1 1  27  27 ALA HB2  H  1   1.36  0.02 . 1 . . . .  27 Ala HB   . 15089 1 
       309 . 1 1  27  27 ALA HB3  H  1   1.36  0.02 . 1 . . . .  27 Ala HB   . 15089 1 
       310 . 1 1  27  27 ALA C    C 13 176.0   0.15 . 1 . . . .  27 Ala C    . 15089 1 
       311 . 1 1  27  27 ALA CA   C 13  52.4   0.15 . 1 . . . .  27 Ala CA   . 15089 1 
       312 . 1 1  27  27 ALA CB   C 13  20.2   0.15 . 1 . . . .  27 Ala CB   . 15089 1 
       313 . 1 1  28  28 SER H    H  1   8.22  0.02 . 1 . . . .  28 Ser H    . 15089 1 
       314 . 1 1  28  28 SER HA   H  1   4.23  0.02 . 1 . . . .  28 Ser HA   . 15089 1 
       315 . 1 1  28  28 SER HB2  H  1   3.89  0.02 . 1 . . . .  28 Ser HB2  . 15089 1 
       316 . 1 1  28  28 SER HB3  H  1   3.89  0.02 . 1 . . . .  28 Ser HB3  . 15089 1 
       317 . 1 1  28  28 SER C    C 13 174.1   0.15 . 1 . . . .  28 Ser C    . 15089 1 
       318 . 1 1  28  28 SER CA   C 13  59.9   0.15 . 1 . . . .  28 Ser CA   . 15089 1 
       319 . 1 1  28  28 SER CB   C 13  63.5   0.15 . 1 . . . .  28 Ser CB   . 15089 1 
       320 . 1 1  28  28 SER N    N 15 114.8   0.15 . 1 . . . .  28 Ser N    . 15089 1 
       321 . 1 1  29  29 VAL H    H  1   7.52  0.02 . 1 . . . .  29 Val H    . 15089 1 
       322 . 1 1  29  29 VAL HA   H  1   4.32  0.02 . 1 . . . .  29 Val HA   . 15089 1 
       323 . 1 1  29  29 VAL HB   H  1   2.00  0.02 . 1 . . . .  29 Val HB   . 15089 1 
       324 . 1 1  29  29 VAL HG11 H  1   0.92  0.02 . 2 . . . .  29 Val HG1  . 15089 1 
       325 . 1 1  29  29 VAL HG12 H  1   0.92  0.02 . 2 . . . .  29 Val HG1  . 15089 1 
       326 . 1 1  29  29 VAL HG13 H  1   0.92  0.02 . 2 . . . .  29 Val HG1  . 15089 1 
       327 . 1 1  29  29 VAL HG21 H  1   0.90  0.02 . 2 . . . .  29 Val HG2  . 15089 1 
       328 . 1 1  29  29 VAL HG22 H  1   0.90  0.02 . 2 . . . .  29 Val HG2  . 15089 1 
       329 . 1 1  29  29 VAL HG23 H  1   0.90  0.02 . 2 . . . .  29 Val HG2  . 15089 1 
       330 . 1 1  29  29 VAL C    C 13 173.6   0.15 . 1 . . . .  29 Val C    . 15089 1 
       331 . 1 1  29  29 VAL CA   C 13  59.3   0.15 . 1 . . . .  29 Val CA   . 15089 1 
       332 . 1 1  29  29 VAL CB   C 13  33.2   0.15 . 1 . . . .  29 Val CB   . 15089 1 
       333 . 1 1  29  29 VAL CG1  C 13  21.0   0.15 . 2 . . . .  29 Val CG1  . 15089 1 
       334 . 1 1  29  29 VAL CG2  C 13  20.9   0.15 . 2 . . . .  29 Val CG2  . 15089 1 
       335 . 1 1  29  29 VAL N    N 15 119.8   0.15 . 1 . . . .  29 Val N    . 15089 1 
       336 . 1 1  30  30 PRO HA   H  1   4.63  0.02 . 1 . . . .  30 Pro HA   . 15089 1 
       337 . 1 1  30  30 PRO HB2  H  1   2.37  0.02 . 2 . . . .  30 Pro HB2  . 15089 1 
       338 . 1 1  30  30 PRO HB3  H  1   2.07  0.02 . 2 . . . .  30 Pro HB3  . 15089 1 
       339 . 1 1  30  30 PRO HG2  H  1   1.93  0.02 . 1 . . . .  30 Pro HG2  . 15089 1 
       340 . 1 1  30  30 PRO HG3  H  1   1.93  0.02 . 1 . . . .  30 Pro HG3  . 15089 1 
       341 . 1 1  30  30 PRO HD2  H  1   3.77  0.02 . 2 . . . .  30 Pro HD2  . 15089 1 
       342 . 1 1  30  30 PRO HD3  H  1   3.73  0.02 . 2 . . . .  30 Pro HD3  . 15089 1 
       343 . 1 1  30  30 PRO CA   C 13  63.0   0.15 . 1 . . . .  30 Pro CA   . 15089 1 
       344 . 1 1  30  30 PRO CB   C 13  31.9   0.15 . 1 . . . .  30 Pro CB   . 15089 1 
       345 . 1 1  30  30 PRO CG   C 13  27.4   0.15 . 1 . . . .  30 Pro CG   . 15089 1 
       346 . 1 1  30  30 PRO CD   C 13  50.7   0.15 . 1 . . . .  30 Pro CD   . 15089 1 
       347 . 1 1  31  31 HIS H    H  1   9.38  0.02 . 1 . . . .  31 His H    . 15089 1 
       348 . 1 1  31  31 HIS HA   H  1   4.55  0.02 . 1 . . . .  31 His HA   . 15089 1 
       349 . 1 1  31  31 HIS HB2  H  1   3.28  0.02 . 1 . . . .  31 His HB2  . 15089 1 
       350 . 1 1  31  31 HIS HB3  H  1   3.28  0.02 . 1 . . . .  31 His HB3  . 15089 1 
       351 . 1 1  31  31 HIS HD2  H  1   7.29  0.02 . 1 . . . .  31 His HD2  . 15089 1 
       352 . 1 1  31  31 HIS CA   C 13  56.3   0.15 . 1 . . . .  31 His CA   . 15089 1 
       353 . 1 1  31  31 HIS CB   C 13  30.6   0.15 . 1 . . . .  31 His CB   . 15089 1 
       354 . 1 1  31  31 HIS CD2  C 13 119.3   0.15 . 1 . . . .  31 His CD2  . 15089 1 
       355 . 1 1  32  32 SER H    H  1   8.80  0.02 . 1 . . . .  32 Ser H    . 15089 1 
       356 . 1 1  32  32 SER HA   H  1   4.24  0.02 . 1 . . . .  32 Ser HA   . 15089 1 
       357 . 1 1  32  32 SER HB2  H  1   3.96  0.02 . 1 . . . .  32 Ser HB2  . 15089 1 
       358 . 1 1  32  32 SER HB3  H  1   3.96  0.02 . 1 . . . .  32 Ser HB3  . 15089 1 
       359 . 1 1  32  32 SER CA   C 13  61.8   0.15 . 1 . . . .  32 Ser CA   . 15089 1 
       360 . 1 1  32  32 SER CB   C 13  63.3   0.15 . 1 . . . .  32 Ser CB   . 15089 1 
       361 . 1 1  33  33 MET HE1  H  1   1.96  0.02 . 1 . . . .  33 Met HE   . 15089 1 
       362 . 1 1  33  33 MET HE2  H  1   1.96  0.02 . 1 . . . .  33 Met HE   . 15089 1 
       363 . 1 1  33  33 MET HE3  H  1   1.96  0.02 . 1 . . . .  33 Met HE   . 15089 1 
       364 . 1 1  33  33 MET C    C 13 177.7   0.15 . 1 . . . .  33 Met C    . 15089 1 
       365 . 1 1  33  33 MET CE   C 13  18.8   0.15 . 1 . . . .  33 Met CE   . 15089 1 
       366 . 1 1  34  34 ASP H    H  1   7.36  0.02 . 1 . . . .  34 Asp H    . 15089 1 
       367 . 1 1  34  34 ASP HA   H  1   4.60  0.02 . 1 . . . .  34 Asp HA   . 15089 1 
       368 . 1 1  34  34 ASP HB2  H  1   2.96  0.02 . 2 . . . .  34 Asp HB2  . 15089 1 
       369 . 1 1  34  34 ASP HB3  H  1   3.12  0.02 . 2 . . . .  34 Asp HB3  . 15089 1 
       370 . 1 1  34  34 ASP C    C 13 177.1   0.15 . 1 . . . .  34 Asp C    . 15089 1 
       371 . 1 1  34  34 ASP CA   C 13  56.8   0.15 . 1 . . . .  34 Asp CA   . 15089 1 
       372 . 1 1  34  34 ASP CB   C 13  40.7   0.15 . 1 . . . .  34 Asp CB   . 15089 1 
       373 . 1 1  34  34 ASP N    N 15 122.8   0.15 . 1 . . . .  34 Asp N    . 15089 1 
       374 . 1 1  35  35 GLU H    H  1   8.71  0.02 . 1 . . . .  35 Glu H    . 15089 1 
       375 . 1 1  35  35 GLU HA   H  1   3.72  0.02 . 1 . . . .  35 Glu HA   . 15089 1 
       376 . 1 1  35  35 GLU HB2  H  1   1.97  0.02 . 2 . . . .  35 Glu HB2  . 15089 1 
       377 . 1 1  35  35 GLU HB3  H  1   2.06  0.02 . 2 . . . .  35 Glu HB3  . 15089 1 
       378 . 1 1  35  35 GLU HG2  H  1   1.33  0.02 . 2 . . . .  35 Glu HG2  . 15089 1 
       379 . 1 1  35  35 GLU HG3  H  1   1.64  0.02 . 2 . . . .  35 Glu HG3  . 15089 1 
       380 . 1 1  35  35 GLU C    C 13 178.0   0.15 . 1 . . . .  35 Glu C    . 15089 1 
       381 . 1 1  35  35 GLU CA   C 13  59.4   0.15 . 1 . . . .  35 Glu CA   . 15089 1 
       382 . 1 1  35  35 GLU CB   C 13  28.9   0.15 . 1 . . . .  35 Glu CB   . 15089 1 
       383 . 1 1  35  35 GLU CG   C 13  35.2   0.15 . 1 . . . .  35 Glu CG   . 15089 1 
       384 . 1 1  35  35 GLU N    N 15 120.8   0.15 . 1 . . . .  35 Glu N    . 15089 1 
       385 . 1 1  36  36 SER H    H  1   8.11  0.02 . 1 . . . .  36 Ser H    . 15089 1 
       386 . 1 1  36  36 SER HA   H  1   4.00  0.02 . 1 . . . .  36 Ser HA   . 15089 1 
       387 . 1 1  36  36 SER HB2  H  1   4.08  0.02 . 1 . . . .  36 Ser HB2  . 15089 1 
       388 . 1 1  36  36 SER HB3  H  1   4.08  0.02 . 1 . . . .  36 Ser HB3  . 15089 1 
       389 . 1 1  36  36 SER C    C 13 176.5   0.15 . 1 . . . .  36 Ser C    . 15089 1 
       390 . 1 1  36  36 SER CA   C 13  63.3   0.15 . 1 . . . .  36 Ser CA   . 15089 1 
       391 . 1 1  36  36 SER CB   C 13  63.3   0.15 . 1 . . . .  36 Ser CB   . 15089 1 
       392 . 1 1  36  36 SER N    N 15 113.3   0.15 . 1 . . . .  36 Ser N    . 15089 1 
       393 . 1 1  37  37 THR H    H  1   8.09  0.02 . 1 . . . .  37 Thr H    . 15089 1 
       394 . 1 1  37  37 THR HA   H  1   3.66  0.02 . 1 . . . .  37 Thr HA   . 15089 1 
       395 . 1 1  37  37 THR HB   H  1   4.24  0.02 . 1 . . . .  37 Thr HB   . 15089 1 
       396 . 1 1  37  37 THR HG21 H  1   1.16  0.02 . 1 . . . .  37 Thr HG2  . 15089 1 
       397 . 1 1  37  37 THR HG22 H  1   1.16  0.02 . 1 . . . .  37 Thr HG2  . 15089 1 
       398 . 1 1  37  37 THR HG23 H  1   1.16  0.02 . 1 . . . .  37 Thr HG2  . 15089 1 
       399 . 1 1  37  37 THR C    C 13 175.3   0.15 . 1 . . . .  37 Thr C    . 15089 1 
       400 . 1 1  37  37 THR CA   C 13  67.9   0.15 . 1 . . . .  37 Thr CA   . 15089 1 
       401 . 1 1  37  37 THR CB   C 13  68.1   0.15 . 1 . . . .  37 Thr CB   . 15089 1 
       402 . 1 1  37  37 THR CG2  C 13  22.11  0.15 . 1 . . . .  37 Thr CG2  . 15089 1 
       403 . 1 1  37  37 THR N    N 15 119.4   0.15 . 1 . . . .  37 Thr N    . 15089 1 
       404 . 1 1  38  38 ALA H    H  1   9.10  0.02 . 1 . . . .  38 Ala H    . 15089 1 
       405 . 1 1  38  38 ALA HA   H  1   3.85  0.02 . 1 . . . .  38 Ala HA   . 15089 1 
       406 . 1 1  38  38 ALA HB1  H  1   1.57  0.02 . 1 . . . .  38 Ala HB   . 15089 1 
       407 . 1 1  38  38 ALA HB2  H  1   1.57  0.02 . 1 . . . .  38 Ala HB   . 15089 1 
       408 . 1 1  38  38 ALA HB3  H  1   1.57  0.02 . 1 . . . .  38 Ala HB   . 15089 1 
       409 . 1 1  38  38 ALA C    C 13 179.1   0.15 . 1 . . . .  38 Ala C    . 15089 1 
       410 . 1 1  38  38 ALA CA   C 13  55.8   0.15 . 1 . . . .  38 Ala CA   . 15089 1 
       411 . 1 1  38  38 ALA CB   C 13  18.0   0.15 . 1 . . . .  38 Ala CB   . 15089 1 
       412 . 1 1  38  38 ALA N    N 15 123.0   0.15 . 1 . . . .  38 Ala N    . 15089 1 
       413 . 1 1  39  39 LYS H    H  1   8.09  0.02 . 1 . . . .  39 Lys H    . 15089 1 
       414 . 1 1  39  39 LYS HA   H  1   3.55  0.02 . 1 . . . .  39 Lys HA   . 15089 1 
       415 . 1 1  39  39 LYS HB2  H  1   1.57  0.02 . 2 . . . .  39 Lys HB2  . 15089 1 
       416 . 1 1  39  39 LYS HB3  H  1   1.32  0.02 . 2 . . . .  39 Lys HB3  . 15089 1 
       417 . 1 1  39  39 LYS HG2  H  1   0.89  0.02 . 2 . . . .  39 Lys HG2  . 15089 1 
       418 . 1 1  39  39 LYS HG3  H  1   0.32  0.02 . 2 . . . .  39 Lys HG3  . 15089 1 
       419 . 1 1  39  39 LYS HD2  H  1   1.08  0.02 . 1 . . . .  39 Lys HD2  . 15089 1 
       420 . 1 1  39  39 LYS HD3  H  1   1.08  0.02 . 1 . . . .  39 Lys HD3  . 15089 1 
       421 . 1 1  39  39 LYS HE2  H  1   1.82  0.02 . 2 . . . .  39 Lys HE2  . 15089 1 
       422 . 1 1  39  39 LYS HE3  H  1   1.01  0.02 . 2 . . . .  39 Lys HE3  . 15089 1 
       423 . 1 1  39  39 LYS C    C 13 177.8   0.15 . 1 . . . .  39 Lys C    . 15089 1 
       424 . 1 1  39  39 LYS CA   C 13  61.2   0.15 . 1 . . . .  39 Lys CA   . 15089 1 
       425 . 1 1  39  39 LYS CB   C 13  34.1   0.15 . 1 . . . .  39 Lys CB   . 15089 1 
       426 . 1 1  39  39 LYS CG   C 13  27.3   0.15 . 1 . . . .  39 Lys CG   . 15089 1 
       427 . 1 1  39  39 LYS CD   C 13  30.2   0.15 . 1 . . . .  39 Lys CD   . 15089 1 
       428 . 1 1  39  39 LYS CE   C 13  39.9   0.15 . 1 . . . .  39 Lys CE   . 15089 1 
       429 . 1 1  39  39 LYS N    N 15 114.9   0.15 . 1 . . . .  39 Lys N    . 15089 1 
       430 . 1 1  40  40 GLY H    H  1   7.89  0.02 . 1 . . . .  40 Gly H    . 15089 1 
       431 . 1 1  40  40 GLY HA2  H  1   3.40  0.02 . 2 . . . .  40 Gly HA2  . 15089 1 
       432 . 1 1  40  40 GLY HA3  H  1   3.49  0.02 . 2 . . . .  40 Gly HA3  . 15089 1 
       433 . 1 1  40  40 GLY C    C 13 175.5   0.15 . 1 . . . .  40 Gly C    . 15089 1 
       434 . 1 1  40  40 GLY CA   C 13  47.1   0.15 . 1 . . . .  40 Gly CA   . 15089 1 
       435 . 1 1  40  40 GLY N    N 15 106.0   0.15 . 1 . . . .  40 Gly N    . 15089 1 
       436 . 1 1  41  41 ILE H    H  1   7.99  0.02 . 1 . . . .  41 Ile H    . 15089 1 
       437 . 1 1  41  41 ILE HA   H  1   3.07  0.02 . 1 . . . .  41 Ile HA   . 15089 1 
       438 . 1 1  41  41 ILE HB   H  1   1.91  0.02 . 1 . . . .  41 Ile HB   . 15089 1 
       439 . 1 1  41  41 ILE HG12 H  1   1.63  0.02 . 2 . . . .  41 Ile HG12 . 15089 1 
       440 . 1 1  41  41 ILE HG13 H  1   0.73  0.02 . 2 . . . .  41 Ile HG13 . 15089 1 
       441 . 1 1  41  41 ILE HG21 H  1   0.97  0.02 . 1 . . . .  41 Ile HG2  . 15089 1 
       442 . 1 1  41  41 ILE HG22 H  1   0.97  0.02 . 1 . . . .  41 Ile HG2  . 15089 1 
       443 . 1 1  41  41 ILE HG23 H  1   0.97  0.02 . 1 . . . .  41 Ile HG2  . 15089 1 
       444 . 1 1  41  41 ILE HD11 H  1   0.93  0.02 . 1 . . . .  41 Ile HD1  . 15089 1 
       445 . 1 1  41  41 ILE HD12 H  1   0.93  0.02 . 1 . . . .  41 Ile HD1  . 15089 1 
       446 . 1 1  41  41 ILE HD13 H  1   0.93  0.02 . 1 . . . .  41 Ile HD1  . 15089 1 
       447 . 1 1  41  41 ILE C    C 13 176.8   0.15 . 1 . . . .  41 Ile C    . 15089 1 
       448 . 1 1  41  41 ILE CA   C 13  65.6   0.15 . 1 . . . .  41 Ile CA   . 15089 1 
       449 . 1 1  41  41 ILE CB   C 13  38.8   0.15 . 1 . . . .  41 Ile CB   . 15089 1 
       450 . 1 1  41  41 ILE CG1  C 13  30.3   0.15 . 1 . . . .  41 Ile CG1  . 15089 1 
       451 . 1 1  41  41 ILE CG2  C 13  18.0   0.15 . 1 . . . .  41 Ile CG2  . 15089 1 
       452 . 1 1  41  41 ILE CD1  C 13  15.9   0.15 . 1 . . . .  41 Ile CD1  . 15089 1 
       453 . 1 1  41  41 ILE N    N 15 122.9   0.15 . 1 . . . .  41 Ile N    . 15089 1 
       454 . 1 1  42  42 LEU H    H  1   7.98  0.02 . 1 . . . .  42 Leu H    . 15089 1 
       455 . 1 1  42  42 LEU HA   H  1   4.00  0.02 . 1 . . . .  42 Leu HA   . 15089 1 
       456 . 1 1  42  42 LEU HB2  H  1   1.98  0.02 . 2 . . . .  42 Leu HB2  . 15089 1 
       457 . 1 1  42  42 LEU HB3  H  1   1.33  0.02 . 2 . . . .  42 Leu HB3  . 15089 1 
       458 . 1 1  42  42 LEU HG   H  1   2.09  0.02 . 1 . . . .  42 Leu HG   . 15089 1 
       459 . 1 1  42  42 LEU HD11 H  1   0.89  0.02 . 1 . . . .  42 Leu HD1  . 15089 1 
       460 . 1 1  42  42 LEU HD12 H  1   0.89  0.02 . 1 . . . .  42 Leu HD1  . 15089 1 
       461 . 1 1  42  42 LEU HD13 H  1   0.89  0.02 . 1 . . . .  42 Leu HD1  . 15089 1 
       462 . 1 1  42  42 LEU HD21 H  1   0.84  0.02 . 1 . . . .  42 Leu HD2  . 15089 1 
       463 . 1 1  42  42 LEU HD22 H  1   0.84  0.02 . 1 . . . .  42 Leu HD2  . 15089 1 
       464 . 1 1  42  42 LEU HD23 H  1   0.84  0.02 . 1 . . . .  42 Leu HD2  . 15089 1 
       465 . 1 1  42  42 LEU C    C 13 180.4   0.15 . 1 . . . .  42 Leu C    . 15089 1 
       466 . 1 1  42  42 LEU CA   C 13  57.9   0.15 . 1 . . . .  42 Leu CA   . 15089 1 
       467 . 1 1  42  42 LEU CB   C 13  42.3   0.15 . 1 . . . .  42 Leu CB   . 15089 1 
       468 . 1 1  42  42 LEU CG   C 13  26.5   0.15 . 1 . . . .  42 Leu CG   . 15089 1 
       469 . 1 1  42  42 LEU CD1  C 13  26.1   0.15 . 1 . . . .  42 Leu CD1  . 15089 1 
       470 . 1 1  42  42 LEU CD2  C 13  22.0   0.15 . 1 . . . .  42 Leu CD2  . 15089 1 
       471 . 1 1  42  42 LEU N    N 15 117.0   0.15 . 1 . . . .  42 Leu N    . 15089 1 
       472 . 1 1  43  43 LYS H    H  1   8.75  0.02 . 1 . . . .  43 Lys H    . 15089 1 
       473 . 1 1  43  43 LYS HA   H  1   3.92  0.02 . 1 . . . .  43 Lys HA   . 15089 1 
       474 . 1 1  43  43 LYS HB2  H  1   1.70  0.02 . 2 . . . .  43 Lys HB2  . 15089 1 
       475 . 1 1  43  43 LYS HB3  H  1   2.01  0.02 . 2 . . . .  43 Lys HB3  . 15089 1 
       476 . 1 1  43  43 LYS HG2  H  1   1.53  0.02 . 1 . . . .  43 Lys HG2  . 15089 1 
       477 . 1 1  43  43 LYS HG3  H  1   1.53  0.02 . 1 . . . .  43 Lys HG3  . 15089 1 
       478 . 1 1  43  43 LYS HD2  H  1   1.76  0.02 . 2 . . . .  43 Lys HD2  . 15089 1 
       479 . 1 1  43  43 LYS HD3  H  1   1.60  0.02 . 2 . . . .  43 Lys HD3  . 15089 1 
       480 . 1 1  43  43 LYS HE2  H  1   3.10  0.02 . 1 . . . .  43 Lys HE2  . 15089 1 
       481 . 1 1  43  43 LYS HE3  H  1   3.10  0.02 . 1 . . . .  43 Lys HE3  . 15089 1 
       482 . 1 1  43  43 LYS C    C 13 176.8   0.15 . 1 . . . .  43 Lys C    . 15089 1 
       483 . 1 1  43  43 LYS CA   C 13  59.6   0.15 . 1 . . . .  43 Lys CA   . 15089 1 
       484 . 1 1  43  43 LYS CB   C 13  32.9   0.15 . 1 . . . .  43 Lys CB   . 15089 1 
       485 . 1 1  43  43 LYS CG   C 13  25.1   0.15 . 1 . . . .  43 Lys CG   . 15089 1 
       486 . 1 1  43  43 LYS CD   C 13  29.3   0.15 . 1 . . . .  43 Lys CD   . 15089 1 
       487 . 1 1  43  43 LYS CE   C 13  42.4   0.15 . 1 . . . .  43 Lys CE   . 15089 1 
       488 . 1 1  43  43 LYS N    N 15 121.5   0.15 . 1 . . . .  43 Lys N    . 15089 1 
       489 . 1 1  44  44 TYR H    H  1   8.35  0.02 . 1 . . . .  44 Tyr H    . 15089 1 
       490 . 1 1  44  44 TYR HA   H  1   4.35  0.02 . 1 . . . .  44 Tyr HA   . 15089 1 
       491 . 1 1  44  44 TYR HB2  H  1   3.45  0.02 . 2 . . . .  44 Tyr HB2  . 15089 1 
       492 . 1 1  44  44 TYR HB3  H  1   3.02  0.02 . 2 . . . .  44 Tyr HB3  . 15089 1 
       493 . 1 1  44  44 TYR HD1  H  1   7.19  0.02 . 1 . . . .  44 Tyr HD1  . 15089 1 
       494 . 1 1  44  44 TYR HD2  H  1   7.19  0.02 . 1 . . . .  44 Tyr HD2  . 15089 1 
       495 . 1 1  44  44 TYR HE1  H  1   6.88  0.02 . 1 . . . .  44 Tyr HE1  . 15089 1 
       496 . 1 1  44  44 TYR HE2  H  1   6.88  0.02 . 1 . . . .  44 Tyr HE2  . 15089 1 
       497 . 1 1  44  44 TYR C    C 13 178.0   0.15 . 1 . . . .  44 Tyr C    . 15089 1 
       498 . 1 1  44  44 TYR CA   C 13  61.8   0.15 . 1 . . . .  44 Tyr CA   . 15089 1 
       499 . 1 1  44  44 TYR CB   C 13  40.2   0.15 . 1 . . . .  44 Tyr CB   . 15089 1 
       500 . 1 1  44  44 TYR CD1  C 13 132.5   0.15 . 1 . . . .  44 Tyr CD1  . 15089 1 
       501 . 1 1  44  44 TYR CD2  C 13 132.5   0.15 . 1 . . . .  44 Tyr CD2  . 15089 1 
       502 . 1 1  44  44 TYR CE1  C 13 119.3   0.15 . 1 . . . .  44 Tyr CE1  . 15089 1 
       503 . 1 1  44  44 TYR CE2  C 13 119.3   0.15 . 1 . . . .  44 Tyr CE2  . 15089 1 
       504 . 1 1  44  44 TYR N    N 15 120.7   0.15 . 1 . . . .  44 Tyr N    . 15089 1 
       505 . 1 1  45  45 LEU H    H  1   8.08  0.02 . 1 . . . .  45 Leu H    . 15089 1 
       506 . 1 1  45  45 LEU HA   H  1   3.82  0.02 . 1 . . . .  45 Leu HA   . 15089 1 
       507 . 1 1  45  45 LEU HB2  H  1   2.26  0.02 . 2 . . . .  45 Leu HB2  . 15089 1 
       508 . 1 1  45  45 LEU HB3  H  1   1.69  0.02 . 2 . . . .  45 Leu HB3  . 15089 1 
       509 . 1 1  45  45 LEU HG   H  1   1.92  0.02 . 1 . . . .  45 Leu HG   . 15089 1 
       510 . 1 1  45  45 LEU HD11 H  1   0.89  0.02 . 1 . . . .  45 Leu HD1  . 15089 1 
       511 . 1 1  45  45 LEU HD12 H  1   0.89  0.02 . 1 . . . .  45 Leu HD1  . 15089 1 
       512 . 1 1  45  45 LEU HD13 H  1   0.89  0.02 . 1 . . . .  45 Leu HD1  . 15089 1 
       513 . 1 1  45  45 LEU HD21 H  1   0.84  0.02 . 1 . . . .  45 Leu HD2  . 15089 1 
       514 . 1 1  45  45 LEU HD22 H  1   0.84  0.02 . 1 . . . .  45 Leu HD2  . 15089 1 
       515 . 1 1  45  45 LEU HD23 H  1   0.84  0.02 . 1 . . . .  45 Leu HD2  . 15089 1 
       516 . 1 1  45  45 LEU C    C 13 179.3   0.15 . 1 . . . .  45 Leu C    . 15089 1 
       517 . 1 1  45  45 LEU CA   C 13  58.1   0.15 . 1 . . . .  45 Leu CA   . 15089 1 
       518 . 1 1  45  45 LEU CB   C 13  39.5   0.15 . 1 . . . .  45 Leu CB   . 15089 1 
       519 . 1 1  45  45 LEU CG   C 13  28.1   0.15 . 1 . . . .  45 Leu CG   . 15089 1 
       520 . 1 1  45  45 LEU CD1  C 13  26.8   0.15 . 1 . . . .  45 Leu CD1  . 15089 1 
       521 . 1 1  45  45 LEU CD2  C 13  23.6   0.15 . 1 . . . .  45 Leu CD2  . 15089 1 
       522 . 1 1  45  45 LEU N    N 15 116.1   0.15 . 1 . . . .  45 Leu N    . 15089 1 
       523 . 1 1  46  46 HIS H    H  1   7.80  0.02 . 1 . . . .  46 His H    . 15089 1 
       524 . 1 1  46  46 HIS HA   H  1   3.76  0.02 . 1 . . . .  46 His HA   . 15089 1 
       525 . 1 1  46  46 HIS HB2  H  1   3.39  0.02 . 1 . . . .  46 His HB2  . 15089 1 
       526 . 1 1  46  46 HIS HB3  H  1   3.39  0.02 . 1 . . . .  46 His HB3  . 15089 1 
       527 . 1 1  46  46 HIS HD2  H  1   7.16  0.02 . 1 . . . .  46 His HD2  . 15089 1 
       528 . 1 1  46  46 HIS C    C 13 178.8   0.15 . 1 . . . .  46 His C    . 15089 1 
       529 . 1 1  46  46 HIS CA   C 13  60.9   0.15 . 1 . . . .  46 His CA   . 15089 1 
       530 . 1 1  46  46 HIS CB   C 13  28.7   0.15 . 1 . . . .  46 His CB   . 15089 1 
       531 . 1 1  46  46 HIS CD2  C 13 121.0   0.15 . 1 . . . .  46 His CD2  . 15089 1 
       532 . 1 1  46  46 HIS N    N 15 117.7   0.15 . 1 . . . .  46 His N    . 15089 1 
       533 . 1 1  47  47 ASP H    H  1   9.00  0.02 . 1 . . . .  47 Asp H    . 15089 1 
       534 . 1 1  47  47 ASP HA   H  1   4.28  0.02 . 1 . . . .  47 Asp HA   . 15089 1 
       535 . 1 1  47  47 ASP HB2  H  1   2.95  0.02 . 2 . . . .  47 Asp HB2  . 15089 1 
       536 . 1 1  47  47 ASP HB3  H  1   2.66  0.02 . 2 . . . .  47 Asp HB3  . 15089 1 
       537 . 1 1  47  47 ASP C    C 13 177.8   0.15 . 1 . . . .  47 Asp C    . 15089 1 
       538 . 1 1  47  47 ASP CA   C 13  57.1   0.15 . 1 . . . .  47 Asp CA   . 15089 1 
       539 . 1 1  47  47 ASP CB   C 13  39.4   0.15 . 1 . . . .  47 Asp CB   . 15089 1 
       540 . 1 1  47  47 ASP N    N 15 123.3   0.15 . 1 . . . .  47 Asp N    . 15089 1 
       541 . 1 1  48  48 LEU H    H  1   7.61  0.02 . 1 . . . .  48 Leu H    . 15089 1 
       542 . 1 1  48  48 LEU HA   H  1   4.21  0.02 . 1 . . . .  48 Leu HA   . 15089 1 
       543 . 1 1  48  48 LEU HB2  H  1   1.64  0.02 . 1 . . . .  48 Leu HB2  . 15089 1 
       544 . 1 1  48  48 LEU HB3  H  1   1.64  0.02 . 1 . . . .  48 Leu HB3  . 15089 1 
       545 . 1 1  48  48 LEU HG   H  1   1.35  0.02 . 1 . . . .  48 Leu HG   . 15089 1 
       546 . 1 1  48  48 LEU HD11 H  1   0.47  0.02 . 1 . . . .  48 Leu HD1  . 15089 1 
       547 . 1 1  48  48 LEU HD12 H  1   0.47  0.02 . 1 . . . .  48 Leu HD1  . 15089 1 
       548 . 1 1  48  48 LEU HD13 H  1   0.47  0.02 . 1 . . . .  48 Leu HD1  . 15089 1 
       549 . 1 1  48  48 LEU HD21 H  1   0.67  0.02 . 1 . . . .  48 Leu HD2  . 15089 1 
       550 . 1 1  48  48 LEU HD22 H  1   0.67  0.02 . 1 . . . .  48 Leu HD2  . 15089 1 
       551 . 1 1  48  48 LEU HD23 H  1   0.67  0.02 . 1 . . . .  48 Leu HD2  . 15089 1 
       552 . 1 1  48  48 LEU C    C 13 176.9   0.15 . 1 . . . .  48 Leu C    . 15089 1 
       553 . 1 1  48  48 LEU CA   C 13  55.2   0.15 . 1 . . . .  48 Leu CA   . 15089 1 
       554 . 1 1  48  48 LEU CB   C 13  42.7   0.15 . 1 . . . .  48 Leu CB   . 15089 1 
       555 . 1 1  48  48 LEU CG   C 13  26.8   0.15 . 1 . . . .  48 Leu CG   . 15089 1 
       556 . 1 1  48  48 LEU CD1  C 13  25.6   0.15 . 1 . . . .  48 Leu CD1  . 15089 1 
       557 . 1 1  48  48 LEU CD2  C 13  22.5   0.15 . 1 . . . .  48 Leu CD2  . 15089 1 
       558 . 1 1  48  48 LEU N    N 15 119.3   0.15 . 1 . . . .  48 Leu N    . 15089 1 
       559 . 1 1  49  49 GLY H    H  1   7.73  0.02 . 1 . . . .  49 Gly H    . 15089 1 
       560 . 1 1  49  49 GLY HA2  H  1   4.18  0.02 . 2 . . . .  49 Gly HA2  . 15089 1 
       561 . 1 1  49  49 GLY HA3  H  1   3.68  0.02 . 2 . . . .  49 Gly HA3  . 15089 1 
       562 . 1 1  49  49 GLY C    C 13 174.0   0.15 . 1 . . . .  49 Gly C    . 15089 1 
       563 . 1 1  49  49 GLY CA   C 13  45.3   0.15 . 1 . . . .  49 Gly CA   . 15089 1 
       564 . 1 1  49  49 GLY N    N 15 106.4   0.15 . 1 . . . .  49 Gly N    . 15089 1 
       565 . 1 1  50  50 VAL H    H  1   8.09  0.02 . 1 . . . .  50 Val H    . 15089 1 
       566 . 1 1  50  50 VAL HA   H  1   4.37  0.02 . 1 . . . .  50 Val HA   . 15089 1 
       567 . 1 1  50  50 VAL HB   H  1   1.96  0.02 . 1 . . . .  50 Val HB   . 15089 1 
       568 . 1 1  50  50 VAL HG11 H  1   0.80  0.02 . 1 . . . .  50 Val HG1  . 15089 1 
       569 . 1 1  50  50 VAL HG12 H  1   0.80  0.02 . 1 . . . .  50 Val HG1  . 15089 1 
       570 . 1 1  50  50 VAL HG13 H  1   0.80  0.02 . 1 . . . .  50 Val HG1  . 15089 1 
       571 . 1 1  50  50 VAL HG21 H  1   0.75  0.02 . 1 . . . .  50 Val HG2  . 15089 1 
       572 . 1 1  50  50 VAL HG22 H  1   0.75  0.02 . 1 . . . .  50 Val HG2  . 15089 1 
       573 . 1 1  50  50 VAL HG23 H  1   0.75  0.02 . 1 . . . .  50 Val HG2  . 15089 1 
       574 . 1 1  50  50 VAL C    C 13 179.4   0.15 . 1 . . . .  50 Val C    . 15089 1 
       575 . 1 1  50  50 VAL CA   C 13  58.7   0.15 . 1 . . . .  50 Val CA   . 15089 1 
       576 . 1 1  50  50 VAL CB   C 13  32.3   0.15 . 1 . . . .  50 Val CB   . 15089 1 
       577 . 1 1  50  50 VAL CG1  C 13  22.1   0.15 . 1 . . . .  50 Val CG1  . 15089 1 
       578 . 1 1  50  50 VAL CG2  C 13  21.4   0.15 . 1 . . . .  50 Val CG2  . 15089 1 
       579 . 1 1  50  50 VAL N    N 15 119.9   0.15 . 1 . . . .  50 Val N    . 15089 1 
       580 . 1 1  51  51 PRO HA   H  1   4.35  0.02 . 1 . . . .  51 Pro HA   . 15089 1 
       581 . 1 1  51  51 PRO HB2  H  1   2.08  0.02 . 2 . . . .  51 Pro HB2  . 15089 1 
       582 . 1 1  51  51 PRO HB3  H  1   1.94  0.02 . 2 . . . .  51 Pro HB3  . 15089 1 
       583 . 1 1  51  51 PRO HG2  H  1   2.06  0.02 . 2 . . . .  51 Pro HG2  . 15089 1 
       584 . 1 1  51  51 PRO HG3  H  1   1.95  0.02 . 2 . . . .  51 Pro HG3  . 15089 1 
       585 . 1 1  51  51 PRO HD2  H  1   3.26  0.02 . 2 . . . .  51 Pro HD2  . 15089 1 
       586 . 1 1  51  51 PRO HD3  H  1   3.58  0.02 . 2 . . . .  51 Pro HD3  . 15089 1 
       587 . 1 1  51  51 PRO C    C 13 177.4   0.15 . 1 . . . .  51 Pro C    . 15089 1 
       588 . 1 1  51  51 PRO CA   C 13  62.4   0.15 . 1 . . . .  51 Pro CA   . 15089 1 
       589 . 1 1  51  51 PRO CB   C 13  32.7   0.15 . 1 . . . .  51 Pro CB   . 15089 1 
       590 . 1 1  51  51 PRO CG   C 13  27.6   0.15 . 1 . . . .  51 Pro CG   . 15089 1 
       591 . 1 1  51  51 PRO CD   C 13  49.9   0.15 . 1 . . . .  51 Pro CD   . 15089 1 
       592 . 1 1  52  52 VAL H    H  1   8.83  0.02 . 1 . . . .  52 Val H    . 15089 1 
       593 . 1 1  52  52 VAL HA   H  1   3.83  0.02 . 1 . . . .  52 Val HA   . 15089 1 
       594 . 1 1  52  52 VAL HB   H  1   2.16  0.02 . 1 . . . .  52 Val HB   . 15089 1 
       595 . 1 1  52  52 VAL HG11 H  1   0.97  0.02 . 1 . . . .  52 Val HG1  . 15089 1 
       596 . 1 1  52  52 VAL HG12 H  1   0.97  0.02 . 1 . . . .  52 Val HG1  . 15089 1 
       597 . 1 1  52  52 VAL HG13 H  1   0.97  0.02 . 1 . . . .  52 Val HG1  . 15089 1 
       598 . 1 1  52  52 VAL HG21 H  1   0.96  0.02 . 1 . . . .  52 Val HG2  . 15089 1 
       599 . 1 1  52  52 VAL HG22 H  1   0.96  0.02 . 1 . . . .  52 Val HG2  . 15089 1 
       600 . 1 1  52  52 VAL HG23 H  1   0.96  0.02 . 1 . . . .  52 Val HG2  . 15089 1 
       601 . 1 1  52  52 VAL C    C 13 175.1   0.15 . 1 . . . .  52 Val C    . 15089 1 
       602 . 1 1  52  52 VAL CA   C 13  61.2   0.15 . 1 . . . .  52 Val CA   . 15089 1 
       603 . 1 1  52  52 VAL CB   C 13  32.9   0.15 . 1 . . . .  52 Val CB   . 15089 1 
       604 . 1 1  52  52 VAL CG1  C 13  20.6   0.15 . 1 . . . .  52 Val CG1  . 15089 1 
       605 . 1 1  52  52 VAL CG2  C 13  19.8   0.15 . 1 . . . .  52 Val CG2  . 15089 1 
       606 . 1 1  52  52 VAL N    N 15 122.3   0.15 . 1 . . . .  52 Val N    . 15089 1 
       607 . 1 1  53  53 SER H    H  1   8.53  0.02 . 1 . . . .  53 Ser H    . 15089 1 
       608 . 1 1  53  53 SER HA   H  1   4.74  0.02 . 1 . . . .  53 Ser HA   . 15089 1 
       609 . 1 1  53  53 SER HB2  H  1   4.29  0.02 . 2 . . . .  53 Ser HB2  . 15089 1 
       610 . 1 1  53  53 SER HB3  H  1   4.02  0.02 . 2 . . . .  53 Ser HB3  . 15089 1 
       611 . 1 1  53  53 SER C    C 13 173.6   0.15 . 1 . . . .  53 Ser C    . 15089 1 
       612 . 1 1  53  53 SER CA   C 13  56.2   0.15 . 1 . . . .  53 Ser CA   . 15089 1 
       613 . 1 1  53  53 SER CB   C 13  63.3   0.15 . 1 . . . .  53 Ser CB   . 15089 1 
       614 . 1 1  53  53 SER N    N 15 124.6   0.15 . 1 . . . .  53 Ser N    . 15089 1 
       615 . 1 1  54  54 PRO HA   H  1   4.02  0.02 . 1 . . . .  54 Pro HA   . 15089 1 
       616 . 1 1  54  54 PRO HB2  H  1   2.50  0.02 . 2 . . . .  54 Pro HB2  . 15089 1 
       617 . 1 1  54  54 PRO HB3  H  1   2.03  0.02 . 2 . . . .  54 Pro HB3  . 15089 1 
       618 . 1 1  54  54 PRO HG2  H  1   2.30  0.02 . 2 . . . .  54 Pro HG2  . 15089 1 
       619 . 1 1  54  54 PRO HG3  H  1   1.96  0.02 . 2 . . . .  54 Pro HG3  . 15089 1 
       620 . 1 1  54  54 PRO HD2  H  1   4.06  0.02 . 2 . . . .  54 Pro HD2  . 15089 1 
       621 . 1 1  54  54 PRO HD3  H  1   3.55  0.02 . 2 . . . .  54 Pro HD3  . 15089 1 
       622 . 1 1  54  54 PRO C    C 13 177.8   0.15 . 1 . . . .  54 Pro C    . 15089 1 
       623 . 1 1  54  54 PRO CA   C 13  65.8   0.15 . 1 . . . .  54 Pro CA   . 15089 1 
       624 . 1 1  54  54 PRO CB   C 13  31.6   0.15 . 1 . . . .  54 Pro CB   . 15089 1 
       625 . 1 1  54  54 PRO CG   C 13  28.1   0.15 . 1 . . . .  54 Pro CG   . 15089 1 
       626 . 1 1  54  54 PRO CD   C 13  50.5   0.15 . 1 . . . .  54 Pro CD   . 15089 1 
       627 . 1 1  55  55 GLU H    H  1   8.78  0.02 . 1 . . . .  55 Glu H    . 15089 1 
       628 . 1 1  55  55 GLU HA   H  1   3.90  0.02 . 1 . . . .  55 Glu HA   . 15089 1 
       629 . 1 1  55  55 GLU HB2  H  1   1.93  0.02 . 2 . . . .  55 Glu HB2  . 15089 1 
       630 . 1 1  55  55 GLU HB3  H  1   2.03  0.02 . 2 . . . .  55 Glu HB3  . 15089 1 
       631 . 1 1  55  55 GLU HG2  H  1   2.39  0.02 . 2 . . . .  55 Glu HG2  . 15089 1 
       632 . 1 1  55  55 GLU HG3  H  1   2.24  0.02 . 2 . . . .  55 Glu HG3  . 15089 1 
       633 . 1 1  55  55 GLU C    C 13 179.8   0.15 . 1 . . . .  55 Glu C    . 15089 1 
       634 . 1 1  55  55 GLU CA   C 13  60.6   0.15 . 1 . . . .  55 Glu CA   . 15089 1 
       635 . 1 1  55  55 GLU CB   C 13  28.8   0.15 . 1 . . . .  55 Glu CB   . 15089 1 
       636 . 1 1  55  55 GLU CG   C 13  37.0   0.15 . 1 . . . .  55 Glu CG   . 15089 1 
       637 . 1 1  55  55 GLU N    N 15 114.9   0.15 . 1 . . . .  55 Glu N    . 15089 1 
       638 . 1 1  56  56 VAL H    H  1   7.577 0.02 . 1 . . . .  56 Val H    . 15089 1 
       639 . 1 1  56  56 VAL HA   H  1   3.92  0.02 . 1 . . . .  56 Val HA   . 15089 1 
       640 . 1 1  56  56 VAL HB   H  1   2.30  0.02 . 1 . . . .  56 Val HB   . 15089 1 
       641 . 1 1  56  56 VAL HG11 H  1   0.98  0.02 . 1 . . . .  56 Val HG1  . 15089 1 
       642 . 1 1  56  56 VAL HG12 H  1   0.98  0.02 . 1 . . . .  56 Val HG1  . 15089 1 
       643 . 1 1  56  56 VAL HG13 H  1   0.98  0.02 . 1 . . . .  56 Val HG1  . 15089 1 
       644 . 1 1  56  56 VAL HG21 H  1   1.12  0.02 . 1 . . . .  56 Val HG2  . 15089 1 
       645 . 1 1  56  56 VAL HG22 H  1   1.12  0.02 . 1 . . . .  56 Val HG2  . 15089 1 
       646 . 1 1  56  56 VAL HG23 H  1   1.12  0.02 . 1 . . . .  56 Val HG2  . 15089 1 
       647 . 1 1  56  56 VAL C    C 13 178.3   0.15 . 1 . . . .  56 Val C    . 15089 1 
       648 . 1 1  56  56 VAL CA   C 13  65.1   0.15 . 1 . . . .  56 Val CA   . 15089 1 
       649 . 1 1  56  56 VAL CB   C 13  31.3   0.15 . 1 . . . .  56 Val CB   . 15089 1 
       650 . 1 1  56  56 VAL CG1  C 13  21.9   0.15 . 1 . . . .  56 Val CG1  . 15089 1 
       651 . 1 1  56  56 VAL CG2  C 13  21.9   0.15 . 1 . . . .  56 Val CG2  . 15089 1 
       652 . 1 1  56  56 VAL N    N 15 118.7   0.15 . 1 . . . .  56 Val N    . 15089 1 
       653 . 1 1  57  57 VAL H    H  1   7.168 0.02 . 1 . . . .  57 Val H    . 15089 1 
       654 . 1 1  57  57 VAL HA   H  1   3.45  0.02 . 1 . . . .  57 Val HA   . 15089 1 
       655 . 1 1  57  57 VAL HB   H  1   2.37  0.02 . 1 . . . .  57 Val HB   . 15089 1 
       656 . 1 1  57  57 VAL HG11 H  1   1.03  0.02 . 1 . . . .  57 Val HG1  . 15089 1 
       657 . 1 1  57  57 VAL HG12 H  1   1.03  0.02 . 1 . . . .  57 Val HG1  . 15089 1 
       658 . 1 1  57  57 VAL HG13 H  1   1.03  0.02 . 1 . . . .  57 Val HG1  . 15089 1 
       659 . 1 1  57  57 VAL HG21 H  1   0.91  0.02 . 1 . . . .  57 Val HG2  . 15089 1 
       660 . 1 1  57  57 VAL HG22 H  1   0.91  0.02 . 1 . . . .  57 Val HG2  . 15089 1 
       661 . 1 1  57  57 VAL HG23 H  1   0.91  0.02 . 1 . . . .  57 Val HG2  . 15089 1 
       662 . 1 1  57  57 VAL C    C 13 176.9   0.15 . 1 . . . .  57 Val C    . 15089 1 
       663 . 1 1  57  57 VAL CA   C 13  66.9   0.15 . 1 . . . .  57 Val CA   . 15089 1 
       664 . 1 1  57  57 VAL CB   C 13  31.6   0.15 . 1 . . . .  57 Val CB   . 15089 1 
       665 . 1 1  57  57 VAL CG1  C 13  22.3   0.15 . 1 . . . .  57 Val CG1  . 15089 1 
       666 . 1 1  57  57 VAL CG2  C 13  22.4   0.15 . 1 . . . .  57 Val CG2  . 15089 1 
       667 . 1 1  57  57 VAL N    N 15 122.0   0.15 . 1 . . . .  57 Val N    . 15089 1 
       668 . 1 1  58  58 VAL H    H  1   8.03  0.02 . 1 . . . .  58 Val H    . 15089 1 
       669 . 1 1  58  58 VAL HA   H  1   3.33  0.02 . 1 . . . .  58 Val HA   . 15089 1 
       670 . 1 1  58  58 VAL HB   H  1   1.88  0.02 . 1 . . . .  58 Val HB   . 15089 1 
       671 . 1 1  58  58 VAL HG11 H  1   0.83  0.02 . 1 . . . .  58 Val HG1  . 15089 1 
       672 . 1 1  58  58 VAL HG12 H  1   0.83  0.02 . 1 . . . .  58 Val HG1  . 15089 1 
       673 . 1 1  58  58 VAL HG13 H  1   0.83  0.02 . 1 . . . .  58 Val HG1  . 15089 1 
       674 . 1 1  58  58 VAL HG21 H  1   0.89  0.02 . 1 . . . .  58 Val HG2  . 15089 1 
       675 . 1 1  58  58 VAL HG22 H  1   0.89  0.02 . 1 . . . .  58 Val HG2  . 15089 1 
       676 . 1 1  58  58 VAL HG23 H  1   0.89  0.02 . 1 . . . .  58 Val HG2  . 15089 1 
       677 . 1 1  58  58 VAL C    C 13 177.9   0.15 . 1 . . . .  58 Val C    . 15089 1 
       678 . 1 1  58  58 VAL CA   C 13  66.2   0.15 . 1 . . . .  58 Val CA   . 15089 1 
       679 . 1 1  58  58 VAL CB   C 13  31.9   0.15 . 1 . . . .  58 Val CB   . 15089 1 
       680 . 1 1  58  58 VAL CG1  C 13  21.1   0.15 . 1 . . . .  58 Val CG1  . 15089 1 
       681 . 1 1  58  58 VAL CG2  C 13  22.6   0.15 . 1 . . . .  58 Val CG2  . 15089 1 
       682 . 1 1  58  58 VAL N    N 15 118.1   0.15 . 1 . . . .  58 Val N    . 15089 1 
       683 . 1 1  59  59 ALA H    H  1   7.64  0.02 . 1 . . . .  59 Ala H    . 15089 1 
       684 . 1 1  59  59 ALA HA   H  1   4.06  0.02 . 1 . . . .  59 Ala HA   . 15089 1 
       685 . 1 1  59  59 ALA HB1  H  1   1.37  0.02 . 1 . . . .  59 Ala HB   . 15089 1 
       686 . 1 1  59  59 ALA HB2  H  1   1.37  0.02 . 1 . . . .  59 Ala HB   . 15089 1 
       687 . 1 1  59  59 ALA HB3  H  1   1.37  0.02 . 1 . . . .  59 Ala HB   . 15089 1 
       688 . 1 1  59  59 ALA C    C 13 180.3   0.15 . 1 . . . .  59 Ala C    . 15089 1 
       689 . 1 1  59  59 ALA CA   C 13  54.8   0.15 . 1 . . . .  59 Ala CA   . 15089 1 
       690 . 1 1  59  59 ALA CB   C 13  18.1   0.15 . 1 . . . .  59 Ala CB   . 15089 1 
       691 . 1 1  59  59 ALA N    N 15 119.4   0.15 . 1 . . . .  59 Ala N    . 15089 1 
       692 . 1 1  60  60 ARG H    H  1   7.59  0.02 . 1 . . . .  60 Arg H    . 15089 1 
       693 . 1 1  60  60 ARG HA   H  1   3.93  0.02 . 1 . . . .  60 Arg HA   . 15089 1 
       694 . 1 1  60  60 ARG HB2  H  1   1.64  0.02 . 2 . . . .  60 Arg HB2  . 15089 1 
       695 . 1 1  60  60 ARG HB3  H  1   1.74  0.02 . 2 . . . .  60 Arg HB3  . 15089 1 
       696 . 1 1  60  60 ARG HG2  H  1   1.47  0.02 . 2 . . . .  60 Arg HG2  . 15089 1 
       697 . 1 1  60  60 ARG HG3  H  1   0.95  0.02 . 2 . . . .  60 Arg HG3  . 15089 1 
       698 . 1 1  60  60 ARG HD2  H  1   3.34  0.02 . 2 . . . .  60 Arg HD2  . 15089 1 
       699 . 1 1  60  60 ARG HD3  H  1   3.03  0.02 . 2 . . . .  60 Arg HD3  . 15089 1 
       700 . 1 1  60  60 ARG HE   H  1   7.81  0.02 . 1 . . . .  60 Arg HE   . 15089 1 
       701 . 1 1  60  60 ARG C    C 13 177.3   0.15 . 1 . . . .  60 Arg C    . 15089 1 
       702 . 1 1  60  60 ARG CA   C 13  57.0   0.15 . 1 . . . .  60 Arg CA   . 15089 1 
       703 . 1 1  60  60 ARG CB   C 13  28.5   0.15 . 1 . . . .  60 Arg CB   . 15089 1 
       704 . 1 1  60  60 ARG CG   C 13  28.0   0.15 . 1 . . . .  60 Arg CG   . 15089 1 
       705 . 1 1  60  60 ARG CD   C 13  40.9   0.15 . 1 . . . .  60 Arg CD   . 15089 1 
       706 . 1 1  60  60 ARG N    N 15 119.0   0.15 . 1 . . . .  60 Arg N    . 15089 1 
       707 . 1 1  60  60 ARG NE   N 15  83.3   0.15 . 1 . . . .  60 Arg NE   . 15089 1 
       708 . 1 1  61  61 GLY H    H  1   8.14  0.02 . 1 . . . .  61 Gly H    . 15089 1 
       709 . 1 1  61  61 GLY HA2  H  1   3.40  0.02 . 2 . . . .  61 Gly HA2  . 15089 1 
       710 . 1 1  61  61 GLY HA3  H  1   2.19  0.02 . 2 . . . .  61 Gly HA3  . 15089 1 
       711 . 1 1  61  61 GLY C    C 13 176.9   0.15 . 1 . . . .  61 Gly C    . 15089 1 
       712 . 1 1  61  61 GLY CA   C 13  47.3   0.15 . 1 . . . .  61 Gly CA   . 15089 1 
       713 . 1 1  61  61 GLY N    N 15 107.2   0.15 . 1 . . . .  61 Gly N    . 15089 1 
       714 . 1 1  62  62 GLU H    H  1   8.00  0.02 . 1 . . . .  62 Glu H    . 15089 1 
       715 . 1 1  62  62 GLU HA   H  1   3.99  0.02 . 1 . . . .  62 Glu HA   . 15089 1 
       716 . 1 1  62  62 GLU HB2  H  1   2.07  0.02 . 2 . . . .  62 Glu HB2  . 15089 1 
       717 . 1 1  62  62 GLU HB3  H  1   1.97  0.02 . 2 . . . .  62 Glu HB3  . 15089 1 
       718 . 1 1  62  62 GLU HG2  H  1   2.40  0.02 . 2 . . . .  62 Glu HG2  . 15089 1 
       719 . 1 1  62  62 GLU HG3  H  1   2.19  0.02 . 2 . . . .  62 Glu HG3  . 15089 1 
       720 . 1 1  62  62 GLU C    C 13 179.3   0.15 . 1 . . . .  62 Glu C    . 15089 1 
       721 . 1 1  62  62 GLU CA   C 13  58.9   0.15 . 1 . . . .  62 Glu CA   . 15089 1 
       722 . 1 1  62  62 GLU CB   C 13  29.5   0.15 . 1 . . . .  62 Glu CB   . 15089 1 
       723 . 1 1  62  62 GLU CG   C 13  36.6   0.15 . 1 . . . .  62 Glu CG   . 15089 1 
       724 . 1 1  62  62 GLU N    N 15 120.0   0.15 . 1 . . . .  62 Glu N    . 15089 1 
       725 . 1 1  63  63 GLN H    H  1   7.68  0.02 . 1 . . . .  63 Gln H    . 15089 1 
       726 . 1 1  63  63 GLN HA   H  1   3.97  0.02 . 1 . . . .  63 Gln HA   . 15089 1 
       727 . 1 1  63  63 GLN HB2  H  1   2.06  0.02 . 2 . . . .  63 Gln HB2  . 15089 1 
       728 . 1 1  63  63 GLN HB3  H  1   2.16  0.02 . 2 . . . .  63 Gln HB3  . 15089 1 
       729 . 1 1  63  63 GLN HG2  H  1   2.38  0.02 . 2 . . . .  63 Gln HG2  . 15089 1 
       730 . 1 1  63  63 GLN HG3  H  1   2.30  0.02 . 2 . . . .  63 Gln HG3  . 15089 1 
       731 . 1 1  63  63 GLN HE21 H  1   7.65  0.02 . 1 . . . .  63 Gln HE21 . 15089 1 
       732 . 1 1  63  63 GLN HE22 H  1   6.81  0.02 . 1 . . . .  63 Gln HE22 . 15089 1 
       733 . 1 1  63  63 GLN C    C 13 178.1   0.15 . 1 . . . .  63 Gln C    . 15089 1 
       734 . 1 1  63  63 GLN CA   C 13  58.8   0.15 . 1 . . . .  63 Gln CA   . 15089 1 
       735 . 1 1  63  63 GLN CB   C 13  29.3   0.15 . 1 . . . .  63 Gln CB   . 15089 1 
       736 . 1 1  63  63 GLN CG   C 13  33.7   0.15 . 1 . . . .  63 Gln CG   . 15089 1 
       737 . 1 1  63  63 GLN N    N 15 119.5   0.15 . 1 . . . .  63 Gln N    . 15089 1 
       738 . 1 1  63  63 GLN NE2  N 15 111.7   0.15 . 1 . . . .  63 Gln NE2  . 15089 1 
       739 . 1 1  64  64 GLU H    H  1   8.03  0.02 . 1 . . . .  64 Glu H    . 15089 1 
       740 . 1 1  64  64 GLU HA   H  1   4.23  0.02 . 1 . . . .  64 Glu HA   . 15089 1 
       741 . 1 1  64  64 GLU HB2  H  1   2.27  0.02 . 2 . . . .  64 Glu HB2  . 15089 1 
       742 . 1 1  64  64 GLU HB3  H  1   1.29  0.02 . 2 . . . .  64 Glu HB3  . 15089 1 
       743 . 1 1  64  64 GLU HG2  H  1   2.23  0.02 . 1 . . . .  64 Glu HG2  . 15089 1 
       744 . 1 1  64  64 GLU HG3  H  1   2.23  0.02 . 1 . . . .  64 Glu HG3  . 15089 1 
       745 . 1 1  64  64 GLU C    C 13 177.1   0.15 . 1 . . . .  64 Glu C    . 15089 1 
       746 . 1 1  64  64 GLU CA   C 13  56.2   0.15 . 1 . . . .  64 Glu CA   . 15089 1 
       747 . 1 1  64  64 GLU CB   C 13  31.2   0.15 . 1 . . . .  64 Glu CB   . 15089 1 
       748 . 1 1  64  64 GLU CG   C 13  37.4   0.15 . 1 . . . .  64 Glu CG   . 15089 1 
       749 . 1 1  64  64 GLU N    N 15 114.2   0.15 . 1 . . . .  64 Glu N    . 15089 1 
       750 . 1 1  65  65 GLY H    H  1   7.60  0.02 . 1 . . . .  65 Gly H    . 15089 1 
       751 . 1 1  65  65 GLY HA2  H  1   3.91  0.02 . 2 . . . .  65 Gly HA2  . 15089 1 
       752 . 1 1  65  65 GLY HA3  H  1   4.02  0.02 . 2 . . . .  65 Gly HA3  . 15089 1 
       753 . 1 1  65  65 GLY C    C 13 175.8   0.15 . 1 . . . .  65 Gly C    . 15089 1 
       754 . 1 1  65  65 GLY CA   C 13  46.6   0.15 . 1 . . . .  65 Gly CA   . 15089 1 
       755 . 1 1  65  65 GLY N    N 15 108.7   0.15 . 1 . . . .  65 Gly N    . 15089 1 
       756 . 1 1  66  66 TRP H    H  1   8.28  0.02 . 1 . . . .  66 Trp H    . 15089 1 
       757 . 1 1  66  66 TRP HA   H  1   4.55  0.02 . 1 . . . .  66 Trp HA   . 15089 1 
       758 . 1 1  66  66 TRP HB2  H  1   3.29  0.02 . 2 . . . .  66 Trp HB2  . 15089 1 
       759 . 1 1  66  66 TRP HB3  H  1   3.14  0.02 . 2 . . . .  66 Trp HB3  . 15089 1 
       760 . 1 1  66  66 TRP HD1  H  1   6.94  0.02 . 1 . . . .  66 Trp HD1  . 15089 1 
       761 . 1 1  66  66 TRP HE1  H  1  10.66  0.02 . 1 . . . .  66 Trp HE1  . 15089 1 
       762 . 1 1  66  66 TRP HE3  H  1   8.05  0.02 . 1 . . . .  66 Trp HE3  . 15089 1 
       763 . 1 1  66  66 TRP HZ2  H  1   7.30  0.02 . 1 . . . .  66 Trp HZ2  . 15089 1 
       764 . 1 1  66  66 TRP HZ3  H  1   6.86  0.02 . 1 . . . .  66 Trp HZ3  . 15089 1 
       765 . 1 1  66  66 TRP HH2  H  1   6.95  0.02 . 1 . . . .  66 Trp HH2  . 15089 1 
       766 . 1 1  66  66 TRP C    C 13 176.7   0.15 . 1 . . . .  66 Trp C    . 15089 1 
       767 . 1 1  66  66 TRP CA   C 13  55.1   0.15 . 1 . . . .  66 Trp CA   . 15089 1 
       768 . 1 1  66  66 TRP CB   C 13  30.5   0.15 . 1 . . . .  66 Trp CB   . 15089 1 
       769 . 1 1  66  66 TRP CD1  C 13 124.5   0.15 . 1 . . . .  66 Trp CD1  . 15089 1 
       770 . 1 1  66  66 TRP CE3  C 13 122.3   0.15 . 1 . . . .  66 Trp CE3  . 15089 1 
       771 . 1 1  66  66 TRP CZ2  C 13 114.0   0.15 . 1 . . . .  66 Trp CZ2  . 15089 1 
       772 . 1 1  66  66 TRP CZ3  C 13 120.5   0.15 . 1 . . . .  66 Trp CZ3  . 15089 1 
       773 . 1 1  66  66 TRP CH2  C 13 124.1   0.15 . 1 . . . .  66 Trp CH2  . 15089 1 
       774 . 1 1  66  66 TRP N    N 15 120.5   0.15 . 1 . . . .  66 Trp N    . 15089 1 
       775 . 1 1  66  66 TRP NE1  N 15 130.0   0.15 . 1 . . . .  66 Trp NE1  . 15089 1 
       776 . 1 1  67  67 ASN H    H  1   8.81  0.02 . 1 . . . .  67 Asn H    . 15089 1 
       777 . 1 1  67  67 ASN HA   H  1   4.82  0.02 . 1 . . . .  67 Asn HA   . 15089 1 
       778 . 1 1  67  67 ASN HB2  H  1   2.90  0.02 . 2 . . . .  67 Asn HB2  . 15089 1 
       779 . 1 1  67  67 ASN HB3  H  1   2.88  0.02 . 2 . . . .  67 Asn HB3  . 15089 1 
       780 . 1 1  67  67 ASN HD21 H  1   7.28  0.02 . 2 . . . .  67 Asn HD21 . 15089 1 
       781 . 1 1  67  67 ASN HD22 H  1   7.58  0.02 . 2 . . . .  67 Asn HD22 . 15089 1 
       782 . 1 1  67  67 ASN C    C 13 175.7   0.15 . 1 . . . .  67 Asn C    . 15089 1 
       783 . 1 1  67  67 ASN CA   C 13  52.7   0.15 . 1 . . . .  67 Asn CA   . 15089 1 
       784 . 1 1  67  67 ASN CB   C 13  39.1   0.15 . 1 . . . .  67 Asn CB   . 15089 1 
       785 . 1 1  67  67 ASN N    N 15 123.9   0.15 . 1 . . . .  67 Asn N    . 15089 1 
       786 . 1 1  67  67 ASN ND2  N 15 115.3   0.15 . 1 . . . .  67 Asn ND2  . 15089 1 
       787 . 1 1  68  68 PRO HA   H  1   4.52  0.02 . 1 . . . .  68 Pro HA   . 15089 1 
       788 . 1 1  68  68 PRO HB2  H  1   2.46  0.02 . 2 . . . .  68 Pro HB2  . 15089 1 
       789 . 1 1  68  68 PRO HB3  H  1   2.04  0.02 . 2 . . . .  68 Pro HB3  . 15089 1 
       790 . 1 1  68  68 PRO HG2  H  1   2.15  0.02 . 1 . . . .  68 Pro HG2  . 15089 1 
       791 . 1 1  68  68 PRO HG3  H  1   2.15  0.02 . 1 . . . .  68 Pro HG3  . 15089 1 
       792 . 1 1  68  68 PRO HD2  H  1   3.86  0.02 . 2 . . . .  68 Pro HD2  . 15089 1 
       793 . 1 1  68  68 PRO HD3  H  1   4.05  0.02 . 2 . . . .  68 Pro HD3  . 15089 1 
       794 . 1 1  68  68 PRO C    C 13 179.5   0.15 . 1 . . . .  68 Pro C    . 15089 1 
       795 . 1 1  68  68 PRO CA   C 13  65.4   0.15 . 1 . . . .  68 Pro CA   . 15089 1 
       796 . 1 1  68  68 PRO CB   C 13  32.3   0.15 . 1 . . . .  68 Pro CB   . 15089 1 
       797 . 1 1  68  68 PRO CG   C 13  27.9   0.15 . 1 . . . .  68 Pro CG   . 15089 1 
       798 . 1 1  68  68 PRO CD   C 13  51.3   0.15 . 1 . . . .  68 Pro CD   . 15089 1 
       799 . 1 1  69  69 GLU H    H  1   8.52  0.02 . 1 . . . .  69 Glu H    . 15089 1 
       800 . 1 1  69  69 GLU HA   H  1   4.15  0.02 . 1 . . . .  69 Glu HA   . 15089 1 
       801 . 1 1  69  69 GLU HB2  H  1   2.23  0.02 . 2 . . . .  69 Glu HB2  . 15089 1 
       802 . 1 1  69  69 GLU HB3  H  1   2.06  0.02 . 2 . . . .  69 Glu HB3  . 15089 1 
       803 . 1 1  69  69 GLU HG2  H  1   2.31  0.02 . 2 . . . .  69 Glu HG2  . 15089 1 
       804 . 1 1  69  69 GLU HG3  H  1   2.45  0.02 . 2 . . . .  69 Glu HG3  . 15089 1 
       805 . 1 1  69  69 GLU C    C 13 179.1   0.15 . 1 . . . .  69 Glu C    . 15089 1 
       806 . 1 1  69  69 GLU CA   C 13  58.8   0.15 . 1 . . . .  69 Glu CA   . 15089 1 
       807 . 1 1  69  69 GLU CB   C 13  29.6   0.15 . 1 . . . .  69 Glu CB   . 15089 1 
       808 . 1 1  69  69 GLU CG   C 13  36.7   0.15 . 1 . . . .  69 Glu CG   . 15089 1 
       809 . 1 1  69  69 GLU N    N 15 116.9   0.15 . 1 . . . .  69 Glu N    . 15089 1 
       810 . 1 1  70  70 PHE H    H  1   7.74  0.02 . 1 . . . .  70 Phe H    . 15089 1 
       811 . 1 1  70  70 PHE HA   H  1   3.81  0.02 . 1 . . . .  70 Phe HA   . 15089 1 
       812 . 1 1  70  70 PHE HB2  H  1   3.55  0.02 . 2 . . . .  70 Phe HB2  . 15089 1 
       813 . 1 1  70  70 PHE HB3  H  1   3.66  0.02 . 2 . . . .  70 Phe HB3  . 15089 1 
       814 . 1 1  70  70 PHE HD1  H  1   7.03  0.02 . 1 . . . .  70 Phe HD1  . 15089 1 
       815 . 1 1  70  70 PHE HD2  H  1   7.03  0.02 . 1 . . . .  70 Phe HD2  . 15089 1 
       816 . 1 1  70  70 PHE HE1  H  1   6.53  0.02 . 1 . . . .  70 Phe HE1  . 15089 1 
       817 . 1 1  70  70 PHE HE2  H  1   6.53  0.02 . 1 . . . .  70 Phe HE2  . 15089 1 
       818 . 1 1  70  70 PHE HZ   H  1   6.69  0.02 . 1 . . . .  70 Phe HZ   . 15089 1 
       819 . 1 1  70  70 PHE C    C 13 177.1   0.15 . 1 . . . .  70 Phe C    . 15089 1 
       820 . 1 1  70  70 PHE CA   C 13  62.5   0.15 . 1 . . . .  70 Phe CA   . 15089 1 
       821 . 1 1  70  70 PHE CB   C 13  38.5   0.15 . 1 . . . .  70 Phe CB   . 15089 1 
       822 . 1 1  70  70 PHE CD1  C 13 131.9   0.15 . 1 . . . .  70 Phe CD1  . 15089 1 
       823 . 1 1  70  70 PHE CD2  C 13 131.9   0.15 . 1 . . . .  70 Phe CD2  . 15089 1 
       824 . 1 1  70  70 PHE CE1  C 13 131.3   0.15 . 1 . . . .  70 Phe CE1  . 15089 1 
       825 . 1 1  70  70 PHE CE2  C 13 131.3   0.15 . 1 . . . .  70 Phe CE2  . 15089 1 
       826 . 1 1  70  70 PHE CZ   C 13 128.8   0.15 . 1 . . . .  70 Phe CZ   . 15089 1 
       827 . 1 1  70  70 PHE N    N 15 123.8   0.15 . 1 . . . .  70 Phe N    . 15089 1 
       828 . 1 1  71  71 THR H    H  1   8.67  0.02 . 1 . . . .  71 Thr H    . 15089 1 
       829 . 1 1  71  71 THR HA   H  1   3.61  0.02 . 1 . . . .  71 Thr HA   . 15089 1 
       830 . 1 1  71  71 THR HB   H  1   4.25  0.02 . 1 . . . .  71 Thr HB   . 15089 1 
       831 . 1 1  71  71 THR HG21 H  1   1.29  0.02 . 1 . . . .  71 Thr HG2  . 15089 1 
       832 . 1 1  71  71 THR HG22 H  1   1.29  0.02 . 1 . . . .  71 Thr HG2  . 15089 1 
       833 . 1 1  71  71 THR HG23 H  1   1.29  0.02 . 1 . . . .  71 Thr HG2  . 15089 1 
       834 . 1 1  71  71 THR C    C 13 175.8   0.15 . 1 . . . .  71 Thr C    . 15089 1 
       835 . 1 1  71  71 THR CA   C 13  67.1   0.15 . 1 . . . .  71 Thr CA   . 15089 1 
       836 . 1 1  71  71 THR CB   C 13  68.1   0.15 . 1 . . . .  71 Thr CB   . 15089 1 
       837 . 1 1  71  71 THR CG2  C 13  25.0   0.15 . 1 . . . .  71 Thr CG2  . 15089 1 
       838 . 1 1  71  71 THR N    N 15 116.2   0.15 . 1 . . . .  71 Thr N    . 15089 1 
       839 . 1 1  72  72 LYS H    H  1   8.00  0.02 . 1 . . . .  72 Lys H    . 15089 1 
       840 . 1 1  72  72 LYS HA   H  1   3.75  0.02 . 1 . . . .  72 Lys HA   . 15089 1 
       841 . 1 1  72  72 LYS HB2  H  1   1.82  0.02 . 2 . . . .  72 Lys HB2  . 15089 1 
       842 . 1 1  72  72 LYS HB3  H  1   1.78  0.02 . 2 . . . .  72 Lys HB3  . 15089 1 
       843 . 1 1  72  72 LYS HG2  H  1   1.52  0.02 . 2 . . . .  72 Lys HG2  . 15089 1 
       844 . 1 1  72  72 LYS HG3  H  1   1.32  0.02 . 2 . . . .  72 Lys HG3  . 15089 1 
       845 . 1 1  72  72 LYS HD2  H  1   1.66  0.02 . 1 . . . .  72 Lys HD2  . 15089 1 
       846 . 1 1  72  72 LYS HD3  H  1   1.66  0.02 . 1 . . . .  72 Lys HD3  . 15089 1 
       847 . 1 1  72  72 LYS HE2  H  1   2.90  0.02 . 1 . . . .  72 Lys HE2  . 15089 1 
       848 . 1 1  72  72 LYS HE3  H  1   2.90  0.02 . 1 . . . .  72 Lys HE3  . 15089 1 
       849 . 1 1  72  72 LYS C    C 13 179.7   0.15 . 1 . . . .  72 Lys C    . 15089 1 
       850 . 1 1  72  72 LYS CA   C 13  59.8   0.15 . 1 . . . .  72 Lys CA   . 15089 1 
       851 . 1 1  72  72 LYS CB   C 13  32.9   0.15 . 1 . . . .  72 Lys CB   . 15089 1 
       852 . 1 1  72  72 LYS CG   C 13  25.2   0.15 . 1 . . . .  72 Lys CG   . 15089 1 
       853 . 1 1  72  72 LYS CD   C 13  29.5   0.15 . 1 . . . .  72 Lys CD   . 15089 1 
       854 . 1 1  72  72 LYS CE   C 13  42.0   0.15 . 1 . . . .  72 Lys CE   . 15089 1 
       855 . 1 1  72  72 LYS N    N 15 118.5   0.15 . 1 . . . .  72 Lys N    . 15089 1 
       856 . 1 1  73  73 LYS H    H  1   7.40  0.02 . 1 . . . .  73 Lys H    . 15089 1 
       857 . 1 1  73  73 LYS HA   H  1   3.55  0.02 . 1 . . . .  73 Lys HA   . 15089 1 
       858 . 1 1  73  73 LYS HB2  H  1   0.77  0.02 . 2 . . . .  73 Lys HB2  . 15089 1 
       859 . 1 1  73  73 LYS HB3  H  1   1.49  0.02 . 2 . . . .  73 Lys HB3  . 15089 1 
       860 . 1 1  73  73 LYS HG2  H  1   1.17  0.02 . 1 . . . .  73 Lys HG2  . 15089 1 
       861 . 1 1  73  73 LYS HG3  H  1   1.17  0.02 . 1 . . . .  73 Lys HG3  . 15089 1 
       862 . 1 1  73  73 LYS HD2  H  1   1.56  0.02 . 2 . . . .  73 Lys HD2  . 15089 1 
       863 . 1 1  73  73 LYS HD3  H  1   1.66  0.02 . 2 . . . .  73 Lys HD3  . 15089 1 
       864 . 1 1  73  73 LYS HE2  H  1   3.05  0.02 . 1 . . . .  73 Lys HE2  . 15089 1 
       865 . 1 1  73  73 LYS HE3  H  1   3.05  0.02 . 1 . . . .  73 Lys HE3  . 15089 1 
       866 . 1 1  73  73 LYS C    C 13 177.9   0.15 . 1 . . . .  73 Lys C    . 15089 1 
       867 . 1 1  73  73 LYS CA   C 13  58.2   0.15 . 1 . . . .  73 Lys CA   . 15089 1 
       868 . 1 1  73  73 LYS CB   C 13  31.2   0.15 . 1 . . . .  73 Lys CB   . 15089 1 
       869 . 1 1  73  73 LYS CG   C 13  25.1   0.15 . 1 . . . .  73 Lys CG   . 15089 1 
       870 . 1 1  73  73 LYS CD   C 13  28.9   0.15 . 1 . . . .  73 Lys CD   . 15089 1 
       871 . 1 1  73  73 LYS CE   C 13  42.4   0.15 . 1 . . . .  73 Lys CE   . 15089 1 
       872 . 1 1  73  73 LYS N    N 15 120.5   0.15 . 1 . . . .  73 Lys N    . 15089 1 
       873 . 1 1  74  74 VAL H    H  1   7.57  0.02 . 1 . . . .  74 Val H    . 15089 1 
       874 . 1 1  74  74 VAL HA   H  1   3.05  0.02 . 1 . . . .  74 Val HA   . 15089 1 
       875 . 1 1  74  74 VAL HB   H  1   1.69  0.02 . 1 . . . .  74 Val HB   . 15089 1 
       876 . 1 1  74  74 VAL HG11 H  1   0.96  0.02 . 1 . . . .  74 Val HG1  . 15089 1 
       877 . 1 1  74  74 VAL HG12 H  1   0.96  0.02 . 1 . . . .  74 Val HG1  . 15089 1 
       878 . 1 1  74  74 VAL HG13 H  1   0.96  0.02 . 1 . . . .  74 Val HG1  . 15089 1 
       879 . 1 1  74  74 VAL HG21 H  1   0.15  0.02 . 1 . . . .  74 Val HG2  . 15089 1 
       880 . 1 1  74  74 VAL HG22 H  1   0.15  0.02 . 1 . . . .  74 Val HG2  . 15089 1 
       881 . 1 1  74  74 VAL HG23 H  1   0.15  0.02 . 1 . . . .  74 Val HG2  . 15089 1 
       882 . 1 1  74  74 VAL C    C 13 178.2   0.15 . 1 . . . .  74 Val C    . 15089 1 
       883 . 1 1  74  74 VAL CA   C 13  65.6   0.15 . 1 . . . .  74 Val CA   . 15089 1 
       884 . 1 1  74  74 VAL CB   C 13  30.7   0.15 . 1 . . . .  74 Val CB   . 15089 1 
       885 . 1 1  74  74 VAL CG1  C 13  22.9   0.15 . 1 . . . .  74 Val CG1  . 15089 1 
       886 . 1 1  74  74 VAL CG2  C 13  21.5   0.15 . 1 . . . .  74 Val CG2  . 15089 1 
       887 . 1 1  74  74 VAL N    N 15 118.5   0.15 . 1 . . . .  74 Val N    . 15089 1 
       888 . 1 1  75  75 ALA H    H  1   8.89  0.02 . 1 . . . .  75 Ala H    . 15089 1 
       889 . 1 1  75  75 ALA HA   H  1   3.85  0.02 . 1 . . . .  75 Ala HA   . 15089 1 
       890 . 1 1  75  75 ALA HB1  H  1   1.37  0.02 . 1 . . . .  75 Ala HB   . 15089 1 
       891 . 1 1  75  75 ALA HB2  H  1   1.37  0.02 . 1 . . . .  75 Ala HB   . 15089 1 
       892 . 1 1  75  75 ALA HB3  H  1   1.37  0.02 . 1 . . . .  75 Ala HB   . 15089 1 
       893 . 1 1  75  75 ALA C    C 13 179.7   0.15 . 1 . . . .  75 Ala C    . 15089 1 
       894 . 1 1  75  75 ALA CA   C 13  55.6   0.15 . 1 . . . .  75 Ala CA   . 15089 1 
       895 . 1 1  75  75 ALA CB   C 13  18.0   0.15 . 1 . . . .  75 Ala CB   . 15089 1 
       896 . 1 1  75  75 ALA N    N 15 122.5   0.15 . 1 . . . .  75 Ala N    . 15089 1 
       897 . 1 1  76  76 GLY H    H  1   7.84  0.02 . 1 . . . .  76 Gly H    . 15089 1 
       898 . 1 1  76  76 GLY HA2  H  1   3.90  0.02 . 2 . . . .  76 Gly HA2  . 15089 1 
       899 . 1 1  76  76 GLY HA3  H  1   3.85  0.02 . 2 . . . .  76 Gly HA3  . 15089 1 
       900 . 1 1  76  76 GLY C    C 13 177.4   0.15 . 1 . . . .  76 Gly C    . 15089 1 
       901 . 1 1  76  76 GLY CA   C 13  47.0   0.15 . 1 . . . .  76 Gly CA   . 15089 1 
       902 . 1 1  76  76 GLY N    N 15 106.7   0.15 . 1 . . . .  76 Gly N    . 15089 1 
       903 . 1 1  77  77 TRP H    H  1   7.87  0.02 . 1 . . . .  77 Trp H    . 15089 1 
       904 . 1 1  77  77 TRP HA   H  1   4.64  0.02 . 1 . . . .  77 Trp HA   . 15089 1 
       905 . 1 1  77  77 TRP HB2  H  1   2.85  0.02 . 2 . . . .  77 Trp HB2  . 15089 1 
       906 . 1 1  77  77 TRP HB3  H  1   3.50  0.02 . 2 . . . .  77 Trp HB3  . 15089 1 
       907 . 1 1  77  77 TRP HD1  H  1   7.12  0.02 . 1 . . . .  77 Trp HD1  . 15089 1 
       908 . 1 1  77  77 TRP HE1  H  1  10.24  0.02 . 1 . . . .  77 Trp HE1  . 15089 1 
       909 . 1 1  77  77 TRP HE3  H  1   7.12  0.02 . 1 . . . .  77 Trp HE3  . 15089 1 
       910 . 1 1  77  77 TRP HZ2  H  1   7.36  0.02 . 1 . . . .  77 Trp HZ2  . 15089 1 
       911 . 1 1  77  77 TRP HZ3  H  1   6.64  0.02 . 1 . . . .  77 Trp HZ3  . 15089 1 
       912 . 1 1  77  77 TRP HH2  H  1   6.86  0.02 . 1 . . . .  77 Trp HH2  . 15089 1 
       913 . 1 1  77  77 TRP C    C 13 178.2   0.15 . 1 . . . .  77 Trp C    . 15089 1 
       914 . 1 1  77  77 TRP CA   C 13  58.8   0.15 . 1 . . . .  77 Trp CA   . 15089 1 
       915 . 1 1  77  77 TRP CB   C 13  27.9   0.15 . 1 . . . .  77 Trp CB   . 15089 1 
       916 . 1 1  77  77 TRP CD1  C 13 125.2   0.15 . 1 . . . .  77 Trp CD1  . 15089 1 
       917 . 1 1  77  77 TRP CE3  C 13 119.9   0.15 . 1 . . . .  77 Trp CE3  . 15089 1 
       918 . 1 1  77  77 TRP CZ2  C 13 114.4   0.15 . 1 . . . .  77 Trp CZ2  . 15089 1 
       919 . 1 1  77  77 TRP CZ3  C 13 121.5   0.15 . 1 . . . .  77 Trp CZ3  . 15089 1 
       920 . 1 1  77  77 TRP CH2  C 13 123.1   0.15 . 1 . . . .  77 Trp CH2  . 15089 1 
       921 . 1 1  77  77 TRP N    N 15 124.5   0.15 . 1 . . . .  77 Trp N    . 15089 1 
       922 . 1 1  77  77 TRP NE1  N 15 129.6   0.15 . 1 . . . .  77 Trp NE1  . 15089 1 
       923 . 1 1  78  78 ALA H    H  1   8.70  0.02 . 1 . . . .  78 Ala H    . 15089 1 
       924 . 1 1  78  78 ALA HA   H  1   4.12  0.02 . 1 . . . .  78 Ala HA   . 15089 1 
       925 . 1 1  78  78 ALA HB1  H  1   1.54  0.02 . 1 . . . .  78 Ala HB   . 15089 1 
       926 . 1 1  78  78 ALA HB2  H  1   1.54  0.02 . 1 . . . .  78 Ala HB   . 15089 1 
       927 . 1 1  78  78 ALA HB3  H  1   1.54  0.02 . 1 . . . .  78 Ala HB   . 15089 1 
       928 . 1 1  78  78 ALA C    C 13 180.4   0.15 . 1 . . . .  78 Ala C    . 15089 1 
       929 . 1 1  78  78 ALA CA   C 13  55.3   0.15 . 1 . . . .  78 Ala CA   . 15089 1 
       930 . 1 1  78  78 ALA CB   C 13  16.9   0.15 . 1 . . . .  78 Ala CB   . 15089 1 
       931 . 1 1  78  78 ALA N    N 15 121.5   0.15 . 1 . . . .  78 Ala N    . 15089 1 
       932 . 1 1  79  79 GLU H    H  1   8.62  0.02 . 1 . . . .  79 Glu H    . 15089 1 
       933 . 1 1  79  79 GLU HA   H  1   3.99  0.02 . 1 . . . .  79 Glu HA   . 15089 1 
       934 . 1 1  79  79 GLU HB2  H  1   2.38  0.02 . 2 . . . .  79 Glu HB2  . 15089 1 
       935 . 1 1  79  79 GLU HB3  H  1   2.17  0.02 . 2 . . . .  79 Glu HB3  . 15089 1 
       936 . 1 1  79  79 GLU HG2  H  1   2.37  0.02 . 2 . . . .  79 Glu HG2  . 15089 1 
       937 . 1 1  79  79 GLU HG3  H  1   2.24  0.02 . 2 . . . .  79 Glu HG3  . 15089 1 
       938 . 1 1  79  79 GLU C    C 13 178.7   0.15 . 1 . . . .  79 Glu C    . 15089 1 
       939 . 1 1  79  79 GLU CA   C 13  59.6   0.15 . 1 . . . .  79 Glu CA   . 15089 1 
       940 . 1 1  79  79 GLU CB   C 13  29.8   0.15 . 1 . . . .  79 Glu CB   . 15089 1 
       941 . 1 1  79  79 GLU CG   C 13  36.0   0.15 . 1 . . . .  79 Glu CG   . 15089 1 
       942 . 1 1  79  79 GLU N    N 15 121.6   0.15 . 1 . . . .  79 Glu N    . 15089 1 
       943 . 1 1  80  80 LYS H    H  1   8.09  0.02 . 1 . . . .  80 Lys H    . 15089 1 
       944 . 1 1  80  80 LYS HA   H  1   4.06  0.02 . 1 . . . .  80 Lys HA   . 15089 1 
       945 . 1 1  80  80 LYS HB2  H  1   1.81  0.02 . 2 . . . .  80 Lys HB2  . 15089 1 
       946 . 1 1  80  80 LYS HB3  H  1   2.11  0.02 . 2 . . . .  80 Lys HB3  . 15089 1 
       947 . 1 1  80  80 LYS HG2  H  1   1.67  0.02 . 2 . . . .  80 Lys HG2  . 15089 1 
       948 . 1 1  80  80 LYS HG3  H  1   1.55  0.02 . 2 . . . .  80 Lys HG3  . 15089 1 
       949 . 1 1  80  80 LYS HD2  H  1   1.74  0.02 . 1 . . . .  80 Lys HD2  . 15089 1 
       950 . 1 1  80  80 LYS HD3  H  1   1.74  0.02 . 1 . . . .  80 Lys HD3  . 15089 1 
       951 . 1 1  80  80 LYS HE2  H  1   3.03  0.02 . 1 . . . .  80 Lys HE2  . 15089 1 
       952 . 1 1  80  80 LYS HE3  H  1   3.03  0.02 . 1 . . . .  80 Lys HE3  . 15089 1 
       953 . 1 1  80  80 LYS C    C 13 179.5   0.15 . 1 . . . .  80 Lys C    . 15089 1 
       954 . 1 1  80  80 LYS CA   C 13  59.4   0.15 . 1 . . . .  80 Lys CA   . 15089 1 
       955 . 1 1  80  80 LYS CB   C 13  32.6   0.15 . 1 . . . .  80 Lys CB   . 15089 1 
       956 . 1 1  80  80 LYS CG   C 13  25.4   0.15 . 1 . . . .  80 Lys CG   . 15089 1 
       957 . 1 1  80  80 LYS CD   C 13  29.2   0.15 . 1 . . . .  80 Lys CD   . 15089 1 
       958 . 1 1  80  80 LYS CE   C 13  42.4   0.15 . 1 . . . .  80 Lys CE   . 15089 1 
       959 . 1 1  80  80 LYS N    N 15 120.4   0.15 . 1 . . . .  80 Lys N    . 15089 1 
       960 . 1 1  81  81 VAL H    H  1   8.37  0.02 . 1 . . . .  81 Val H    . 15089 1 
       961 . 1 1  81  81 VAL HA   H  1   3.58  0.02 . 1 . . . .  81 Val HA   . 15089 1 
       962 . 1 1  81  81 VAL HB   H  1   2.03  0.02 . 1 . . . .  81 Val HB   . 15089 1 
       963 . 1 1  81  81 VAL HG11 H  1   0.72  0.02 . 1 . . . .  81 Val HG1  . 15089 1 
       964 . 1 1  81  81 VAL HG12 H  1   0.72  0.02 . 1 . . . .  81 Val HG1  . 15089 1 
       965 . 1 1  81  81 VAL HG13 H  1   0.72  0.02 . 1 . . . .  81 Val HG1  . 15089 1 
       966 . 1 1  81  81 VAL HG21 H  1   0.99  0.02 . 1 . . . .  81 Val HG2  . 15089 1 
       967 . 1 1  81  81 VAL HG22 H  1   0.99  0.02 . 1 . . . .  81 Val HG2  . 15089 1 
       968 . 1 1  81  81 VAL HG23 H  1   0.99  0.02 . 1 . . . .  81 Val HG2  . 15089 1 
       969 . 1 1  81  81 VAL C    C 13 179.0   0.15 . 1 . . . .  81 Val C    . 15089 1 
       970 . 1 1  81  81 VAL CA   C 13  65.7   0.15 . 1 . . . .  81 Val CA   . 15089 1 
       971 . 1 1  81  81 VAL CB   C 13  32.0   0.15 . 1 . . . .  81 Val CB   . 15089 1 
       972 . 1 1  81  81 VAL CG1  C 13  22.2   0.15 . 1 . . . .  81 Val CG1  . 15089 1 
       973 . 1 1  81  81 VAL CG2  C 13  23.2   0.15 . 1 . . . .  81 Val CG2  . 15089 1 
       974 . 1 1  81  81 VAL N    N 15 118.6   0.15 . 1 . . . .  81 Val N    . 15089 1 
       975 . 1 1  82  82 ALA H    H  1   8.27  0.02 . 1 . . . .  82 Ala H    . 15089 1 
       976 . 1 1  82  82 ALA HA   H  1   4.08  0.02 . 1 . . . .  82 Ala HA   . 15089 1 
       977 . 1 1  82  82 ALA HB1  H  1   1.59  0.02 . 1 . . . .  82 Ala HB   . 15089 1 
       978 . 1 1  82  82 ALA HB2  H  1   1.59  0.02 . 1 . . . .  82 Ala HB   . 15089 1 
       979 . 1 1  82  82 ALA HB3  H  1   1.59  0.02 . 1 . . . .  82 Ala HB   . 15089 1 
       980 . 1 1  82  82 ALA C    C 13 179.2   0.15 . 1 . . . .  82 Ala C    . 15089 1 
       981 . 1 1  82  82 ALA CA   C 13  54.7   0.15 . 1 . . . .  82 Ala CA   . 15089 1 
       982 . 1 1  82  82 ALA CB   C 13  18.0   0.15 . 1 . . . .  82 Ala CB   . 15089 1 
       983 . 1 1  82  82 ALA N    N 15 121.5   0.15 . 1 . . . .  82 Ala N    . 15089 1 
       984 . 1 1  83  83 SER H    H  1   7.82  0.02 . 1 . . . .  83 Ser H    . 15089 1 
       985 . 1 1  83  83 SER HA   H  1   4.47  0.02 . 1 . . . .  83 Ser HA   . 15089 1 
       986 . 1 1  83  83 SER HB2  H  1   4.07  0.02 . 1 . . . .  83 Ser HB2  . 15089 1 
       987 . 1 1  83  83 SER HB3  H  1   4.07  0.02 . 1 . . . .  83 Ser HB3  . 15089 1 
       988 . 1 1  83  83 SER C    C 13 174.8   0.15 . 1 . . . .  83 Ser C    . 15089 1 
       989 . 1 1  83  83 SER CA   C 13  59.2   0.15 . 1 . . . .  83 Ser CA   . 15089 1 
       990 . 1 1  83  83 SER CB   C 13  64.1   0.15 . 1 . . . .  83 Ser CB   . 15089 1 
       991 . 1 1  83  83 SER N    N 15 111.7   0.15 . 1 . . . .  83 Ser N    . 15089 1 
       992 . 1 1  84  84 GLY H    H  1   7.74  0.02 . 1 . . . .  84 Gly H    . 15089 1 
       993 . 1 1  84  84 GLY HA2  H  1   4.22  0.02 . 2 . . . .  84 Gly HA2  . 15089 1 
       994 . 1 1  84  84 GLY HA3  H  1   3.76  0.02 . 2 . . . .  84 Gly HA3  . 15089 1 
       995 . 1 1  84  84 GLY C    C 13 174.4   0.15 . 1 . . . .  84 Gly C    . 15089 1 
       996 . 1 1  84  84 GLY CA   C 13  45.8   0.15 . 1 . . . .  84 Gly CA   . 15089 1 
       997 . 1 1  84  84 GLY N    N 15 108.8   0.15 . 1 . . . .  84 Gly N    . 15089 1 
       998 . 1 1  85  85 ASN H    H  1   7.83  0.02 . 1 . . . .  85 Asn H    . 15089 1 
       999 . 1 1  85  85 ASN HA   H  1   4.64  0.02 . 1 . . . .  85 Asn HA   . 15089 1 
      1000 . 1 1  85  85 ASN HB2  H  1   2.51  0.02 . 2 . . . .  85 Asn HB2  . 15089 1 
      1001 . 1 1  85  85 ASN HB3  H  1   2.67  0.02 . 2 . . . .  85 Asn HB3  . 15089 1 
      1002 . 1 1  85  85 ASN HD21 H  1   7.50  0.02 . 1 . . . .  85 Asn HD21 . 15089 1 
      1003 . 1 1  85  85 ASN HD22 H  1   7.13  0.02 . 1 . . . .  85 Asn HD22 . 15089 1 
      1004 . 1 1  85  85 ASN C    C 13 174.4   0.15 . 1 . . . .  85 Asn C    . 15089 1 
      1005 . 1 1  85  85 ASN CA   C 13  53.3   0.15 . 1 . . . .  85 Asn CA   . 15089 1 
      1006 . 1 1  85  85 ASN CB   C 13  40.2   0.15 . 1 . . . .  85 Asn CB   . 15089 1 
      1007 . 1 1  85  85 ASN N    N 15 118.4   0.15 . 1 . . . .  85 Asn N    . 15089 1 
      1008 . 1 1  85  85 ASN ND2  N 15 113.4   0.15 . 1 . . . .  85 Asn ND2  . 15089 1 
      1009 . 1 1  86  86 ARG H    H  1   8.50  0.02 . 1 . . . .  86 Arg H    . 15089 1 
      1010 . 1 1  86  86 ARG HA   H  1   4.25  0.02 . 1 . . . .  86 Arg HA   . 15089 1 
      1011 . 1 1  86  86 ARG HB2  H  1   1.73  0.02 . 1 . . . .  86 Arg HB2  . 15089 1 
      1012 . 1 1  86  86 ARG HB3  H  1   1.73  0.02 . 1 . . . .  86 Arg HB3  . 15089 1 
      1013 . 1 1  86  86 ARG HG2  H  1   1.66  0.02 . 2 . . . .  86 Arg HG2  . 15089 1 
      1014 . 1 1  86  86 ARG HG3  H  1   1.51  0.02 . 2 . . . .  86 Arg HG3  . 15089 1 
      1015 . 1 1  86  86 ARG HD2  H  1   3.17  0.02 . 1 . . . .  86 Arg HD2  . 15089 1 
      1016 . 1 1  86  86 ARG HD3  H  1   3.17  0.02 . 1 . . . .  86 Arg HD3  . 15089 1 
      1017 . 1 1  86  86 ARG HE   H  1   7.18  0.02 . 1 . . . .  86 Arg HE   . 15089 1 
      1018 . 1 1  86  86 ARG C    C 13 175.9   0.15 . 1 . . . .  86 Arg C    . 15089 1 
      1019 . 1 1  86  86 ARG CA   C 13  56.5   0.15 . 1 . . . .  86 Arg CA   . 15089 1 
      1020 . 1 1  86  86 ARG CB   C 13  30.3   0.15 . 1 . . . .  86 Arg CB   . 15089 1 
      1021 . 1 1  86  86 ARG CG   C 13  27.2   0.15 . 1 . . . .  86 Arg CG   . 15089 1 
      1022 . 1 1  86  86 ARG CD   C 13  43.4   0.15 . 1 . . . .  86 Arg CD   . 15089 1 
      1023 . 1 1  86  86 ARG N    N 15 121.6   0.15 . 1 . . . .  86 Arg N    . 15089 1 
      1024 . 1 1  86  86 ARG NE   N 15  84.7   0.15 . 1 . . . .  86 Arg NE   . 15089 1 
      1025 . 1 1  87  87 ILE H    H  1   8.16  0.02 . 1 . . . .  87 Ile H    . 15089 1 
      1026 . 1 1  87  87 ILE HA   H  1   4.42  0.02 . 1 . . . .  87 Ile HA   . 15089 1 
      1027 . 1 1  87  87 ILE HB   H  1   1.56  0.02 . 1 . . . .  87 Ile HB   . 15089 1 
      1028 . 1 1  87  87 ILE HG12 H  1   1.03  0.02 . 2 . . . .  87 Ile HG12 . 15089 1 
      1029 . 1 1  87  87 ILE HG13 H  1   1.34  0.02 . 2 . . . .  87 Ile HG13 . 15089 1 
      1030 . 1 1  87  87 ILE HG21 H  1   0.78  0.02 . 1 . . . .  87 Ile HG2  . 15089 1 
      1031 . 1 1  87  87 ILE HG22 H  1   0.78  0.02 . 1 . . . .  87 Ile HG2  . 15089 1 
      1032 . 1 1  87  87 ILE HG23 H  1   0.78  0.02 . 1 . . . .  87 Ile HG2  . 15089 1 
      1033 . 1 1  87  87 ILE HD11 H  1   0.73  0.02 . 1 . . . .  87 Ile HD1  . 15089 1 
      1034 . 1 1  87  87 ILE HD12 H  1   0.73  0.02 . 1 . . . .  87 Ile HD1  . 15089 1 
      1035 . 1 1  87  87 ILE HD13 H  1   0.73  0.02 . 1 . . . .  87 Ile HD1  . 15089 1 
      1036 . 1 1  87  87 ILE C    C 13 173.9   0.15 . 1 . . . .  87 Ile C    . 15089 1 
      1037 . 1 1  87  87 ILE CA   C 13  59.0   0.15 . 1 . . . .  87 Ile CA   . 15089 1 
      1038 . 1 1  87  87 ILE CB   C 13  41.0   0.15 . 1 . . . .  87 Ile CB   . 15089 1 
      1039 . 1 1  87  87 ILE CG1  C 13  26.9   0.15 . 1 . . . .  87 Ile CG1  . 15089 1 
      1040 . 1 1  87  87 ILE CG2  C 13  17.4   0.15 . 1 . . . .  87 Ile CG2  . 15089 1 
      1041 . 1 1  87  87 ILE CD1  C 13  14.1   0.15 . 1 . . . .  87 Ile CD1  . 15089 1 
      1042 . 1 1  87  87 ILE N    N 15 121.9   0.15 . 1 . . . .  87 Ile N    . 15089 1 
      1043 . 1 1  88  88 LEU H    H  1   8.39  0.02 . 1 . . . .  88 Leu H    . 15089 1 
      1044 . 1 1  88  88 LEU HA   H  1   4.32  0.02 . 1 . . . .  88 Leu HA   . 15089 1 
      1045 . 1 1  88  88 LEU HB2  H  1   1.47  0.02 . 1 . . . .  88 Leu HB2  . 15089 1 
      1046 . 1 1  88  88 LEU HB3  H  1   1.47  0.02 . 1 . . . .  88 Leu HB3  . 15089 1 
      1047 . 1 1  88  88 LEU HG   H  1   1.39  0.02 . 1 . . . .  88 Leu HG   . 15089 1 
      1048 . 1 1  88  88 LEU HD11 H  1   0.82  0.02 . 1 . . . .  88 Leu HD1  . 15089 1 
      1049 . 1 1  88  88 LEU HD12 H  1   0.82  0.02 . 1 . . . .  88 Leu HD1  . 15089 1 
      1050 . 1 1  88  88 LEU HD13 H  1   0.82  0.02 . 1 . . . .  88 Leu HD1  . 15089 1 
      1051 . 1 1  88  88 LEU HD21 H  1   0.78  0.02 . 1 . . . .  88 Leu HD2  . 15089 1 
      1052 . 1 1  88  88 LEU HD22 H  1   0.78  0.02 . 1 . . . .  88 Leu HD2  . 15089 1 
      1053 . 1 1  88  88 LEU HD23 H  1   0.78  0.02 . 1 . . . .  88 Leu HD2  . 15089 1 
      1054 . 1 1  88  88 LEU C    C 13 175.8   0.15 . 1 . . . .  88 Leu C    . 15089 1 
      1055 . 1 1  88  88 LEU CA   C 13  54.7   0.15 . 1 . . . .  88 Leu CA   . 15089 1 
      1056 . 1 1  88  88 LEU CB   C 13  42.3   0.15 . 1 . . . .  88 Leu CB   . 15089 1 
      1057 . 1 1  88  88 LEU CG   C 13  27.3   0.15 . 1 . . . .  88 Leu CG   . 15089 1 
      1058 . 1 1  88  88 LEU CD1  C 13  24.3   0.15 . 1 . . . .  88 Leu CD1  . 15089 1 
      1059 . 1 1  88  88 LEU CD2  C 13  24.3   0.15 . 1 . . . .  88 Leu CD2  . 15089 1 
      1060 . 1 1  88  88 LEU N    N 15 127.4   0.15 . 1 . . . .  88 Leu N    . 15089 1 
      1061 . 1 1  89  89 ILE H    H  1   8.45  0.02 . 1 . . . .  89 Ile H    . 15089 1 
      1062 . 1 1  89  89 ILE HA   H  1   4.09  0.02 . 1 . . . .  89 Ile HA   . 15089 1 
      1063 . 1 1  89  89 ILE HB   H  1   1.69  0.02 . 1 . . . .  89 Ile HB   . 15089 1 
      1064 . 1 1  89  89 ILE HG12 H  1   1.44  0.02 . 2 . . . .  89 Ile HG12 . 15089 1 
      1065 . 1 1  89  89 ILE HG13 H  1   0.65  0.02 . 2 . . . .  89 Ile HG13 . 15089 1 
      1066 . 1 1  89  89 ILE HG21 H  1   0.72  0.02 . 1 . . . .  89 Ile HG2  . 15089 1 
      1067 . 1 1  89  89 ILE HG22 H  1   0.72  0.02 . 1 . . . .  89 Ile HG2  . 15089 1 
      1068 . 1 1  89  89 ILE HG23 H  1   0.72  0.02 . 1 . . . .  89 Ile HG2  . 15089 1 
      1069 . 1 1  89  89 ILE HD11 H  1   0.69  0.02 . 1 . . . .  89 Ile HD1  . 15089 1 
      1070 . 1 1  89  89 ILE HD12 H  1   0.69  0.02 . 1 . . . .  89 Ile HD1  . 15089 1 
      1071 . 1 1  89  89 ILE HD13 H  1   0.69  0.02 . 1 . . . .  89 Ile HD1  . 15089 1 
      1072 . 1 1  89  89 ILE C    C 13 175.6   0.15 . 1 . . . .  89 Ile C    . 15089 1 
      1073 . 1 1  89  89 ILE CA   C 13  60.7   0.15 . 1 . . . .  89 Ile CA   . 15089 1 
      1074 . 1 1  89  89 ILE CB   C 13  38.9   0.15 . 1 . . . .  89 Ile CB   . 15089 1 
      1075 . 1 1  89  89 ILE CG1  C 13  27.7   0.15 . 1 . . . .  89 Ile CG1  . 15089 1 
      1076 . 1 1  89  89 ILE CG2  C 13  17.7   0.15 . 1 . . . .  89 Ile CG2  . 15089 1 
      1077 . 1 1  89  89 ILE CD1  C 13  12.9   0.15 . 1 . . . .  89 Ile CD1  . 15089 1 
      1078 . 1 1  89  89 ILE N    N 15 126.0   0.15 . 1 . . . .  89 Ile N    . 15089 1 
      1079 . 1 1  90  90 LYS H    H  1   8.99  0.02 . 1 . . . .  90 Lys H    . 15089 1 
      1080 . 1 1  90  90 LYS HA   H  1   3.95  0.02 . 1 . . . .  90 Lys HA   . 15089 1 
      1081 . 1 1  90  90 LYS HB2  H  1   1.65  0.02 . 1 . . . .  90 Lys HB2  . 15089 1 
      1082 . 1 1  90  90 LYS HB3  H  1   1.65  0.02 . 1 . . . .  90 Lys HB3  . 15089 1 
      1083 . 1 1  90  90 LYS HG2  H  1   1.34  0.02 . 1 . . . .  90 Lys HG2  . 15089 1 
      1084 . 1 1  90  90 LYS HG3  H  1   1.34  0.02 . 1 . . . .  90 Lys HG3  . 15089 1 
      1085 . 1 1  90  90 LYS HD2  H  1   1.64  0.02 . 1 . . . .  90 Lys HD2  . 15089 1 
      1086 . 1 1  90  90 LYS HD3  H  1   1.64  0.02 . 1 . . . .  90 Lys HD3  . 15089 1 
      1087 . 1 1  90  90 LYS HE2  H  1   2.97  0.02 . 1 . . . .  90 Lys HE2  . 15089 1 
      1088 . 1 1  90  90 LYS HE3  H  1   2.97  0.02 . 1 . . . .  90 Lys HE3  . 15089 1 
      1089 . 1 1  90  90 LYS C    C 13 176.7   0.15 . 1 . . . .  90 Lys C    . 15089 1 
      1090 . 1 1  90  90 LYS CA   C 13  58.7   0.15 . 1 . . . .  90 Lys CA   . 15089 1 
      1091 . 1 1  90  90 LYS CB   C 13  33.0   0.15 . 1 . . . .  90 Lys CB   . 15089 1 
      1092 . 1 1  90  90 LYS CG   C 13  25.1   0.15 . 1 . . . .  90 Lys CG   . 15089 1 
      1093 . 1 1  90  90 LYS CD   C 13  29.2   0.15 . 1 . . . .  90 Lys CD   . 15089 1 
      1094 . 1 1  90  90 LYS CE   C 13  42.1   0.15 . 1 . . . .  90 Lys CE   . 15089 1 
      1095 . 1 1  90  90 LYS N    N 15 128.8   0.15 . 1 . . . .  90 Lys N    . 15089 1 
      1096 . 1 1  91  91 ASN H    H  1   7.86  0.02 . 1 . . . .  91 Asn H    . 15089 1 
      1097 . 1 1  91  91 ASN HA   H  1   5.08  0.02 . 1 . . . .  91 Asn HA   . 15089 1 
      1098 . 1 1  91  91 ASN HB2  H  1   2.31  0.02 . 2 . . . .  91 Asn HB2  . 15089 1 
      1099 . 1 1  91  91 ASN HB3  H  1   2.12  0.02 . 2 . . . .  91 Asn HB3  . 15089 1 
      1100 . 1 1  91  91 ASN HD21 H  1   6.83  0.02 . 2 . . . .  91 Asn HD21 . 15089 1 
      1101 . 1 1  91  91 ASN HD22 H  1   8.10  0.02 . 2 . . . .  91 Asn HD22 . 15089 1 
      1102 . 1 1  91  91 ASN CA   C 13  52.3   0.15 . 1 . . . .  91 Asn CA   . 15089 1 
      1103 . 1 1  91  91 ASN CB   C 13  40.2   0.15 . 1 . . . .  91 Asn CB   . 15089 1 
      1104 . 1 1  91  91 ASN N    N 15 114.2   0.15 . 1 . . . .  91 Asn N    . 15089 1 
      1105 . 1 1  91  91 ASN ND2  N 15 113.2   0.15 . 1 . . . .  91 Asn ND2  . 15089 1 
      1106 . 1 1  92  92 PRO HA   H  1   4.21  0.02 . 1 . . . .  92 Pro HA   . 15089 1 
      1107 . 1 1  92  92 PRO HB2  H  1   2.19  0.02 . 2 . . . .  92 Pro HB2  . 15089 1 
      1108 . 1 1  92  92 PRO HB3  H  1   2.05  0.02 . 2 . . . .  92 Pro HB3  . 15089 1 
      1109 . 1 1  92  92 PRO HG2  H  1   2.01  0.02 . 2 . . . .  92 Pro HG2  . 15089 1 
      1110 . 1 1  92  92 PRO HG3  H  1   1.96  0.02 . 2 . . . .  92 Pro HG3  . 15089 1 
      1111 . 1 1  92  92 PRO HD2  H  1   3.75  0.02 . 2 . . . .  92 Pro HD2  . 15089 1 
      1112 . 1 1  92  92 PRO HD3  H  1   3.40  0.02 . 2 . . . .  92 Pro HD3  . 15089 1 
      1113 . 1 1  92  92 PRO C    C 13 177.7   0.15 . 1 . . . .  92 Pro C    . 15089 1 
      1114 . 1 1  92  92 PRO CA   C 13  64.4   0.15 . 1 . . . .  92 Pro CA   . 15089 1 
      1115 . 1 1  92  92 PRO CB   C 13  32.0   0.15 . 1 . . . .  92 Pro CB   . 15089 1 
      1116 . 1 1  92  92 PRO CG   C 13  27.3   0.15 . 1 . . . .  92 Pro CG   . 15089 1 
      1117 . 1 1  92  92 PRO CD   C 13  50.6   0.15 . 1 . . . .  92 Pro CD   . 15089 1 
      1118 . 1 1  93  93 GLU H    H  1  10.02  0.02 . 1 . . . .  93 Glu H    . 15089 1 
      1119 . 1 1  93  93 GLU HA   H  1   4.10  0.02 . 1 . . . .  93 Glu HA   . 15089 1 
      1120 . 1 1  93  93 GLU HB2  H  1   1.95  0.02 . 2 . . . .  93 Glu HB2  . 15089 1 
      1121 . 1 1  93  93 GLU HB3  H  1   1.83  0.02 . 2 . . . .  93 Glu HB3  . 15089 1 
      1122 . 1 1  93  93 GLU HG2  H  1   2.18  0.02 . 2 . . . .  93 Glu HG2  . 15089 1 
      1123 . 1 1  93  93 GLU HG3  H  1   1.69  0.02 . 2 . . . .  93 Glu HG3  . 15089 1 
      1124 . 1 1  93  93 GLU C    C 13 177.1   0.15 . 1 . . . .  93 Glu C    . 15089 1 
      1125 . 1 1  93  93 GLU CA   C 13  58.2   0.15 . 1 . . . .  93 Glu CA   . 15089 1 
      1126 . 1 1  93  93 GLU CB   C 13  27.8   0.15 . 1 . . . .  93 Glu CB   . 15089 1 
      1127 . 1 1  93  93 GLU CG   C 13  35.0   0.15 . 1 . . . .  93 Glu CG   . 15089 1 
      1128 . 1 1  93  93 GLU N    N 15 119.5   0.15 . 1 . . . .  93 Glu N    . 15089 1 
      1129 . 1 1  94  94 TYR H    H  1   7.35  0.02 . 1 . . . .  94 Tyr H    . 15089 1 
      1130 . 1 1  94  94 TYR HA   H  1   4.51  0.02 . 1 . . . .  94 Tyr HA   . 15089 1 
      1131 . 1 1  94  94 TYR HB2  H  1   3.38  0.02 . 2 . . . .  94 Tyr HB2  . 15089 1 
      1132 . 1 1  94  94 TYR HB3  H  1   2.72  0.02 . 2 . . . .  94 Tyr HB3  . 15089 1 
      1133 . 1 1  94  94 TYR HD1  H  1   7.16  0.02 . 1 . . . .  94 Tyr HD1  . 15089 1 
      1134 . 1 1  94  94 TYR HD2  H  1   7.16  0.02 . 1 . . . .  94 Tyr HD2  . 15089 1 
      1135 . 1 1  94  94 TYR HE1  H  1   6.79  0.02 . 1 . . . .  94 Tyr HE1  . 15089 1 
      1136 . 1 1  94  94 TYR HE2  H  1   6.79  0.02 . 1 . . . .  94 Tyr HE2  . 15089 1 
      1137 . 1 1  94  94 TYR C    C 13 176.1   0.15 . 1 . . . .  94 Tyr C    . 15089 1 
      1138 . 1 1  94  94 TYR CA   C 13  58.6   0.15 . 1 . . . .  94 Tyr CA   . 15089 1 
      1139 . 1 1  94  94 TYR CB   C 13  37.5   0.15 . 1 . . . .  94 Tyr CB   . 15089 1 
      1140 . 1 1  94  94 TYR CD1  C 13 132.3   0.15 . 1 . . . .  94 Tyr CD1  . 15089 1 
      1141 . 1 1  94  94 TYR CD2  C 13 132.3   0.15 . 1 . . . .  94 Tyr CD2  . 15089 1 
      1142 . 1 1  94  94 TYR CE1  C 13 118.6   0.15 . 1 . . . .  94 Tyr CE1  . 15089 1 
      1143 . 1 1  94  94 TYR CE2  C 13 118.6   0.15 . 1 . . . .  94 Tyr CE2  . 15089 1 
      1144 . 1 1  94  94 TYR N    N 15 119.4   0.15 . 1 . . . .  94 Tyr N    . 15089 1 
      1145 . 1 1  95  95 PHE H    H  1   7.70  0.02 . 1 . . . .  95 Phe H    . 15089 1 
      1146 . 1 1  95  95 PHE HA   H  1   5.05  0.02 . 1 . . . .  95 Phe HA   . 15089 1 
      1147 . 1 1  95  95 PHE HB2  H  1   3.34  0.02 . 2 . . . .  95 Phe HB2  . 15089 1 
      1148 . 1 1  95  95 PHE HB3  H  1   3.05  0.02 . 2 . . . .  95 Phe HB3  . 15089 1 
      1149 . 1 1  95  95 PHE HD1  H  1   7.17  0.02 . 1 . . . .  95 Phe HD1  . 15089 1 
      1150 . 1 1  95  95 PHE HD2  H  1   7.17  0.02 . 1 . . . .  95 Phe HD2  . 15089 1 
      1151 . 1 1  95  95 PHE HE1  H  1   6.84  0.02 . 1 . . . .  95 Phe HE1  . 15089 1 
      1152 . 1 1  95  95 PHE HE2  H  1   6.84  0.02 . 1 . . . .  95 Phe HE2  . 15089 1 
      1153 . 1 1  95  95 PHE HZ   H  1   6.59  0.02 . 1 . . . .  95 Phe HZ   . 15089 1 
      1154 . 1 1  95  95 PHE C    C 13 176.2   0.15 . 1 . . . .  95 Phe C    . 15089 1 
      1155 . 1 1  95  95 PHE CA   C 13  55.0   0.15 . 1 . . . .  95 Phe CA   . 15089 1 
      1156 . 1 1  95  95 PHE CB   C 13  37.7   0.15 . 1 . . . .  95 Phe CB   . 15089 1 
      1157 . 1 1  95  95 PHE CD1  C 13 130.8   0.15 . 1 . . . .  95 Phe CD1  . 15089 1 
      1158 . 1 1  95  95 PHE CD2  C 13 130.8   0.15 . 1 . . . .  95 Phe CD2  . 15089 1 
      1159 . 1 1  95  95 PHE CE1  C 13 131.5   0.15 . 1 . . . .  95 Phe CE1  . 15089 1 
      1160 . 1 1  95  95 PHE CE2  C 13 131.5   0.15 . 1 . . . .  95 Phe CE2  . 15089 1 
      1161 . 1 1  95  95 PHE CZ   C 13 127.8   0.15 . 1 . . . .  95 Phe CZ   . 15089 1 
      1162 . 1 1  95  95 PHE N    N 15 120.6   0.15 . 1 . . . .  95 Phe N    . 15089 1 
      1163 . 1 1  96  96 SER H    H  1   7.53  0.02 . 1 . . . .  96 Ser H    . 15089 1 
      1164 . 1 1  96  96 SER HA   H  1   4.22  0.02 . 1 . . . .  96 Ser HA   . 15089 1 
      1165 . 1 1  96  96 SER HB2  H  1   4.25  0.02 . 2 . . . .  96 Ser HB2  . 15089 1 
      1166 . 1 1  96  96 SER HB3  H  1   3.98  0.02 . 2 . . . .  96 Ser HB3  . 15089 1 
      1167 . 1 1  96  96 SER C    C 13 174.7   0.15 . 1 . . . .  96 Ser C    . 15089 1 
      1168 . 1 1  96  96 SER CA   C 13  58.1   0.15 . 1 . . . .  96 Ser CA   . 15089 1 
      1169 . 1 1  96  96 SER CB   C 13  65.8   0.15 . 1 . . . .  96 Ser CB   . 15089 1 
      1170 . 1 1  96  96 SER N    N 15 122.9   0.15 . 1 . . . .  96 Ser N    . 15089 1 
      1171 . 1 1  97  97 THR H    H  1   8.68  0.02 . 1 . . . .  97 Thr H    . 15089 1 
      1172 . 1 1  97  97 THR HA   H  1   3.58  0.02 . 1 . . . .  97 Thr HA   . 15089 1 
      1173 . 1 1  97  97 THR HB   H  1   4.04  0.02 . 1 . . . .  97 Thr HB   . 15089 1 
      1174 . 1 1  97  97 THR HG21 H  1   1.15  0.02 . 1 . . . .  97 Thr HG2  . 15089 1 
      1175 . 1 1  97  97 THR HG22 H  1   1.15  0.02 . 1 . . . .  97 Thr HG2  . 15089 1 
      1176 . 1 1  97  97 THR HG23 H  1   1.15  0.02 . 1 . . . .  97 Thr HG2  . 15089 1 
      1177 . 1 1  97  97 THR C    C 13 175.9   0.15 . 1 . . . .  97 Thr C    . 15089 1 
      1178 . 1 1  97  97 THR CA   C 13  66.0   0.15 . 1 . . . .  97 Thr CA   . 15089 1 
      1179 . 1 1  97  97 THR CB   C 13  68.4   0.15 . 1 . . . .  97 Thr CB   . 15089 1 
      1180 . 1 1  97  97 THR CG2  C 13  22.1   0.15 . 1 . . . .  97 Thr CG2  . 15089 1 
      1181 . 1 1  97  97 THR N    N 15 116.4   0.15 . 1 . . . .  97 Thr N    . 15089 1 
      1182 . 1 1  98  98 TYR H    H  1   7.94  0.02 . 1 . . . .  98 Tyr H    . 15089 1 
      1183 . 1 1  98  98 TYR HA   H  1   4.31  0.02 . 1 . . . .  98 Tyr HA   . 15089 1 
      1184 . 1 1  98  98 TYR HB2  H  1   3.10  0.02 . 2 . . . .  98 Tyr HB2  . 15089 1 
      1185 . 1 1  98  98 TYR HB3  H  1   2.78  0.02 . 2 . . . .  98 Tyr HB3  . 15089 1 
      1186 . 1 1  98  98 TYR HD1  H  1   7.03  0.02 . 1 . . . .  98 Tyr HD1  . 15089 1 
      1187 . 1 1  98  98 TYR HD2  H  1   7.03  0.02 . 1 . . . .  98 Tyr HD2  . 15089 1 
      1188 . 1 1  98  98 TYR HE1  H  1   6.80  0.02 . 1 . . . .  98 Tyr HE1  . 15089 1 
      1189 . 1 1  98  98 TYR HE2  H  1   6.80  0.02 . 1 . . . .  98 Tyr HE2  . 15089 1 
      1190 . 1 1  98  98 TYR C    C 13 177.7   0.15 . 1 . . . .  98 Tyr C    . 15089 1 
      1191 . 1 1  98  98 TYR CA   C 13  60.7   0.15 . 1 . . . .  98 Tyr CA   . 15089 1 
      1192 . 1 1  98  98 TYR CB   C 13  38.1   0.15 . 1 . . . .  98 Tyr CB   . 15089 1 
      1193 . 1 1  98  98 TYR CD1  C 13 133.3   0.15 . 1 . . . .  98 Tyr CD1  . 15089 1 
      1194 . 1 1  98  98 TYR CD2  C 13 133.3   0.15 . 1 . . . .  98 Tyr CD2  . 15089 1 
      1195 . 1 1  98  98 TYR CE1  C 13 118.2   0.15 . 1 . . . .  98 Tyr CE1  . 15089 1 
      1196 . 1 1  98  98 TYR CE2  C 13 118.2   0.15 . 1 . . . .  98 Tyr CE2  . 15089 1 
      1197 . 1 1  98  98 TYR N    N 15 120.4   0.15 . 1 . . . .  98 Tyr N    . 15089 1 
      1198 . 1 1  99  99 MET H    H  1   7.32  0.02 . 1 . . . .  99 Met H    . 15089 1 
      1199 . 1 1  99  99 MET HA   H  1   3.69  0.02 . 1 . . . .  99 Met HA   . 15089 1 
      1200 . 1 1  99  99 MET HB2  H  1   1.87  0.02 . 2 . . . .  99 Met HB2  . 15089 1 
      1201 . 1 1  99  99 MET HB3  H  1   1.63  0.02 . 2 . . . .  99 Met HB3  . 15089 1 
      1202 . 1 1  99  99 MET HG2  H  1   2.22  0.02 . 2 . . . .  99 Met HG2  . 15089 1 
      1203 . 1 1  99  99 MET HG3  H  1   1.49  0.02 . 2 . . . .  99 Met HG3  . 15089 1 
      1204 . 1 1  99  99 MET HE1  H  1   1.72  0.02 . 1 . . . .  99 Met HE   . 15089 1 
      1205 . 1 1  99  99 MET HE2  H  1   1.72  0.02 . 1 . . . .  99 Met HE   . 15089 1 
      1206 . 1 1  99  99 MET HE3  H  1   1.72  0.02 . 1 . . . .  99 Met HE   . 15089 1 
      1207 . 1 1  99  99 MET C    C 13 177.7   0.15 . 1 . . . .  99 Met C    . 15089 1 
      1208 . 1 1  99  99 MET CA   C 13  59.5   0.15 . 1 . . . .  99 Met CA   . 15089 1 
      1209 . 1 1  99  99 MET CB   C 13  33.7   0.15 . 1 . . . .  99 Met CB   . 15089 1 
      1210 . 1 1  99  99 MET CG   C 13  33.0   0.15 . 1 . . . .  99 Met CG   . 15089 1 
      1211 . 1 1  99  99 MET CE   C 13  17.5   0.15 . 1 . . . .  99 Met CE   . 15089 1 
      1212 . 1 1  99  99 MET N    N 15 118.9   0.15 . 1 . . . .  99 Met N    . 15089 1 
      1213 . 1 1 100 100 GLN H    H  1   7.48  0.02 . 1 . . . . 100 Gln H    . 15089 1 
      1214 . 1 1 100 100 GLN HA   H  1   3.29  0.02 . 1 . . . . 100 Gln HA   . 15089 1 
      1215 . 1 1 100 100 GLN HB2  H  1   1.76  0.02 . 2 . . . . 100 Gln HB2  . 15089 1 
      1216 . 1 1 100 100 GLN HB3  H  1   1.55  0.02 . 2 . . . . 100 Gln HB3  . 15089 1 
      1217 . 1 1 100 100 GLN HG2  H  1   1.08  0.02 . 2 . . . . 100 Gln HG2  . 15089 1 
      1218 . 1 1 100 100 GLN HG3  H  1   0.97  0.02 . 2 . . . . 100 Gln HG3  . 15089 1 
      1219 . 1 1 100 100 GLN HE21 H  1   6.66  0.02 . 1 . . . . 100 Gln HE21 . 15089 1 
      1220 . 1 1 100 100 GLN HE22 H  1   5.93  0.02 . 1 . . . . 100 Gln HE22 . 15089 1 
      1221 . 1 1 100 100 GLN C    C 13 177.9   0.15 . 1 . . . . 100 Gln C    . 15089 1 
      1222 . 1 1 100 100 GLN CA   C 13  59.4   0.15 . 1 . . . . 100 Gln CA   . 15089 1 
      1223 . 1 1 100 100 GLN CB   C 13  28.3   0.15 . 1 . . . . 100 Gln CB   . 15089 1 
      1224 . 1 1 100 100 GLN CG   C 13  33.8   0.15 . 1 . . . . 100 Gln CG   . 15089 1 
      1225 . 1 1 100 100 GLN N    N 15 117.7   0.15 . 1 . . . . 100 Gln N    . 15089 1 
      1226 . 1 1 100 100 GLN NE2  N 15 111.7   0.15 . 1 . . . . 100 Gln NE2  . 15089 1 
      1227 . 1 1 101 101 GLU H    H  1   8.48  0.02 . 1 . . . . 101 Glu H    . 15089 1 
      1228 . 1 1 101 101 GLU HA   H  1   3.96  0.02 . 1 . . . . 101 Glu HA   . 15089 1 
      1229 . 1 1 101 101 GLU HB2  H  1   2.06  0.02 . 1 . . . . 101 Glu HB2  . 15089 1 
      1230 . 1 1 101 101 GLU HB3  H  1   2.06  0.02 . 1 . . . . 101 Glu HB3  . 15089 1 
      1231 . 1 1 101 101 GLU HG2  H  1   2.41  0.02 . 2 . . . . 101 Glu HG2  . 15089 1 
      1232 . 1 1 101 101 GLU HG3  H  1   2.30  0.02 . 2 . . . . 101 Glu HG3  . 15089 1 
      1233 . 1 1 101 101 GLU C    C 13 179.4   0.15 . 1 . . . . 101 Glu C    . 15089 1 
      1234 . 1 1 101 101 GLU CA   C 13  59.4   0.15 . 1 . . . . 101 Glu CA   . 15089 1 
      1235 . 1 1 101 101 GLU CB   C 13  29.3   0.15 . 1 . . . . 101 Glu CB   . 15089 1 
      1236 . 1 1 101 101 GLU CG   C 13  36.4   0.15 . 1 . . . . 101 Glu CG   . 15089 1 
      1237 . 1 1 101 101 GLU N    N 15 118.1   0.15 . 1 . . . . 101 Glu N    . 15089 1 
      1238 . 1 1 102 102 GLN H    H  1   7.82  0.02 . 1 . . . . 102 Gln H    . 15089 1 
      1239 . 1 1 102 102 GLN HA   H  1   4.06  0.02 . 1 . . . . 102 Gln HA   . 15089 1 
      1240 . 1 1 102 102 GLN HB2  H  1   2.21  0.02 . 2 . . . . 102 Gln HB2  . 15089 1 
      1241 . 1 1 102 102 GLN HB3  H  1   2.07  0.02 . 2 . . . . 102 Gln HB3  . 15089 1 
      1242 . 1 1 102 102 GLN HG2  H  1   2.26  0.02 . 2 . . . . 102 Gln HG2  . 15089 1 
      1243 . 1 1 102 102 GLN HG3  H  1   2.14  0.02 . 2 . . . . 102 Gln HG3  . 15089 1 
      1244 . 1 1 102 102 GLN HE21 H  1   6.84  0.02 . 1 . . . . 102 Gln HE21 . 15089 1 
      1245 . 1 1 102 102 GLN HE22 H  1   7.66  0.02 . 1 . . . . 102 Gln HE22 . 15089 1 
      1246 . 1 1 102 102 GLN C    C 13 179.0   0.15 . 1 . . . . 102 Gln C    . 15089 1 
      1247 . 1 1 102 102 GLN CA   C 13  59.1   0.15 . 1 . . . . 102 Gln CA   . 15089 1 
      1248 . 1 1 102 102 GLN CB   C 13  29.6   0.15 . 1 . . . . 102 Gln CB   . 15089 1 
      1249 . 1 1 102 102 GLN CG   C 13  34.9   0.15 . 1 . . . . 102 Gln CG   . 15089 1 
      1250 . 1 1 102 102 GLN N    N 15 117.5   0.15 . 1 . . . . 102 Gln N    . 15089 1 
      1251 . 1 1 102 102 GLN NE2  N 15 111.9   0.15 . 1 . . . . 102 Gln NE2  . 15089 1 
      1252 . 1 1 103 103 LEU H    H  1   7.85  0.02 . 1 . . . . 103 Leu H    . 15089 1 
      1253 . 1 1 103 103 LEU HA   H  1   4.19  0.02 . 1 . . . . 103 Leu HA   . 15089 1 
      1254 . 1 1 103 103 LEU HB2  H  1   2.33  0.02 . 2 . . . . 103 Leu HB2  . 15089 1 
      1255 . 1 1 103 103 LEU HB3  H  1   1.51  0.02 . 2 . . . . 103 Leu HB3  . 15089 1 
      1256 . 1 1 103 103 LEU HG   H  1   2.29  0.02 . 1 . . . . 103 Leu HG   . 15089 1 
      1257 . 1 1 103 103 LEU HD11 H  1   1.24  0.02 . 1 . . . . 103 Leu HD1  . 15089 1 
      1258 . 1 1 103 103 LEU HD12 H  1   1.24  0.02 . 1 . . . . 103 Leu HD1  . 15089 1 
      1259 . 1 1 103 103 LEU HD13 H  1   1.24  0.02 . 1 . . . . 103 Leu HD1  . 15089 1 
      1260 . 1 1 103 103 LEU HD21 H  1   0.99  0.02 . 1 . . . . 103 Leu HD2  . 15089 1 
      1261 . 1 1 103 103 LEU HD22 H  1   0.99  0.02 . 1 . . . . 103 Leu HD2  . 15089 1 
      1262 . 1 1 103 103 LEU HD23 H  1   0.99  0.02 . 1 . . . . 103 Leu HD2  . 15089 1 
      1263 . 1 1 103 103 LEU C    C 13 178.1   0.15 . 1 . . . . 103 Leu C    . 15089 1 
      1264 . 1 1 103 103 LEU CA   C 13  58.1   0.15 . 1 . . . . 103 Leu CA   . 15089 1 
      1265 . 1 1 103 103 LEU CB   C 13  41.8   0.15 . 1 . . . . 103 Leu CB   . 15089 1 
      1266 . 1 1 103 103 LEU CG   C 13  26.9   0.15 . 1 . . . . 103 Leu CG   . 15089 1 
      1267 . 1 1 103 103 LEU CD1  C 13  26.8   0.15 . 1 . . . . 103 Leu CD1  . 15089 1 
      1268 . 1 1 103 103 LEU CD2  C 13  23.1   0.15 . 1 . . . . 103 Leu CD2  . 15089 1 
      1269 . 1 1 103 103 LEU N    N 15 117.0   0.15 . 1 . . . . 103 Leu N    . 15089 1 
      1270 . 1 1 104 104 LYS H    H  1   8.85  0.02 . 1 . . . . 104 Lys H    . 15089 1 
      1271 . 1 1 104 104 LYS HA   H  1   3.84  0.02 . 1 . . . . 104 Lys HA   . 15089 1 
      1272 . 1 1 104 104 LYS HB2  H  1   1.97  0.02 . 2 . . . . 104 Lys HB2  . 15089 1 
      1273 . 1 1 104 104 LYS HB3  H  1   2.45  0.02 . 2 . . . . 104 Lys HB3  . 15089 1 
      1274 . 1 1 104 104 LYS HG2  H  1   1.45  0.02 . 1 . . . . 104 Lys HG2  . 15089 1 
      1275 . 1 1 104 104 LYS HG3  H  1   1.45  0.02 . 1 . . . . 104 Lys HG3  . 15089 1 
      1276 . 1 1 104 104 LYS HD2  H  1   1.76  0.02 . 2 . . . . 104 Lys HD2  . 15089 1 
      1277 . 1 1 104 104 LYS HD3  H  1   1.74  0.02 . 2 . . . . 104 Lys HD3  . 15089 1 
      1278 . 1 1 104 104 LYS HE2  H  1   2.97  0.02 . 1 . . . . 104 Lys HE2  . 15089 1 
      1279 . 1 1 104 104 LYS HE3  H  1   2.97  0.02 . 1 . . . . 104 Lys HE3  . 15089 1 
      1280 . 1 1 104 104 LYS C    C 13 178.7   0.15 . 1 . . . . 104 Lys C    . 15089 1 
      1281 . 1 1 104 104 LYS CA   C 13  60.4   0.15 . 1 . . . . 104 Lys CA   . 15089 1 
      1282 . 1 1 104 104 LYS CB   C 13  32.3   0.15 . 1 . . . . 104 Lys CB   . 15089 1 
      1283 . 1 1 104 104 LYS CG   C 13  24.9   0.15 . 1 . . . . 104 Lys CG   . 15089 1 
      1284 . 1 1 104 104 LYS CD   C 13  29.4   0.15 . 1 . . . . 104 Lys CD   . 15089 1 
      1285 . 1 1 104 104 LYS CE   C 13  42.2   0.15 . 1 . . . . 104 Lys CE   . 15089 1 
      1286 . 1 1 104 104 LYS N    N 15 120.0   0.15 . 1 . . . . 104 Lys N    . 15089 1 
      1287 . 1 1 105 105 GLU H    H  1   7.96  0.02 . 1 . . . . 105 Glu H    . 15089 1 
      1288 . 1 1 105 105 GLU HA   H  1   4.07  0.02 . 1 . . . . 105 Glu HA   . 15089 1 
      1289 . 1 1 105 105 GLU HB2  H  1   2.11  0.02 . 1 . . . . 105 Glu HB2  . 15089 1 
      1290 . 1 1 105 105 GLU HB3  H  1   2.11  0.02 . 1 . . . . 105 Glu HB3  . 15089 1 
      1291 . 1 1 105 105 GLU HG2  H  1   2.41  0.02 . 1 . . . . 105 Glu HG2  . 15089 1 
      1292 . 1 1 105 105 GLU HG3  H  1   2.41  0.02 . 1 . . . . 105 Glu HG3  . 15089 1 
      1293 . 1 1 105 105 GLU C    C 13 178.7   0.15 . 1 . . . . 105 Glu C    . 15089 1 
      1294 . 1 1 105 105 GLU CA   C 13  59.2   0.15 . 1 . . . . 105 Glu CA   . 15089 1 
      1295 . 1 1 105 105 GLU CB   C 13  29.4   0.15 . 1 . . . . 105 Glu CB   . 15089 1 
      1296 . 1 1 105 105 GLU CG   C 13  36.1   0.15 . 1 . . . . 105 Glu CG   . 15089 1 
      1297 . 1 1 105 105 GLU N    N 15 116.4   0.15 . 1 . . . . 105 Glu N    . 15089 1 
      1298 . 1 1 106 106 LEU H    H  1   7.39  0.02 . 1 . . . . 106 Leu H    . 15089 1 
      1299 . 1 1 106 106 LEU HA   H  1   4.26  0.02 . 1 . . . . 106 Leu HA   . 15089 1 
      1300 . 1 1 106 106 LEU HB2  H  1   1.94  0.02 . 2 . . . . 106 Leu HB2  . 15089 1 
      1301 . 1 1 106 106 LEU HB3  H  1   1.41  0.02 . 2 . . . . 106 Leu HB3  . 15089 1 
      1302 . 1 1 106 106 LEU HG   H  1   1.98  0.02 . 1 . . . . 106 Leu HG   . 15089 1 
      1303 . 1 1 106 106 LEU HD11 H  1   0.80  0.02 . 1 . . . . 106 Leu HD1  . 15089 1 
      1304 . 1 1 106 106 LEU HD12 H  1   0.80  0.02 . 1 . . . . 106 Leu HD1  . 15089 1 
      1305 . 1 1 106 106 LEU HD13 H  1   0.80  0.02 . 1 . . . . 106 Leu HD1  . 15089 1 
      1306 . 1 1 106 106 LEU HD21 H  1   0.89  0.02 . 1 . . . . 106 Leu HD2  . 15089 1 
      1307 . 1 1 106 106 LEU HD22 H  1   0.89  0.02 . 1 . . . . 106 Leu HD2  . 15089 1 
      1308 . 1 1 106 106 LEU HD23 H  1   0.89  0.02 . 1 . . . . 106 Leu HD2  . 15089 1 
      1309 . 1 1 106 106 LEU C    C 13 179.9   0.15 . 1 . . . . 106 Leu C    . 15089 1 
      1310 . 1 1 106 106 LEU CA   C 13  57.0   0.15 . 1 . . . . 106 Leu CA   . 15089 1 
      1311 . 1 1 106 106 LEU CB   C 13  41.9   0.15 . 1 . . . . 106 Leu CB   . 15089 1 
      1312 . 1 1 106 106 LEU CG   C 13  26.6   0.15 . 1 . . . . 106 Leu CG   . 15089 1 
      1313 . 1 1 106 106 LEU CD1  C 13  26.8   0.15 . 1 . . . . 106 Leu CD1  . 15089 1 
      1314 . 1 1 106 106 LEU CD2  C 13  22.2   0.15 . 1 . . . . 106 Leu CD2  . 15089 1 
      1315 . 1 1 106 106 LEU N    N 15 117.5   0.15 . 1 . . . . 106 Leu N    . 15089 1 
      1316 . 1 1 107 107 VAL H    H  1   8.21  0.02 . 1 . . . . 107 Val H    . 15089 1 
      1317 . 1 1 107 107 VAL HA   H  1   3.76  0.02 . 1 . . . . 107 Val HA   . 15089 1 
      1318 . 1 1 107 107 VAL HB   H  1   2.23  0.02 . 1 . . . . 107 Val HB   . 15089 1 
      1319 . 1 1 107 107 VAL HG11 H  1   0.95  0.02 . 2 . . . . 107 Val HG1  . 15089 1 
      1320 . 1 1 107 107 VAL HG12 H  1   0.95  0.02 . 2 . . . . 107 Val HG1  . 15089 1 
      1321 . 1 1 107 107 VAL HG13 H  1   0.95  0.02 . 2 . . . . 107 Val HG1  . 15089 1 
      1322 . 1 1 107 107 VAL HG21 H  1   0.92  0.02 . 2 . . . . 107 Val HG2  . 15089 1 
      1323 . 1 1 107 107 VAL HG22 H  1   0.92  0.02 . 2 . . . . 107 Val HG2  . 15089 1 
      1324 . 1 1 107 107 VAL HG23 H  1   0.92  0.02 . 2 . . . . 107 Val HG2  . 15089 1 
      1325 . 1 1 107 107 VAL C    C 13 177.6   0.15 . 1 . . . . 107 Val C    . 15089 1 
      1326 . 1 1 107 107 VAL CA   C 13  66.2   0.15 . 1 . . . . 107 Val CA   . 15089 1 
      1327 . 1 1 107 107 VAL CB   C 13  31.8   0.15 . 1 . . . . 107 Val CB   . 15089 1 
      1328 . 1 1 107 107 VAL CG1  C 13  23.2   0.15 . 2 . . . . 107 Val CG1  . 15089 1 
      1329 . 1 1 107 107 VAL CG2  C 13  21.9   0.15 . 2 . . . . 107 Val CG2  . 15089 1 
      1330 . 1 1 107 107 VAL N    N 15 122.2   0.15 . 1 . . . . 107 Val N    . 15089 1 
      1331 . 1 1 108 108 LEU H    H  1   8.19  0.02 . 1 . . . . 108 Leu H    . 15089 1 
      1332 . 1 1 108 108 LEU HA   H  1   4.12  0.02 . 1 . . . . 108 Leu HA   . 15089 1 
      1333 . 1 1 108 108 LEU HB2  H  1   1.82  0.02 . 2 . . . . 108 Leu HB2  . 15089 1 
      1334 . 1 1 108 108 LEU HB3  H  1   1.51  0.02 . 2 . . . . 108 Leu HB3  . 15089 1 
      1335 . 1 1 108 108 LEU HG   H  1   1.77  0.02 . 1 . . . . 108 Leu HG   . 15089 1 
      1336 . 1 1 108 108 LEU HD11 H  1   0.91  0.02 . 1 . . . . 108 Leu HD1  . 15089 1 
      1337 . 1 1 108 108 LEU HD12 H  1   0.91  0.02 . 1 . . . . 108 Leu HD1  . 15089 1 
      1338 . 1 1 108 108 LEU HD13 H  1   0.91  0.02 . 1 . . . . 108 Leu HD1  . 15089 1 
      1339 . 1 1 108 108 LEU HD21 H  1   0.87  0.02 . 1 . . . . 108 Leu HD2  . 15089 1 
      1340 . 1 1 108 108 LEU HD22 H  1   0.87  0.02 . 1 . . . . 108 Leu HD2  . 15089 1 
      1341 . 1 1 108 108 LEU HD23 H  1   0.87  0.02 . 1 . . . . 108 Leu HD2  . 15089 1 
      1342 . 1 1 108 108 LEU C    C 13 178.7   0.15 . 1 . . . . 108 Leu C    . 15089 1 
      1343 . 1 1 108 108 LEU CA   C 13  57.2   0.15 . 1 . . . . 108 Leu CA   . 15089 1 
      1344 . 1 1 108 108 LEU CB   C 13  41.7   0.15 . 1 . . . . 108 Leu CB   . 15089 1 
      1345 . 1 1 108 108 LEU CG   C 13  27.0   0.15 . 1 . . . . 108 Leu CG   . 15089 1 
      1346 . 1 1 108 108 LEU CD1  C 13  25.4   0.15 . 1 . . . . 108 Leu CD1  . 15089 1 
      1347 . 1 1 108 108 LEU CD2  C 13  23.0   0.15 . 1 . . . . 108 Leu CD2  . 15089 1 
      1348 . 1 1 108 108 LEU N    N 15 120.3   0.15 . 1 . . . . 108 Leu N    . 15089 1 
      1349 . 1 1 109 109 GLU H    H  1   7.92  0.02 . 1 . . . . 109 Glu H    . 15089 1 
      1350 . 1 1 109 109 GLU HA   H  1   4.13  0.02 . 1 . . . . 109 Glu HA   . 15089 1 
      1351 . 1 1 109 109 GLU HB2  H  1   2.07  0.02 . 1 . . . . 109 Glu HB2  . 15089 1 
      1352 . 1 1 109 109 GLU HB3  H  1   2.07  0.02 . 1 . . . . 109 Glu HB3  . 15089 1 
      1353 . 1 1 109 109 GLU HG2  H  1   2.32  0.02 . 2 . . . . 109 Glu HG2  . 15089 1 
      1354 . 1 1 109 109 GLU HG3  H  1   2.27  0.02 . 2 . . . . 109 Glu HG3  . 15089 1 
      1355 . 1 1 109 109 GLU C    C 13 177.5   0.15 . 1 . . . . 109 Glu C    . 15089 1 
      1356 . 1 1 109 109 GLU CA   C 13  58.1   0.15 . 1 . . . . 109 Glu CA   . 15089 1 
      1357 . 1 1 109 109 GLU CB   C 13  29.7   0.15 . 1 . . . . 109 Glu CB   . 15089 1 
      1358 . 1 1 109 109 GLU CG   C 13  36.1   0.15 . 1 . . . . 109 Glu CG   . 15089 1 
      1359 . 1 1 109 109 GLU N    N 15 118.5   0.15 . 1 . . . . 109 Glu N    . 15089 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                        15089
   _Spectral_peak_list.ID                              1
   _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.Experiment_ID                   4
   _Spectral_peak_list.Experiment_name                '3D 1H-13C NOESY'
   _Spectral_peak_list.Number_of_spectral_dimensions   3
   _Spectral_peak_list.Details                        
;
Aliphatic C13 NOESY peak list from 3D C13-NOESY in H2O, Varian 750
This peak list was combined with the aromatic C13 NOESY peak list in H2O for
AutoStructure calculations and RPF analysis.
;
   _Spectral_peak_list.Text_data_format                text
   _Spectral_peak_list.Text_data                      
;
 
      Assignment         w1         w2         w3   Data Height     Note    

 W66HE1-E64CB-HB3     10.653     31.255      1.285       766635 
     E64HA-CB-HB2      4.217     31.255      2.262      1112430 
     E64HA-CB-HB3      4.216     31.255      1.286       738746 
 W66HE1-E64CB-HB2     10.661     31.255      2.263       668071 
E64HB2/E64QG-CB/E64CB-HB3/E64HB3      2.250     31.255      1.285      3906551 
    E64HB3-CB-HB2      1.287     31.255      2.262      2764495 
      E64H-CB-HB3      8.040     31.255      1.288       886596 
 W66HD1-E64CB-HB3      6.943     31.255      1.281       379838 
 W66HD1-E64CB-HB2      6.939     31.255      2.260       388450 
      E64H-CB-HB2      8.041     31.255      2.266       862315 
     K73HA-CB-HB2      3.545     31.255      0.760       866493 
     K73HA-CB-HB3      3.546     31.255      1.485      1157099 
    K73HB3-CB-HB2      1.487     31.255      0.762      2918491 
     K73QG-CB-HB2      1.165     31.255      0.762       951216 
     K73QG-CB-HB3      1.163     31.255      1.485      1687804 
    K73HB2-CB-HB3      0.763     31.255      1.486      3945782 
     K73QE-CB-HB3      3.030     31.255      1.488       350502 
     K73QE-CB-HB2      3.035     31.255      0.757       227140 
   V74H-K73CB-HB2      7.570     31.255      0.764       380285 
K73H/W77HZ2-CB/K73CB-HB2/K73HB2      7.391     31.255      0.762       799639 
   V74H-K73CB-HB3      7.567     31.255      1.486       889489 
K73H/W77HZ2-CB/K73CB-HB3/K73HB3      7.395     31.255      1.486      1882733 
            ?-?-?      3.744     31.255      0.764       196519 
  F70HA-K73CB-HB3      3.780     31.255      1.485       482605 
     M23HA-CB-HB2      4.438     31.325      2.125       423324 
     V56HG2-CB-HB      1.116     31.326      2.293      3827915 
V56H/G65H-CB/E64CB-HB/E64HB2      7.589     31.330      2.293      2621839 
      V56HA-CB-HB      3.913     31.331      2.294      2161237 
  L17HD1-V56CB-HB      0.764     31.335      2.293      1095129 
      M23H-CB-HB2      7.544     31.336      2.124       475745 
      M23H-CB-HB3      7.544     31.351      1.978       301692 
     M23HA-CB-HB3      4.437     31.355      1.978       412728 
     V56HG1-CB-HB      0.974     31.361      2.293      4434767 
    V57H-V56CB-HB      7.164     31.367      2.294       927182 
   N24H-M23CB-HB2      8.243     31.403      2.122       402576 
    M23HG2-CB-HB2      2.970     31.403      2.129       334999 
            ?-?-?      1.822     31.416      2.137      1568499 
    M23HG2-CB-HB3      2.974     31.442      1.971       180532 
   N24H-M23CB-HB3      8.249     31.442      1.981       470027 
  K15HB3-A12CA-HA      1.574     31.536      3.962      1014686 
       A12H-CA-HA      9.200     31.546      3.962       750776 
      A12HB-CA-HA      1.328     31.552      3.963      3255288 
  K15HG3-A12CA-HA      0.812     31.559      3.964      2650389 
            ?-?-?      1.934     31.564      3.962       868885 
            ?-?-?      0.983     31.564      3.970      1148534 
  K15HB2-A12CA-HA      1.708     31.575      3.963       780335 
    P54HB2-CB-HB3      2.486     31.589      2.027      7340214 
P54HA/P54HD2-CB/P54CB-HB2/P54HB2      4.019     31.592      2.487      3004099 
  A75HB-P54CB-HB2      1.365     31.592      2.486      1409004 
    P54HG3-CB-HB2      1.960     31.592      2.493      3554251 
  A75HA-P54CB-HB2      3.851     31.592      2.490       732544 
   E55H-P54CB-HB2      8.781     31.593      2.487       540811 
   V57HB-A75CA-HA      2.367     31.600      3.839       764467 
       A75H-CA-HA      8.901     31.606      3.840      1094232 
      A75HB-CA-HA      1.366     31.606      3.840      4174203 
    P54HB3-CB-HB2      2.018     31.607      2.493      8650502 
P54HA/P54HD2-CB/P54CB-HB3/P54HB3      4.025     31.611      2.027      2787009 
   E55H-P54CB-HB3      8.783     31.614      2.028      1254295 
    A78H-A75CA-HA      8.687     31.614      3.841       632317 
   P54HA-V57CB-HB      4.016     31.619      2.375      1011745 
  P54HB2-A75CA-HA      2.492     31.623      3.837       539596 
    G76H-A75CA-HA      7.849     31.624      3.841       507679 
            ?-?-?      3.885     31.626      2.499       815452 
    V58H-V57CB-HB      8.030     31.627      2.373      1299426 
  A78HB-P54CB-HB2      1.524     31.629      2.490       809624 
     V57HG1-CB-HB      1.023     31.630      2.371      2196452 
  A75HB-P54CB-HB3      1.361     31.630      2.027      1271338 
    E14H-A12CA-HA      7.391     31.630      3.969       331788 
   T11HA-A12CA-HA      4.192     31.630      3.964       351670 
   P54HA-A75CA-HA      4.020     31.630      3.835      1340859 
    P54HD3-CB-HB2      3.572     31.636      2.501       641986 
       V57H-CB-HB      7.164     31.639      2.372      1705008 
       M9HA-CG-QG      4.753     31.643      2.512       877194 
   A75HB-V57CB-HB      1.359     31.643      2.371      1206502 
       M9QB-CG-QG      1.983     31.643      2.510      5366246 
     V57HG2-CB-HB      0.908     31.650      2.370      3286528 
 V58HG2-P54CB-HB2      0.907     31.654      2.504      1130059 
K15H/A16H-A12CA/A12CA-HA/A12HA      8.034     31.669      3.972       561658 
      V57HA-CB-HB      3.436     31.669      2.370       516061 
M9QG/P54HB2-CG/P54CB-QG/P54HB2      2.510     31.670      2.511     70335872 
        M9H-CG-QG      8.326     31.672      2.513       669918 
   A75HA-V57CB-HB      3.833     31.683      2.369       797087 
   A78HB-V57CB-HB      1.523     31.699      2.369       407399 
    P30HB3-CB-HB2      2.064     31.777      2.359      2748474 
P54HD3/V81HA-CB/V81CB-HB3/V81HB      3.563     31.783      2.023      1027711 
  I41HD1-A38CA-HA      0.923     31.816      3.844      3511329 
A38HB/A78HB-CA/A75CA-HA/A75HA      1.549     31.816      3.845      4281480 
            ?-?-?      0.907     31.817      3.844      3511329 
  W66HZ3-V57CB-HB      6.864     31.825      2.361       229594 
     P30QG-CB-HB2      1.899     31.826      2.362      1757675 
V107H/L108H-CB/V107CB-HB/V107HB      8.208     31.830      2.229      2772874 
    V107HG2-CB-HB      0.930     31.835      2.230      5363523 
    A59H-V58CB-HB      7.643     31.847      1.876      1600191 
     V58HG2-CB-HB      0.877     31.847      1.878      4960694 
      V58HA-CB-HB      3.332     31.848      1.876       720528 
    A82H-V81CB-HB      8.295     31.863      2.020      1004214 
            ?-?-?      8.250     31.868      4.614      2205622 
       V58H-CB-HB      8.031     31.871      1.876      2222723 
            ?-?-?      7.138     31.876      4.615       948574 
     V58HG1-CB-HB      0.829     31.877      1.877      4975843 
   E55HA-V58CB-HB      3.901     31.882      1.877      1557527 
            ?-?-?      3.134     31.882      4.615      8732891 
   A59HB-V58CB-HB      1.352     31.884      1.876       771411 
    K39H-A38CA-HA      8.081     31.894      3.850       448256 
   A59HA-V58CB-HB      4.030     31.900      1.880       434078 
       V81H-CB-HB      8.369     31.901      2.019      1929478 
I41H/L42H-A38CA/A38CA-HA/A38HA      7.991     31.929      3.847       683897 
   I41HB-A38CA-HA      1.942     31.929      3.846      1485497 
P30HD2/P92HD2-CB/P92CB-HB3/P92HB3      3.756     31.937      2.051       847470 
       A38H-CA-HA      9.122     31.941      3.846       498132 
     V107HA-CB-HB      3.782     31.948      2.231      1219085 
     V107HB-CB-HB      2.221     31.955      2.221     14340489 
      A16HB-CA-HA      1.528     31.968      4.004      3671924 
       A16H-CA-HA      8.044     31.970      4.005       798019 
 L103HD2-A16CA-HA      0.969     31.970      4.003      2488274 
   F19QD-A16CA-HA      7.297     31.979      4.004       933457 
            ?-?-?      8.192     31.989      3.997       437535 
     P92HA-CB-HB2      4.200     31.994      2.187      1716315 
I89HG2/I89HD1-P92CB/P92CB-HB2/P92HB2      0.704     31.998      2.190      1170677 
    P92HD3-CB-HB3      3.405     32.004      2.045       610723 
    P92HD3-CB-HB2      3.404     32.007      2.190       487076 
    F19H-A16CA-HA      8.479     32.008      4.005       477440 
P92HB3/P92HG2-CB/P92CB-HB2/P92HB2      2.035     32.012      2.187      9087032 
     P92HA-CB-HB3      4.195     32.016      2.045      1650170 
V81HG1/I89HG2/I89HD1-CB/P92CB/P92CB-HB/P92HB3/P92HB3      0.724     32.082      2.031      4176179 
     M23HB3-CA-HA      1.969     32.084      4.435      1279657 
     V81HG2-CB-HB      0.983     32.099      2.028      3786167 
    N24H-M23CA-HA      8.257     32.099      4.435       839854 
     M23HG3-CA-HA      2.454     32.099      4.437      1380345 
       M23H-CA-HA      7.541     32.100      4.436       707191 
     M23HG2-CA-HA      2.987     32.103      4.434       651431 
     M23HB2-CA-HA      2.127     32.115      4.437       964940 
    P10HB3-CB-HB2      1.744     32.173      2.278      3722264 
    P10HB2-CB-HB3      2.278     32.175      1.744      3181368 
     P10HA-CB-HB2      4.532     32.192      2.278      1413084 
     P10HA-CB-HB3      4.532     32.199      1.741       695942 
S53HB3/P54HA/P54HD2-CA/S53CA/S53CA-HA/S53HA/S53HA      4.034     32.209      4.735      3307134 
       S53H-CA-HA      8.530     32.212      4.731       556198 
 Y44QE-K104CB-HB3      6.890     32.213      2.456       293141 
   K104HD3-CB-HB3      1.749     32.222      2.453      1053096 
  P54HD3-S53CA-HA      3.538     32.227      4.735      2206933 
    K104QG-CB-HB3      1.447     32.228      2.453      1240499 
       H31H-CA-HA      9.376     32.242      4.549       462989 
     K104H-CB-HB3      8.867     32.245      2.453       710856 
E64HB2/E64QG-CA/E64CA-HA/E64HA      2.245     32.246      4.215      3676982 
E101HA-K104CB-HB2      3.953     32.247      1.966      1099303 
V50HG1/V50HG2-CB/V50CB-HB/V50HB      0.771     32.247      1.955      5415546 
 E105H-K104CB-HB2      7.971     32.251      1.964      1024959 
    G65H-E64CA-HA      7.605     32.252      4.216       635620 
   K104HB3-CB-HB2      2.453     32.256      1.980      4414774 
   K104HB2-CB-HB3      1.995     32.256      2.457      8259405 
 E105H-K104CB-HB3      7.978     32.256      2.454       511391 
       E64H-CA-HA      8.039     32.257      4.216      1541239 
       V50H-CB-HB      8.092     32.259      1.954      1403245 
    K104QG-CB-HB2      1.446     32.269      1.964      1870454 
     K104H-CB-HB2      8.865     32.269      1.966      1031475 
      H31QB-CA-HA      3.275     32.270      4.551      2049446 
    S32H-H31CA-HA      8.799     32.272      4.548       724500 
     H31HD2-CA-HA      7.295     32.276      4.550       541429 
    K104HA-CB-HB2      3.834     32.276      1.963      1309231 
P68HD2/K104HA-CB/K104CB-HB2/K104HB3      3.838     32.305      2.451      1360139 
            ?-?-?      8.838     32.317      2.038       981695 
      V50HA-CB-HB      4.374     32.317      1.953      1309857 
  P54HG2-S53CA-HA      2.309     32.330      4.734       379464 
    P68HD2-CB-HB3      3.872     32.339      2.036      1304653 
   E69H-P68CB-HB2      8.529     32.362      2.454       385691 
   E69H-P68CB-HB3      8.529     32.362      2.038       774802 
    P68HB2-CB-HB3      2.451     32.371      2.038     10499539 
     P68HA-CB-HB2      4.513     32.374      2.452      3226083 
    P68HB3-CB-HB2      2.036     32.375      2.452     11894658 
     P68HA-CB-HB3      4.511     32.384      2.038      1954214 
    P68HD3-CB-HB3      4.065     32.396      2.043       972412 
K5QG/E64HB3-CA/E64CA-HA/E64HA      1.309     32.419      4.206      1955515 
      S8H-K7CA-HA      8.368     32.421      4.313      3547335 
       K7QG-CA-HA      1.415     32.443      4.313      1985668 
    S28H-H31CA-HA      8.245     32.446      4.578       776337 
       R86H-CA-HA      8.512     32.458      4.243      1527811 
     R86HG3-CA-HA      1.506     32.461      4.243      1234475 
      K7HB3-CA-HA      1.888     32.464      4.313      3736670 
        K7H-CA-HA      8.283     32.467      4.313      1929433 
D6H/I87H-K5CA/R86CA-HA/R86HA      8.175     32.467      4.240      7595466 
      K7HB2-CA-HA      1.743     32.502      4.310      3479477 
      K5HB3-CA-HA      1.728     32.548      4.216      4771661 
        K5H-CA-HA      8.238     32.548      4.207      3738454 
      K80H-CB-HB3      8.096     32.572      2.104      1735893 
   V81H-K80CB-HB3      8.371     32.580      2.103       900165 
K80HA/A82HA-CB/P51CB-HB3/P51HB2      4.058     32.590      2.101      1334337 
  W77HA-K80CB-HB3      4.633     32.596      2.102       614149 
      K80H-CB-HB2      8.096     32.598      1.812      1221789 
K80HG3/A82HB-CB/P51CB-HB3/P51HB2      1.548     32.601      2.099      1465720 
     K80HA-CB-HB2      4.062     32.603      1.812      1588519 
      R86QB-CA-HA      1.725     32.603      4.245      4063062 
   V81H-K80CB-HB2      8.366     32.614      1.808       670129 
    K80HG2-CB-HB3      1.667     32.635      2.100      2665584 
 H46HD2-P51CB-HB3      7.164     32.711      1.935       353799 
      K7HA-CB-HB3      4.317     32.712      1.890      2620971 
      K7QG-CB-HB3      1.421     32.720      1.887      2872467 
  H46HA-P51CB-HB3      3.757     32.722      1.934       573101 
     P51HA-CB-HB3      4.346     32.725      1.939      1329880 
      K7HA-CB-HB2      4.318     32.740      1.749      2385054 
       K7H-CB-HB3      8.308     32.740      1.888      1090010 
 H46HD2-P51CB-HB2      7.162     32.748      2.083       398664 
    P51HD3-CB-HB2      3.577     32.750      2.081       591990 
V2HA/A82HA-CB/P51CB-HB/P51HB3      4.059     32.761      1.918       736693 
     P51HA-CB-HB2      4.347     32.763      2.079      1015589 
  H46HA-P51CB-HB2      3.753     32.779      2.080       518359 
K73HA/V81HA-K72CB/K80CB-HB2/K80HB2      3.570     32.790      1.814       328542 
      V2HG2-CB-HB      0.755     32.800      1.915      2639981 
   M33HE-D34CA-HA      1.955     32.804      4.597       552358 added
     K72HA-CB-HB3      3.741     32.837      1.787      2326239 
   K73H-K72CB-HB3      7.395     32.848      1.784       975747 
      V2HG1-CB-HB      0.878     32.849      1.913      2203882 
     K72QE-CB-HB2      2.883     32.851      1.812       486948 
      K72H-CB-HB3      8.008     32.851      1.786      2365777 
     K72HA-CB-HB2      3.741     32.854      1.811      2313012 
      K5HA-CB-HB3      4.198     32.859      1.692      2245972 
     D34HB3-CA-HA      3.119     32.864      4.599      1179966 
      K72H-CB-HB2      8.008     32.866      1.813      2367168 
   K73H-K72CB-HB2      7.396     32.869      1.812       991893 
K5H/K7H-CB/K7CB-HB2/K7HB2      8.272     32.876      1.751      1995086 
     D34HB2-CA-HA      2.970     32.891      4.601       787382 
K43QG/K43HD3-CB/K43CB-HB3/K43HB3      1.560     32.899      1.996      1584412 
      K43H-CB-HB3      8.758     32.909      1.998      1176809 
       D34H-CA-HA      7.332     32.916      4.603       483441 
      K43H-CB-HB2      8.759     32.924      1.693       989472 
    T37H-D34CA-HA      8.084     32.928      4.603       412126 
    L106HB3-CA-HA      1.413     32.932      4.257      1320893 
    E35H-D34CA-HA      8.729     32.934      4.590       361810 
    K72HG3-CB-HB2      1.334     32.942      1.818      1801970 
K5HA/E69HA-CB/K72CB-HB2/K72HB3      4.189     32.942      1.761      2561417 
K5QG/K72HG3-CB/K72CB-HB2/K72HB3      1.334     32.943      1.759      4350828 
      L106H-CA-HA      7.383     32.958      4.256       781260 
L106HB2/L106HG-CA/L106CA-HA/L106HA      1.962     32.959      4.256      1512765 
      V52HA-CB-HB      3.820     32.965      2.161       706417 
      R60HE-CA-HA      7.813     32.967      3.918       481532 
    L106HD2-CA-HA      0.874     32.968      4.257      3495100 
       R60H-CA-HA      7.568     32.983      3.914       668825 
       K5H-CB-HB3      8.243     32.986      1.694      1510050 
     R60HD2-CA-HA      3.333     32.993      3.916       955789 
  E109H-L106CA-HA      7.944     32.994      4.259       380695 
    Q63H-R60CA-HA      7.679     32.994      3.917       660520 
  Q63HB2-R60CA-HA      2.046     32.997      3.920      1192587 
  Q63HB3-R60CA-HA      2.161     33.004      3.918      1015663 
      K90HA-CB-QB      3.947     33.005      1.645      3350288 
     K43HA-CB-HB2      3.933     33.005      1.698      1382932 
V52HG1/V52HG2-CB/V52CB-HB/V52HB      0.972     33.009      2.160      3427576 
       K90H-CB-QB      9.001     33.010      1.645      1645307 
K43HA/P10HD3-CB/M9CB-HB3/M9QB      3.909     33.012      1.991      1238445 
     R60HG3-CA-HA      0.923     33.012      3.922       774232 
      K90QG-CB-QB      1.342     33.014      1.654      5246724 
    G61H-R60CA-HA      8.154     33.018      3.917       459187 
    N91H-K90CB-QB      7.855     33.018      1.643      1172916 
     R60HD3-CA-HA      3.027     33.020      3.920      2215624 
K15HB2/R60HB3-CA/R60CA-HA/R60HA      1.715     33.026      3.922      1752476 
    A38H-D34CA-HA      9.075     33.028      4.603       261524 
K15H/A16H/E64H-CA/K15CA/R60CA-HA/K15HA/R60HA      8.025     33.037      3.923      1090305 
    M99HG2-CG-HG3      2.199     33.037      1.471      1891712 
       M9QG-CB-QB      2.507     33.043      1.979       595137 
    M99HG3-CG-HG2      1.478     33.044      2.209      2503019 
     K15HB3-CA-HA      1.589     33.045      3.922      1471508 
     M99HA-CG-HG2      3.700     33.050      2.210       512971 
      M99H-CG-HG3      7.322     33.051      1.482       286332 
     K15HG3-CA-HA      0.827     33.051      3.923       876721 
      M99H-CG-HG2      7.321     33.055      2.207       672706 
R60HG2/K15QD-CA/K15CA-HA/K15HA      1.501     33.059      3.923      2459600 
     R60HB2-CA-HA      1.642     33.059      3.926      1498968 
D18H/F19H-K15CA/K15CA-HA/K15HA      8.488     33.064      3.926       580003 
   D18QB-K15CA-HA      2.650     33.075      3.926       707139 
     M99HA-CG-HG3      3.695     33.086      1.484       387203 
     D47HB2-CA-HA      2.946     33.118      4.281      1490404 
    M99HB3-CG-HG3      1.627     33.121      1.477      1760634 
    L48H-D47CA-HA      7.608     33.124      4.282       627123 
     D47HB3-CA-HA      2.656     33.124      4.281      2348183 
       D47H-CA-HA      9.008     33.129      4.282      1527102 
   P10HD2-M9CB-QB      3.584     33.136      1.982       817493 
            ?-?-?      2.191     33.153      4.117       330070 
M9H/Y44H-CB/K43CB-QB/K43HB3      8.328     33.155      1.984      2317874 
    G49H-D47CA-HA      7.737     33.157      4.284       498477 
L108HD2/L108HD1-CA/L108CA-HA/L108HA      0.872     33.157      4.114      4499221 
    L108HB3-CA-HA      1.507     33.161      4.114      2254932 
      L108H-CA-HA      8.204     33.161      4.113      1747341 
 V107HB-L108CA-HA      2.237     33.162      4.122       343329 
L108HG/L108HB2-CA/L108CA-HA/L108HA      1.800     33.167      4.114      2080181 
            ?-?-?      3.115     33.175      4.113       601089 
  E109H-L108CA-HA      7.934     33.181      4.115       926661 
       M9HA-CB-QB      4.755     33.187      1.982      1502887 
  P30HD2-V29CB-HB      3.763     33.189      2.000       454435 
            ?-?-?      8.238     33.214      4.447       626798 
            ?-?-?      3.090     33.235      4.448      1693529 
            ?-?-?      3.227     33.242      4.448      1778935 
      V29HA-CB-HB      4.315     33.271      2.001      1013565 
     V29HG2-CB-HB      0.904     33.301      2.000      8914879 
       V29H-CB-HB      7.523     33.319      2.000      2140851 
    G21H-D18CA-HA      8.873     33.338      4.517       327482 
D18H/F19H-CA/D18CA-HA/D18HA      8.487     33.343      4.516      1311350 
            ?-?-?      8.232     33.346      4.524       417205 
            ?-?-?      3.031     33.346      4.517      1131463 
      D18QB-CA-HA      2.650     33.348      4.515      1430723 
            ?-?-?      6.765     33.360      4.514       395182 
            ?-?-?      7.973     33.477      4.523       940923 
            ?-?-?      3.225     33.482      4.521      2687690 
            ?-?-?      2.513     33.605      1.984       776102 
      M99H-CB-HB2      7.318     33.711      1.864       467834 
      M99H-CB-HB3      7.324     33.720      1.634       358652 
    M99HG2-CB-HB2      2.213     33.720      1.878       393199 
  F95QE-M99CB-HB3      6.845     33.725      1.639       269422 
  F95QD-M99CB-HB2      7.170     33.729      1.867       253102 
  F95QD-M99CB-HB3      7.191     33.737      1.638       227200 
     M99HA-CB-HB2      3.690     33.738      1.874       318864 
    M99HB2-CB-HB3      1.867     33.744      1.629      1494242 
     M99HA-CB-HB3      3.699     33.748      1.628       473610 
  Q100H-M99CB-HB3      7.483     33.750      1.628       272429 
    M99HB3-CB-HB2      1.628     33.754      1.871      1586396 
  Q100H-M99CB-HB2      7.475     33.754      1.870       401717 
    M99HG2-CB-HB3      2.190     33.770      1.639       452059 
F95QE/Y44QE-Q100CG/Q100CG-HG3/Q100HG3      6.883     33.800      0.967       190878 
   Q100HB3-CG-HG3      1.553     33.800      0.969       249795 
     Q100H-CG-HG3      7.472     33.802      0.960       400517 
    Q100HA-CG-HG2      3.290     33.802      1.074       377382 
  Q100HE21-CG-HG3      6.662     33.803      0.959       280272 
Q63HE21/Q63H-CG/Q63CG-HG3/Q63HG3      7.678     33.809      2.300      2209234 
   E64H-Q63CG-HG2      8.032     33.809      2.381       545549 
   Q100HB2-CG-HG2      1.753     33.810      1.078       523925 
   E64H-Q63CG-HG3      8.032     33.812      2.299       481938 
    Q63HB3-CG-HG3      2.154     33.813      2.299      5167559 
   Q63HE22-CG-HG2      6.808     33.813      2.380       653009 
     Q63HA-CG-HG3      3.955     33.815      2.300      1906551 
  Q100HE21-CG-HG2      6.656     33.818      1.077       278885 
    Q63HB3-CG-HG2      2.154     33.819      2.381      5871692 
  Q100HE22-CG-HG3      5.924     33.823      0.958       349800 
    Q63HB2-CG-HG2      2.056     33.823      2.381      3528536 
    Q63HB2-CG-HG3      2.057     33.823      2.300      3108558 
Q63HE21/Q63H-CG/Q63CG-HG2/Q63HG2      7.678     33.823      2.381      2469384 
     Q63HA-CG-HG2      3.956     33.826      2.380      2133900 
   Q63HE22-CG-HG3      6.810     33.828      2.299       538418 
   Q100HB2-CG-HG3      1.758     33.829      0.977       409208 
   Q100HG2-CG-HG3      1.082     33.833      0.986      2509005 
   Q100HG3-CG-HG2      0.970     33.835      1.075      2432941 
  Q100HE22-CG-HG2      5.920     33.836      1.075       308724 
   Q100HB3-CG-HG2      1.534     33.836      1.075       408466 
     Q100H-CG-HG2      7.471     33.844      1.078       382406 
    K43H-L42CA-HA      8.756     33.847      3.994       332443 
F95QE/Y44QE-Q100CG/Q100CG-HG2/Q100HG2      6.867     33.849      1.077       308044 
    Q100HA-CG-HG3      3.282     33.857      0.969       293897 
     L42HB3-CA-HA      1.316     33.876      3.991      1082950 
       L42H-CA-HA      7.981     33.876      3.990       859798 
      L42HG-CA-HA      2.067     33.876      3.993       982578 
     L42HD2-CA-HA      0.847     33.881      3.992      3454621 
  I41HG2-L42CA-HA      0.961     33.886      3.993      1508168 
     L42HB2-CA-HA      1.964     33.896      3.994      1075720 
    G21H-L17CA-HA      8.870     33.900      4.214       265674 
       L17H-CA-HA      8.259     33.911      4.224       420467 
     L17HD2-CA-HA      0.895     33.937      4.222      3651099 
    I20H-L17CA-HA      8.437     33.938      4.228       469623 
   I20HB-L17CA-HA      2.082     33.944      4.219      1553031 
L17HB3/L106HB3-CA/L103CA-HA/L103HA      1.416     33.959      4.213      1198102 
  L45HB2-L42CA-HA      2.251     33.972      3.999       351478 
    L103HD1-CA-HA      1.273     33.977      4.182       497456 
     L17HB2-CA-HA      2.168     33.978      4.226      1009382 
    L103HD2-CA-HA      0.975     33.978      4.189      3078817 
    L103HB3-CA-HA      1.496     33.985      4.191      1478559 
  L45HB3-L42CA-HA      1.680     33.985      3.997       609249 
L17HG/L106HB2-CA/L103CA-HA/L103HA      1.974     33.986      4.194      1301786 
L103HG/L103HB2-CA/L103CA-HA/L103HA      2.311     33.992      4.182      1312260 
  L106H-L103CA-HA      7.386     33.996      4.184       475940 
      L103H-CA-HA      7.846     33.997      4.185       769407 
  K104H-L103CA-HA      8.858     34.041      4.197       338759 
    E109HG3-CA-HA      2.271     34.063      4.123      1397398 
     S96HB3-CA-HA      3.980     34.063      4.200      2150820 
     E109QB-CA-HA      2.066     34.070      4.119      2907718 
  T97HG2-S96CA-HA      1.145     34.070      4.207       313238 
      E109H-CA-HA      7.950     34.070      4.122      1893632 
    Y98H-S96CA-HA      7.957     34.079      4.189       584474 
            ?-?-?      3.122     34.090      4.121       451704 
            ?-?-?      8.222     34.095      4.124       297702 
     K39HA-CB-HB3      3.537     34.131      1.309       364122 
     K39QD-CB-HB3      1.071     34.138      1.314       500167 
   L48HG-L45CA-HA      1.340     34.138      3.810       409334 
            ?-?-?      3.534     34.142      1.488       272543 
    T97H-S96CA-HA      8.691     34.145      4.208      2115088 
     K73HD3-CA-HA      1.638     34.145      3.544      1308447 
     K73HB2-CA-HA      0.761     34.151      3.544      1153901 
      K73QG-CA-HA      1.168     34.152      3.544      1531787 
       S96H-CA-HA      7.529     34.154      4.204       529581 
     E93HB2-CA-HA      1.953     34.154      4.102      3047058 
     K73HB3-CA-HA      1.502     34.154      3.544      1541283 
       K73H-CA-HA      7.398     34.156      3.544      1354610 
G76H/W77H-K73CA/K73CA-HA/K73HA      7.848     34.157      3.545       630767 
     L45HD2-CA-HA      0.838     34.158      3.815      3293460 
       L45H-CA-HA      8.086     34.159      3.815       979381 
    V74H-K73CA-HA      7.568     34.159      3.545       379244 
     L45HB3-CA-HA      1.689     34.159      3.814      1553660 
    K39HG2-CB-HB3      0.928     34.160      1.315       219091 
     L45HB2-CA-HA      2.252     34.163      3.815       951890 
 I89HD1-K39CB-HB2      0.681     34.166      1.567       625308 
   L48QB-L45CA-HA      1.647     34.168      3.814      1546875 
      K39H-CB-HB3      8.096     34.168      1.316       325319 
      L45HG-CA-HA      1.923     34.173      3.816       870858 
  L48HD1-L45CA-HA      0.466     34.174      3.816       663204 
 I89HD1-K39CB-HB3      0.682     34.175      1.311       667125 
     E93HG3-CA-HA      1.697     34.177      4.095       787522 
    K39HG3-CB-HB3      0.325     34.182      1.307       265523 
      K39H-CB-HB2      8.102     34.183      1.574       448043 
  K72HG3-K73CA-HA      1.337     34.184      3.545       342153 
    K39HG2-CB-HB2      0.923     34.185      1.568       264105 
    K39HB3-CB-HB2      1.310     34.189      1.567       972304 
    H46H-L45CA-HA      7.786     34.190      3.817       295198 
     E93HB3-CA-HA      1.827     34.191      4.100      2606755 
     K39QD-CB-HB2      1.066     34.191      1.564       407967 
    L48H-L45CA-HA      7.607     34.192      3.820       419056 
    K39HB2-CB-HB3      1.574     34.193      1.310       952511 
     K39HA-CB-HB2      3.539     34.203      1.581       207881 
       E93H-CA-HA     10.028     34.203      4.097       637064 
        F4H-CA-HA      8.343     34.228      4.528       906833 
    K39HG3-CB-HB2      0.318     34.245      1.578       268319 
      K5H-F4CA-HA      8.248     34.269      4.532      3645961 
      F4HB3-CA-HA      3.121     34.276      4.532      2454780 
      F4HB2-CA-HA      2.983     34.285      4.532      2229484 
       F4QD-CA-HA      7.220     34.344      4.528      1299181 
    M23HB2-CG-HG2      2.139     34.382      2.987       395285 
     M23HA-CG-HG3      4.438     34.385      2.451       704434 
      M23H-CG-HG2      7.536     34.414      2.988       345224 
      M23H-CG-HG3      7.539     34.418      2.455       455858 
    M23HG3-CG-HG2      2.450     34.418      2.991      1500974 
    M23HB3-CG-HG2      1.958     34.421      2.994       790387 
    M23HG2-CG-HG3      2.996     34.424      2.452      2007263 
    M23HB3-CG-HG3      1.960     34.429      2.451      1386636 
       F19H-CA-HA      8.471     34.442      4.733       449208 
    M23HB2-CG-HG3      2.132     34.494      2.449       795377 
            ?-?-?      7.572     34.500      4.735       196329 weak weak ....close to water
      F19QD-CA-HA      7.303     34.536      4.737      1045681 
      Y94QE-CA-HA      6.791     34.590      4.509       275158 
A27H/Y94QD-S26CA/Y94CA-HA/Y94HA      7.181     34.620      4.505      1666096 
  P51HD2-V50CA-HA      3.251     34.620      4.372      1621870 
  P51HD3-V50CA-HA      3.580     34.630      4.373      2630124 
     F19HB2-CA-HA      3.104     34.633      4.733       590530 
       V50H-CA-HA      8.089     34.635      4.371       985862 
      F19QD-CA-HA      7.296     34.639      4.738      1120849 
      V50HB-CA-HA      1.958     34.653      4.375      1964080 
     Y94HB2-CA-HA      3.375     34.654      4.501      1382829 
V50HG1/V50HG2-CA/V50CA-HA/V50HA      0.769     34.656      4.373      3050772 
     Y94HB3-CA-HA      2.717     34.658      4.501       868200 
     F19HB3-CA-HA      3.668     34.676      4.738       350756 
       Y94H-CA-HA      7.325     34.694      4.508       789828 
S8H/M9H-CA/S8CA-HA/S8HA      8.339     34.736      4.388      4993105 
Q63H/Q63H-E62CA/Q63CA-HA/Q63HA      7.679     34.748      3.965      2833117 
       E69H-CA-HA      8.531     34.750      4.149      1137482 
       S8QB-CA-HA      3.854     34.756      4.385      5142224 
     E69HG3-CA-HA      2.440     34.773      4.148      1104500 
       K90H-CA-HA      8.998     34.785      3.947       656096 
     E69HB2-CA-HA      2.248     34.785      4.148      2157262 
    K72H-E69CA-HA      8.005     34.798      4.149       893633 
E62HG3/Q63HB3-CA/Q63CA-HA/Q63HA      2.165     34.798      3.971      4776024 
K72HB3/K72HB2-E69CA/E69CA-HA/E69HA      1.801     34.799      4.147      2302096 
      K90QG-CA-HA      1.342     34.800      3.949      1715109 
  K80HB2-W77CA-HA      1.796     34.800      4.631       626025 
E62HG2/Q63HG2-CA/Q63CA-HA/Q63HA      2.386     34.803      3.968      2690800 
K90QB/K90QD-CA/K90CA-HA/K90HA      1.638     34.803      3.948      3637790 
     W77HB3-CA-HA      3.502     34.806      4.638       757899 
     W77HB2-CA-HA      2.847     34.820      4.637      1092084 
     W77HD1-CA-HA      7.130     34.821      4.638      2018494 
     E69HB3-CA-HA      2.055     34.834      4.146      1910271 
    Q102HA-CG-HG2      4.045     34.852      2.253      1074558 
     S26HB3-CA-HA      4.033     34.852      4.519      1973764 
  K80HB3-W77CA-HA      2.116     34.854      4.635       659850 
  Q102HE21-CG-HG3      6.834     34.854      2.137      1024329 
    Q102HA-CG-HG3      4.048     34.857      2.138      1436264 
       W77H-CA-HA      7.872     34.860      4.639       831734 
 F19HZ-Q102CG-HG3      7.207     34.860      2.138       303169 
            ?-?-?      2.885     34.862      4.519      1861153 
     S26HB2-CA-HA      3.882     34.863      4.517      1995106 
Q102H/L103H-CG/Q102CG-HG2/Q102HG2      7.821     34.863      2.257      1397897 
  Q102HE21-CG-HG2      6.833     34.866      2.256      1014731 
Q102H/L103H-CG/Q102CG-HG3/Q102HG3      7.823     34.866      2.136      1402013 
Q102HG2/Q102HB2-CG/Q102CG-HG3/Q102HG3      2.246     34.873      2.139     11640911 
E62H/E64H-CA/Q63CA-HA/Q63HA      8.012     34.875      3.980      2632318 
            ?-?-?      8.797     34.876      4.519       581460 
   Q102HG3-CG-HG2      2.138     34.876      2.255     10931863 
E62HB2/Q63HB2-CA/Q63CA-HA/Q63HA      2.048     34.884      3.973      4994610 
 F19HZ-Q102CG-HG2      7.209     34.886      2.258       276554 
   Q102HG2-CG-HG2      2.255     34.887      2.258     15765021 
       S26H-CA-HA      7.767     34.896      4.511      1008789 
    N91H-K90CA-HA      7.844     34.899      3.950      1022939 
            ?-?-?      7.590     34.908      4.522       303743 
     E62HB3-CA-HA      1.980     34.911      3.989      3461247 
     E93HA-CG-HG3      4.105     34.932      1.691       276844 
     E93HA-CG-HG2      4.099     34.947      2.175       744395 
    E93HB2-CG-HG2      1.946     34.957      2.172      2047631 
    L88H-I87CA-HA      8.398     34.965      4.410      4371615 
    E93HB3-CG-HG2      1.820     34.977      2.173      2263110 
      E93H-CG-HG3     10.045     34.977      1.686       162149 
    E93HG3-CG-HG2      1.696     34.981      2.174      5254158 
       I87H-CA-HA      8.171     34.984      4.416      1018799 
    E93HG2-CG-HG3      2.175     34.989      1.693      3868304 
    E93HB3-CG-HG3      1.834     34.989      1.691      1117968 
    E93HB2-CG-HG3      1.940     35.002      1.689      1049572 
    I87HG12-CA-HA      1.026     35.004      4.417       437242 
    I87HG13-CA-HA      1.344     35.010      4.414       773076 
      I87HB-CA-HA      1.553     35.011      4.416      1827150 
      E93H-CG-HG2     10.038     35.019      2.172       221604 
    Q102HB2-CA-HA      2.207     35.052      4.048      3690461 
Q102H/L103H/S83H-CA/Q102CA/K80CA-HA/Q102HA/K80HA      7.829     35.090      4.049      1915731 
E105H/E105H-CA/Q102CA-HA/Q102HA      7.972     35.114      4.058      2546044 
K80HB3/Q102HG3/E105QB/E105QB-CA/Q102CA/E105CA/Q102CA-HA/Q102HA/E105HA/Q102HA      2.114     35.135      4.054      6492178 
L106H/L106H-E105CA/Q102CA-HA/Q102HA      7.377     35.142      4.059       509173 
L108HD2-E105CA-HA      0.896     35.149      4.059      1239231 
     E105QG-CA-HA      2.388     35.152      4.056      2575024 
     E35HA-CG-HG2      3.714     35.167      1.323       220954 
     E35HA-CG-HG3      3.704     35.194      1.637       281024 
    E35HB3-CG-HG3      2.085     35.196      1.634       618558 
    E35HB2-CG-HG3      1.965     35.196      1.642       601568 
  L108H-E105CA-HA      8.208     35.199      4.060       778084 
    E35HB3-CG-HG2      2.066     35.201      1.329       307776 
    E35HB2-CG-HG2      1.949     35.215      1.325       342605 
      S83QB-CA-HA      4.063     35.221      4.469      6533679 
       S83H-CA-HA      7.819     35.224      4.469      2195494 
    G84H-S83CA-HA      7.737     35.224      4.470       949111 
    E35HG3-CG-HG2      1.632     35.250      1.325      1068421 
            ?-?-?      1.863     35.252      4.309       504089 
    E35HG2-CG-HG3      1.323     35.265      1.633      1380966 
S36H/K39H-E35CA/E35CA-HA/E35HA      8.098     35.269      3.705       358146 
  W77HH2-E35CA-HA      6.856     35.279      3.702       553701 
  P30HD2-V29CA-HA      3.761     35.283      4.311      3713222 
      V29HB-CA-HA      2.000     35.286      4.311       938167 
       E35H-CA-HA      8.717     35.289      3.708       475576 
  W77HZ3-E35CA-HA      6.638     35.290      3.707       477021 
     V29HG2-CA-HA      0.904     35.297      4.310      4095626 
       V29H-CA-HA      7.528     35.309      4.312       776315 
K80HB2/L108HB2-CA/E105CA-HA/E105HA      1.796     35.331      4.058      3682956 
K80HG3/L108HB3-CA/E105CA-HA/E105HA      1.534     35.369      4.055      1947153 
     E35HB2-CA-HA      1.955     35.373      3.707      1133825 
      E101H-CA-HA      8.489     35.377      3.962      1497126 
L103HD1-Q100CA-HA      1.241     35.377      3.283       568684 
    Q100HG2-CA-HA      1.076     35.379      3.287       714420 
    Q100HB2-CA-HA      1.755     35.381      3.283      1101722 
  F95HZ-Q100CA-HA      6.590     35.382      3.287       530248 
  K104H-E101CA-HA      8.871     35.383      3.962       577661 
Q102H/S83H-E101CA/E79CA-HA/E79HA      7.826     35.383      3.958       801813 
     E101QB-CA-HA      2.057     35.383      3.961      3410978 
  Y44QE-Q100CA-HA      6.870     35.394      3.284       646414 
Q100HB3/L103HB3-CA/Q100CA-HA/Q100HA      1.536     35.394      3.283       896646 
     K80HG2-CA-HA      1.666     35.397      4.055      1773300 
       K80H-CA-HA      8.096     35.397      4.056      1666006 
    Q100HG3-CA-HA      0.972     35.404      3.284       622943 
      Q100H-CA-HA      7.474     35.408      3.284       666449 
  E101H-Q100CA-HA      8.491     35.409      3.284       299428 
  L103H-Q100CA-HA      7.836     35.410      3.283       340568 
E35HB3/Q102HB3-CA/M99CA-HA/M99HA      2.059     35.420      3.704      1197839 
L103HB2-Q100CA-HA      2.315     35.421      3.285       409294 
E35HG3/M99HB3-CA/M99CA-HA/M99HA      1.617     35.479      3.706      1408323 
M99HG2/Q102HB2-CA/M99CA-HA/M99HA      2.213     35.562      3.698      1346078 
     M99HB2-CA-HA      1.863     35.604      3.696      1107861 
       M99H-CA-HA      7.344     35.604      3.696       843351 
     E79HB3-CA-HA      2.148     35.610      3.988      2361656 
    D18H-E14CA-HA      8.490     35.615      3.822       221281 
   F19HZ-M99CA-HA      7.207     35.619      3.691       495698 
     E79HG3-CA-HA      2.251     35.625      3.987      2326405 
E79HB2/E79HG2-CA/E79CA-HA/E79HA      2.373     35.630      3.988      3772226 
      K43QG-CA-HA      1.541     35.644      3.916      1664206 
   A82HB-E79CA-HA      1.577     35.648      3.988      2099607 
     K43HB2-CA-HA      1.707     35.649      3.915      2056254 
    Y44H-K43CA-HA      8.349     35.649      3.916       382470 
  V81HG1-K43CA-HA      0.711     35.663      3.914      2537031 
   H46QB-K43CA-HA      3.396     35.663      3.914      1419291 
       E79H-CA-HA      8.632     35.665      3.989      1461068 
       K43H-CA-HA      8.759     35.669      3.914      1098932 
      E14QB-CA-HA      2.039     35.671      3.813      2326216 
    A82H-E79CA-HA      8.281     35.673      3.993       414840 
     K43HB3-CA-HA      2.003     35.677      3.914      1853185 
E14HG3/L17HB2-CA/E14CA-HA/E14HA      2.168     35.681      3.810      1532978 
  L17HD1-E14CA-HA      0.784     35.681      3.811       900338 
    D47H-K43CA-HA      9.008     35.682      3.910       248117 
  V81HG2-K43CA-HA      0.995     35.686      3.912       779869 
       E14H-CA-HA      7.405     35.693      3.811       939384 
    K73H-K72CA-HA      7.403     35.698      3.747       922810 
    K80H-E79CA-HA      8.102     35.706      3.996       544537 
     K72HG2-CA-HA      1.507     35.706      3.736      1998617 
    L17H-E14CA-HA      8.260     35.718      3.817       322765 
            ?-?-?      0.870     35.724      3.742       671352 
    G76H-K72CA-HA      7.840     35.728      3.735       561928 
E35HG2/K72HG3/A75HB-CA/K72CA/K72CA-HA/K72HA/K72HA      1.349     35.733      3.741      3852787 
K72HB3/K72HB2-CA/K72CA-HA/K72HA      1.799     35.744      3.741      4205692 
       K72H-CA-HA      8.006     35.755      3.742      1919176 
    A75H-K72CA-HA      8.898     35.781      3.742       580945 
      E79H-CG-HG3      8.630     35.966      2.240       844004 
      E79H-CG-HG2      8.630     35.968      2.372       980949 
   K80H-E79CG-HG3      8.093     35.978      2.241       579475 
     E79HA-CG-HG2      3.992     35.983      2.369      2533460 
   K80H-E79CG-HG2      8.093     35.983      2.371       675784 
     E79HA-CG-HG3      3.998     35.987      2.241      2119562 
 G76HA3-E79CG-HG2      3.867     35.987      2.371       538216 
 G76HA3-E79CG-HG3      3.861     35.987      2.239       427422 
L108HB3-E109CG-HG3      1.548     36.006      2.241       584892 
  A82HB-E79CG-HG2      1.562     36.017      2.376       595331 
    E69H-S28CA-HA      8.536     36.020      4.225       250567 
E79HB2/E79HG2-CG/E79CG-HG3/E79HG3      2.355     36.029      2.246     27885306 
    E79HG3-CG-HG2      2.246     36.034      2.370     22240682 
    V29H-S28CA-HA      7.537     36.039      4.227       753334 
      S28QB-CA-HA      3.879     36.045      4.227      3317579 
       S28H-CA-HA      8.236     36.054      4.228      1047659 
  E69HB3-S28CA-HA      2.052     36.054      4.227      1229203 
  E69HB2-S28CA-HA      2.245     36.060      4.229       920888 
  H31HD2-S28CA-HA      7.277     36.068      4.224       511213 
     E109H-CG-HG2      7.952     36.084      2.316       639782 
    F70H-S28CA-HA      7.734     36.103      4.229       334299 
     N24HA-CB-HB3      4.737     36.106      2.812       234940 
     N24HA-CB-HB2      4.730     36.106      2.564       199645 
      N24H-CB-HB3      8.256     36.129      2.809       346734 
    N24HB3-CB-HB2      2.807     36.130      2.562      1337380 
    N24HB2-CB-HB3      2.558     36.146      2.809      1751724 
   N24HD21-CB-HB3      7.648     36.153      2.815       365910 
   N24HD21-CB-HB2      7.652     36.170      2.565       241965 
      N24H-CB-HB2      8.255     36.227      2.554       227532 
     E14HA-CG-HG3      3.819     36.332      2.165       543916 
     E14HA-CG-HG2      3.817     36.346      2.231       571439 
      E14H-CG-HG2      7.407     36.372      2.230       497241 
      E14H-CG-HG3      7.408     36.382      2.169       539707 
    K104HD2-CA-HA      1.757     36.382      3.840       636260 
E69HG2/E101HG3/E109HG3-CG/E101CG/E109CG-HG2/E101HG3/E109HG2      2.293     36.384      2.297     48052784 
  Y44QE-K104CA-HA      6.888     36.391      3.832       288534 
 L48HD2-K104CA-HA      0.663     36.394      3.839       493133 
            ?-?-?      7.988     36.396      0.915       362816 
     E14QB-CG-HG3      2.043     36.400      2.170      7209508 
     E14QB-CG-HG2      2.050     36.400      2.230      5524176 
E69HB3/E101QB/E109QB-CG/E101CG/E109CG-HG2/E101HG3/E109HG2      2.064     36.407      2.297      8706476 
     K104QG-CA-HA      1.448     36.407      3.838      2320833 
V107HG2-K104CA-HA      0.939     36.408      3.839      1133422 
  E105H-K104CA-HA      7.978     36.409      3.839       460014 
    K104HB3-CA-HA      2.446     36.415      3.838      1649776 
V107H/L108H-K104CA/K104CA-HA/K104HA      8.207     36.418      3.836       671852 
     I20H-CD1-HD1      8.415     36.419      0.914       997484 
    I20HA-CD1-HD1      3.998     36.419      0.912      1125787 
 L48HD1-K104CA-HA      0.468     36.420      3.838      1235842 
  G21H-I20CD1-HD1      8.883     36.423      0.913       245719 
      K104H-CA-HA      8.863     36.423      3.837       855729 
 A38HA-I20CD1-HD1      3.852     36.424      0.914       773437 
 V107HB-K104CA-HA      2.236     36.424      3.845      1523905 
    E101HA-CG-HG3      3.963     36.430      2.292      1374067 
V74HG2-I20CD1-HD1      0.143     36.430      0.911       549990 
I20HD1/L42HD1-CD1/I20CD1-HD1/I20HD1      0.913     36.431      0.913     72890024 
  I20HG13-CD1-HD1      2.150     36.431      0.914      4020872 
A16HB/A38HB-I20CD1/I20CD1-HD1/I20HD1      1.549     36.435      0.912      2363453 
E69HA/E109HA-CG/E109CG-HG2/E109HG2      4.144     36.437      2.308      1517262 
 L17HA-I20CD1-HD1      4.223     36.438      0.913      1322219 
E101HG2/E69HG3-CG/E69CG-HG3/E69HG2      2.407     36.452      2.299     27857012 
    K104HB2-CA-HA      1.956     36.453      3.849      1417046 
T97HG2-E101CG-HG3      1.148     36.460      2.295       872680 
W66HH2-I20CD1-HD1      6.939     36.461      0.915       263547 
    I20HB-CD1-HD1      2.083     36.461      0.912      3765016 
  S28QB-E69CG-HG3      3.883     36.478      2.440       674567 
  S28QB-E69CG-HG2      3.880     36.478      2.306       674676 
E69H/E101H-CG/E101CG-HG2/E101HG3      8.509     36.487      2.302      2061754 
T97HG2-E101CG-HG2      1.146     36.489      2.399       941612 
E69H/E101H-CG/E101CG-HG3/E101HG2      8.503     36.492      2.418      1469806 
    E62HB3-CG-HG2      1.973     36.504      2.404      4367608 
    E62HB3-CG-HG3      1.973     36.504      2.183      4440427 
     E69HA-CG-HG3      4.150     36.508      2.442      1095065 
E62HA/E101HA-CG/E101CG-HG2/E101HG2      3.975     36.516      2.400      2612272 
E62HB2/E101QB-CG/E101CG-HG2/E101HG2      2.056     36.533      2.403      8321380 
    E62HB2-CG-HG3      2.044     36.538      2.181      7755598 
     E55HG2-CA-HA      2.392     36.579      3.894      1248498 
     E55HG3-CA-HA      2.244     36.586      3.896      2372772 
E55HB2/V58HB-CA/E55CA-HA/E55HA      1.904     36.598      3.898      4592008 
     E55HB3-CA-HA      2.022     36.601      3.897      2647198 
  V58HG2-E55CA-HA      0.871     36.601      3.898      1930778 
    V58H-E55CA-HA      8.031     36.601      3.898       789417 
      E62H-CG-HG3      8.013     36.602      2.183      1282968 
     E62HA-CG-HG3      3.985     36.602      2.183      2067479 
      E62H-CG-HG2      8.007     36.605      2.402      1868075 
       E55H-CA-HA      8.785     36.608      3.898      1922459 
    E62HG2-CG-HG3      2.403     36.614      2.187     14454511 
V56H/A59H-E55CA/E55CA-HA/E55HA      7.608     36.622      3.898       782617 
 V58HG1-E62CG-HG2      0.827     36.625      2.401      1539893 
   K39QD-I89CA-HA      1.071     36.658      4.088       327163 
 E101HG3-Y98CA-HA      2.274     36.675      4.307       477540 
I89HG2/I89HG13/I89HD1-CA/I89CA/I89CA-HA/I89HA/I89HA      0.693     36.679      4.086      2672042 
    I89HG12-CA-HA      1.426     36.684      4.087       997397 
      I89HB-CA-HA      1.664     36.684      4.086      1248645 
   Q102H-Y98CA-HA      7.816     36.684      4.307       241783 
       I89H-CA-HA      8.464     36.688      4.085       806240 
    K90H-I89CA-HA      9.003     36.690      4.087      2055321 
     Y98HB3-CA-HA      2.777     36.723      4.307      1571904 
      Y98QD-CA-HA      7.030     36.728      4.308      1221201 
      Y98QE-CA-HA      6.806     36.728      4.309       336845 
     Y98HB2-CA-HA      3.102     36.737      4.307      1965931 
   E101H-Y98CA-HA      8.493     36.738      4.308       397711 
       Y98H-CA-HA      7.949     36.740      4.308      1471944 
  E101QB-Y98CA-HA      2.077     36.748      4.306      1132412 
    M99H-Y98CA-HA      7.321     36.760      4.309       336429 
    E55HB3-CG-HG2      2.040     36.876      2.397      6030824 
    E55HB2-CG-HG2      1.938     36.877      2.396      4357402 
 P92HA-I89CD1-HD1      4.214     36.889      0.671       392146 
  P51HB3-H46CA-HA      1.940     36.897      3.749       774512 
P92HB3-I89CD1-HD1      2.009     36.908      0.670       964881 
   P51HA-H46CA-HA      4.339     36.908      3.751      1060122 
  P51HB2-H46CA-HA      2.075     36.909      3.748       948185 
N91H/G40H-I89CD1/I89CD1-HD1/I89HD1      7.886     36.919      0.670       744198 
N91HD22-I89CD1-HD1      8.102     36.920      0.668       320417 
    E55HB3-CG-HG3      2.028     36.923      2.242      4761862 
      H46QB-CA-HA      3.393     36.926      3.749      2010717 
     E55HA-CG-HG2      3.906     36.928      2.394      1648235 
  I89HG12-CD1-HD1      1.430     36.928      0.670      5450750 
    I89HB-CD1-HD1      1.685     36.929      0.669      4154046 
    V50H-H46CA-HA      8.089     36.929      3.745       603486 
       H46H-CA-HA      7.794     36.930      3.748      1024326 
    D47H-H46CA-HA      9.003     36.930      3.748       383590 
I89HA/S36QB-CD1/I89CD1-HD1/I89HD1      4.081     36.933      0.670      1156871 
G40HA3-I89CD1-HD1      3.498     36.933      0.670      1631990 
     I89H-CD1-HD1      8.463     36.935      0.669       752560 
     H46HD2-CA-HA      7.172     36.936      3.751       345351 
K39HB2-I89CD1-HD1      1.571     36.937      0.669      2716100 
  P51HD2-H46CA-HA      3.264     36.939      3.745       649416 
  V81HG1-H46CA-HA      0.723     36.947      3.747       434760 
   V56H-E55CG-HG2      7.595     36.960      2.393       495164 
    E55HG2-CG-HG3      2.393     36.976      2.243     21319932 
    E55HB2-CG-HG3      1.922     36.993      2.241      3780884 
      E55H-CG-HG3      8.783     36.995      2.243      1065043 
     E55HA-CG-HG3      3.901     37.013      2.241      2264231 
      E55H-CG-HG2      8.784     37.016      2.393       883704 
   V56H-E55CG-HG3      7.598     37.043      2.242       513103 
       K39H-CA-HA      8.101     37.205      3.544       845508 
  L42HB2-K39CA-HA      1.970     37.206      3.546       674557 
K39HG2/L42HD1-CA/K39CA-HA/K39HA      0.888     37.206      3.546      1944538 
     K39HG3-CA-HA      0.323     37.207      3.546       777600 
K39HB3/L42HB3-CA/K39CA-HA/K39HA      1.316     37.214      3.546      1285197 
   L42HG-K39CA-HA      2.082     37.216      3.544       354639 
      V52HB-CA-HA      2.160     37.216      3.824      1098933 
     K39HB2-CA-HA      1.570     37.218      3.546       944062 
    L42H-K39CA-HA      7.974     37.226      3.543       450107 
  I87HD1-K39CA-HA      0.716     37.230      3.545       682340 
    S53H-V52CA-HA      8.546     37.250      3.828       868791 
V52HG1/V52HG2-CA/V52CA-HA/V52HA      0.978     37.268      3.826       991516 
     I13H-CD1-HD1      7.195     37.327      0.845       510408 
    I13HB-CD1-HD1      1.813     37.364      0.846      2085968 
            ?-?-?      4.354     37.366      0.848       424144 
    I13HA-CD1-HD1      3.558     37.376      0.847      1787626 
            ?-?-?      8.550     37.384      0.848       474414 
  R60HD3-E64CG-QG      3.023     37.385      2.233       440517 
  W66HE1-E64CG-QG     10.669     37.385      2.220       352661 
            ?-?-?      3.020     37.390      2.215       436491 
            ?-?-?      1.966     37.390      0.847      2323262 
            ?-?-?      3.899     37.390      0.848      2173134 
     E64HB3-CG-QG      1.287     37.392      2.230      1723606 
       E64H-CG-QG      8.043     37.397      2.225      1123673 
   I13HD1-CD1-HD1      0.849     37.401      0.849    134841808 
  I13HG12-CD1-HD1      1.562     37.409      0.849      5150314 
  R60HD2-E64CG-QG      3.335     37.415      2.235       535950 
  E14H-I13CD1-HD1      7.410     37.419      0.850       448155 
     Y94QD-CB-HB3      7.178     37.467      2.719       619578 
    Y94HB3-CB-HB2      2.716     37.468      3.378      2427998 
    Y94HB2-CB-HB3      3.377     37.471      2.716      2463610 
      Y94H-CB-HB3      7.339     37.472      2.715       564862 
     Y94HA-CB-HB3      4.503     37.475      2.717       640665 
     Y94HA-CB-HB2      4.502     37.485      3.375       873532 
     Y94QD-CB-HB2      7.179     37.498      3.373       929606 
      Y94H-CB-HB2      7.334     37.506      3.376       537493 
            ?-?-?      0.735     37.521      3.898      2036390 
            ?-?-?      0.964     37.531      3.897      2253758 
            ?-?-?      8.539     37.531      3.896      2957767 
            ?-?-?      0.857     37.540      3.898      1305517 
            ?-?-?      8.842     37.548      3.897       479661 
            ?-?-?      2.044     37.562      3.896       533292 
       I13H-CB-HB      7.186     37.691      1.816       812049 
      I13HA-CB-HB      3.530     37.706      1.813       424123 
      F95H-CB-HB2      7.702     37.710      3.340       841968 
      F95H-CB-HB3      7.700     37.710      3.042       720837 
    F95HB2-CB-HB3      3.340     37.711      3.043      2157385 
     F95HA-CB-HB2      5.056     37.711      3.344       399051 
     F95HA-CB-HB3      5.050     37.716      3.047       490751 
    E14H-I13CB-HB      7.412     37.717      1.812       593262 
    F95HB3-CB-HB2      3.041     37.723      3.339      2043817 
     I13HG2-CB-HB      0.942     37.726      1.814      1740770 
     F95QD-CB-HB3      7.178     37.733      3.044       707407 
    I13HG13-CB-HB      1.041     37.734      1.814       485120 
    I13HG12-CB-HB      1.557     37.739      1.812       702692 
     F95QD-CB-HB2      7.175     37.754      3.343       985057 
      Y44QE-CA-HA      6.876     37.863      4.340       377470 
  D47HB2-Y44CA-HA      2.956     37.880      4.342      1217463 
    L45H-Y44CA-HA      8.088     37.887      4.340       368241 
     Y44HB3-CA-HA      3.022     37.887      4.343      1032570 
       Y44H-CA-HA      8.348     37.888      4.343      1063114 
      Y44QD-CA-HA      7.190     37.890      4.342      1650505 
     Y44HB2-CA-HA      3.436     37.895      4.343      1231205 
    D47H-Y44CA-HA      9.006     37.898      4.341       461492 
      Y44HA-CA-HA      4.346     37.900      4.344     10102386 
  E35HB2-S32CA-HA      1.962     37.902      4.224       283504 
  D47HB3-Y44CA-HA      2.659     37.902      4.344       433734 
      S32QB-CA-HA      3.965     37.922      4.223      1069326 
    E35H-S32CA-HA      8.724     37.946      4.229       313846 
  E35HB3-S32CA-HA      2.061     37.989      4.226       449112 
     Y98QE-CB-HB2      6.806     38.113      3.102       212661 
   M99H-Y98CB-HB3      7.324     38.142      2.778       530973 
     Y98QD-CB-HB2      7.031     38.148      3.103       984011 
     Y98QE-CB-HB3      6.804     38.157      2.775       265942 
     Y98QD-CB-HB3      7.030     38.158      2.776      1145462 
    Y98HB2-CB-HB3      3.101     38.159      2.776      4953442 
    Y98HB3-CB-HB2      2.777     38.161      3.103      4478520 
     Y98HA-CB-HB2      4.303     38.165      3.103      1357179 
      Y98H-CB-HB3      7.948     38.166      2.776      1603995 
     Y98HA-CB-HB3      4.304     38.170      2.777      1324502 
      Y98H-CB-HB2      7.948     38.173      3.102      1314735 
      I20HA-CB-HB      3.995     38.196      2.074       330085 
V81HA/K39HA-I87CD1/I87CD1-HD1/I87HD1      3.545     38.199      0.724      1143001 
W77HB2-I87CD1-HD1      2.850     38.199      0.723       591795 
W77HB3-I87CD1-HD1      3.506     38.199      0.723       676808 
            ?-?-?      4.856     38.200      0.723       709567 
K80HB3-I87CD1-HD1      2.099     38.203      0.723       824176 
 W77HA-I87CD1-HD1      4.636     38.204      0.724       806980 
   I87HD1-CD1-HD1      0.724     38.205      0.724    134263616 
            ?-?-?      1.134     38.205      0.723       888787 
 K80QD-I87CD1-HD1      1.708     38.206      0.723      1466871 
I87HG12/V81HG2/K39HE3-CD1/I87CD1/I87CD1-HD1/I87HD1/I87HD1      1.026     38.207      0.724      6331674 
K39HE2-I87CD1-HD1      1.797     38.207      0.724      1784584 
  I87HG13-CD1-HD1      1.329     38.210      0.723      4534890 
     F19HA-CB-HB3      4.742     38.212      3.655       463087 
    I87HB-CD1-HD1      1.553     38.212      0.723      3308084 
  V81H-I87CD1-HD1      8.391     38.215      0.724       771363 
     I87H-CD1-HD1      8.151     38.215      0.724       618971 
K43HB3-I87CD1-HD1      2.005     38.216      0.723       625222 
W77HD1-I87CD1-HD1      7.128     38.218      0.723       576550 
    I87HA-CD1-HD1      4.415     38.218      0.725       907351 
    G21H-I20CB-HB      8.880     38.219      2.079       495046 
    F19HB3-CB-HB2      3.647     38.228      3.094      2084582 
F19QD/M99H-CB/Y98CB-HB2/Y98HB2      7.307     38.232      3.098       864456 
 I41HD1-F19CB-HB3      0.933     38.236      3.641       684238 
   I20H-F19CB-HB2      8.410     38.236      3.096       551819 false positive
   I20H-F19CB-HB3      8.414     38.236      3.649       552434 false positive
       I20H-CB-HB      8.413     38.238      2.076      1013380 
   L17HA-I20CB-HB      4.224     38.239      2.077       922420 
    I20HG12-CB-HB      1.018     38.245      2.078       593500 
I20HG2/I20HD1-CB/I20CB-HB/I20HB      0.866     38.246      2.078      1945044 
      F19H-CB-HB2      8.463     38.248      3.097       722321 
    F19HB2-CB-HB3      3.094     38.255      3.648      2191760 
 I41HD1-F19CB-HB2      0.930     38.262      3.099       861582 
     F19HA-CB-HB2      4.737     38.268      3.096       658236 
      F19H-CB-HB3      8.471     38.271      3.649       757334 
  W66HH2-I20CB-HB      6.950     38.274      2.077       251287 
     F19QD-CB-HB3      7.293     38.283      3.652       521305 
       V2HB-CA-HA      1.911     38.379      4.055       533082 
      N3H-V2CA-HA      8.578     38.393      4.059      3834708 
      V2HG2-CA-HA      0.758     38.406      4.058      1376889 
      V2HG1-CA-HA      0.872     38.410      4.058      1403274 
            ?-?-?      1.846     38.415      3.813       240956 
  K73HB3-F70CA-HA      1.485     38.416      3.809       255424 
   H46HA-P51CA-HA      3.746     38.419      4.340       810965 
P51HB3/P51HG3-CA/P51CA-HA/P51HA      1.937     38.427      4.341      1464147 
P51HB2/P51HG2-CA/P51CA-HA/P51HA      2.070     38.429      4.340      1972776 
    V52H-P51CA-HA      8.822     38.429      4.340      2081410 
     F70HB2-CA-HA      3.578     38.439      3.806       882502 
     F70HB3-CA-HA      3.649     38.446      3.805      1274463 
       F70H-CA-HA      7.732     38.450      3.808       501522 
      F70H-CB-HB3      7.737     38.453      3.668       377102 
      F70QD-CA-HA      7.029     38.458      3.794       383855 
    T71H-F70CA-HA      8.680     38.462      3.803       223938 
      F70H-CB-HB2      7.730     38.496      3.551       388426 
     F70QD-CB-HB2      7.030     38.503      3.556       355518 
   T71H-F70CB-HB3      8.675     38.523      3.652       239568 
   T71H-F70CB-HB2      8.675     38.525      3.539       306896 
     F70HA-CB-HB2      3.815     38.529      3.545       426512 
     F70QD-CB-HB3      7.024     38.563      3.662       362444 
   A38HA-I41CB-HB      3.844     38.867      1.900       549886 
    I41HG13-CB-HB      0.721     38.887      1.899       515295 
I41HG2/I41HD1-CB/I41CB-HB/I41HB      0.953     38.890      1.900      2194828 
    I41HG12-CB-HB      1.625     38.892      1.902       581854 
I41H/L42H-CB/I41CB-HB/I41HB      7.986     38.899      1.899      1756813 
      I41HA-CB-HB      3.048     38.925      1.900       378189 
      I89HA-CB-HB      4.081     38.928      1.679       645793 
I89HG2/I89HD1/I89HG13-CB/I89CB/I89CB-HB/I89HB/I89HB      0.689     38.934      1.680      4170146 
       I89H-CB-HB      8.463     38.935      1.680      1537825 
    I89HG12-CB-HB      1.434     38.937      1.679      1516314 
   L88HA-I89CB-HB      4.317     38.966      1.680       424165 
    H31H-P30CA-HA      9.377     39.012      4.647       710647 
     P30HB2-CA-HA      2.356     39.053      4.638       895091 
            ?-?-?      1.368     39.055      4.637       653118 
     N67HA-CB-HB3      4.816     39.059      2.890       861645 
            ?-?-?      1.873     39.063      4.630       533226 
      N67H-CB-HB3      8.802     39.078      2.892       920152 
  W66HA-N67CB-HB3      4.522     39.078      2.892       975132 
     P10HB2-CA-HA      2.281     39.089      4.542      1679575 
      P10QG-CA-HA      1.964     39.090      4.544       976649 
   F70H-N67CB-HB2      7.738     39.098      2.904       388558 
   N67HD22-CB-HB3      7.588     39.098      2.895       695291 
    T11H-P10CA-HA      8.508     39.100      4.541      1775139 
     P30HB3-CA-HA      2.074     39.101      4.633       564535 
   N67HD21-CB-HB3      7.279     39.105      2.889       482912 
     P10HB3-CA-HA      1.747     39.117      4.543       861328 
  T11HG2-P10CA-HA      1.304     39.130      4.544       431293 
            ?-?-?      9.421     39.182      3.922       188723 
       S32H-CB-QB      8.796     39.200      3.947       334834 
    N3HD21-CB-HB3      7.599     39.258      2.665      1060456 
       N3H-CB-HB3      8.584     39.258      2.665       668700 
   V56H-S53CB-HB2      7.591     39.273      4.292       356335 
   E55H-S53CB-HB3      8.785     39.283      4.017       910398 
   E55H-S53CB-HB2      8.783     39.286      4.293      1182218 
S53HB3/P54HD2-CB/S53CB-HB2/S53HB2      4.024     39.286      4.292     10888401 
  V56HB-S53CB-HB2      2.302     39.286      4.292       425065 
     S53HA-CB-HB3      4.736     39.290      4.021      2685595 
   V56H-S53CB-HB3      7.588     39.290      4.024       408717 
     S53HA-CB-HB2      4.736     39.290      4.291      2549380 
    S53HB2-CB-HB3      4.291     39.290      4.020     10430197 
   L48H-D47CB-HB2      7.603     39.294      2.939       565964 
 V56HG2-S53CB-HB2      1.112     39.295      4.294       453352 
 P54HD3-S53CB-HB2      3.538     39.295      4.292      1097994 
            ?-?-?      0.982     39.297      4.292       273637 
      S53H-CB-HB3      8.537     39.297      4.021      1382038 
      S53H-CB-HB2      8.542     39.299      4.292       887927 
    N3HD21-CB-HB2      7.602     39.301      2.759       800243 
            ?-?-?      0.975     39.301      4.021       466527 
       N3H-CB-HB2      8.578     39.302      2.759       620306 
 E55HB3-S53CB-HB2      2.019     39.307      4.289       403208 
      N3HA-CB-HB3      4.686     39.309      2.665      1147542 
    N3HD22-CB-HB2      6.906     39.312      2.759       180628 
 P54HD3-S53CB-HB3      3.537     39.314      4.018       790152 
      N3HA-CB-HB2      4.682     39.314      2.758      1032921 
  I89HD1-S36CB-QB      0.704     39.315      4.085       404802 
   K39QD-S36CA-HA      1.107     39.315      4.019       756866 
     N3HB3-CB-HB2      2.665     39.324      2.758     46400504 
   L48H-D47CB-HB3      7.605     39.325      2.663      1244932 
 P54HG2-S53CB-HB3      2.304     39.326      4.020       414153 
 E55HB3-S53CB-HB3      2.022     39.326      4.016       346602 
    N3HD22-CB-HB3      6.909     39.337      2.663       212069 
      S32HA-CB-QB      4.241     39.342      3.976      2045682 
    D47HB2-CB-HB3      2.964     39.345      2.660      4531562 
     N3HB2-CB-HB3      2.767     39.345      2.665     46904232 
  K39HB2-S36CA-HA      1.599     39.346      4.008       425701 
S36H/T37H-CB/S36CB-QB/S36QB      8.102     39.349      4.087       738410 
    D47HB3-CB-HB2      2.656     39.358      2.946      5156085 
            ?-?-?      8.103     39.359      3.785       688287 
  I89HD1-S36CA-HA      0.705     39.370      4.007      1313081 
      D47H-CB-HB2      9.007     39.371      2.946      1039220 
S36H/T37H/K39H-CA/S36CA/S36CA-HA/S36HA/S36HA      8.104     39.373      4.004      1176135 
            ?-?-?      3.796     39.378      4.087      1609683 
     D47HA-CB-HB3      4.301     39.386      2.656      1361873 
     D47HA-CB-HB2      4.292     39.387      2.947      1119638 
      D47H-CB-HB3      9.013     39.391      2.658       898087 
    G40H-S36CA-HA      7.876     39.418      4.005       222286 
     T11HG2-CA-HA      1.302     39.454      4.182       583593 
       T11H-CA-HA      8.512     39.462      4.184       215728 
     L45HG-CB-HB3      1.923     39.464      1.690       729664 
  E69HG3-S28CB-QB      2.446     39.465      3.878       751029 
  E69HG2-S28CB-QB      2.312     39.465      3.876       639640 
      S28HA-CB-QB      4.228     39.470      3.879      4904397 
    V29H-S28CB-QB      7.530     39.478      3.878      1440712 
   E14QB-T11CA-HA      2.035     39.482      4.194       228344 
  E69HB3-S28CB-QB      2.048     39.483      3.877      1248402 
  E69HB2-S28CB-QB      2.237     39.483      3.877       850456 
   H46H-L45CB-HB3      7.803     39.484      1.695       301611 
  V29HG2-S28CB-QB      0.889     39.484      3.879      1384024 
       S28H-CB-QB      8.233     39.491      3.879      2884004 
    A12H-T11CA-HA      9.188     39.492      4.192       291437 
H31HD2/N67HD21-S28CB/S28CB-QB/S28QB      7.281     39.495      3.879       766526 
      T11HB-CA-HA      4.396     39.501      4.187       559109 
    L45HB3-CB-HB2      1.691     39.504      2.253      2066952 
     L45HG-CB-HB2      1.924     39.504      2.254       738578 
     L45HA-CB-HB3      3.810     39.508      1.692       522746 
    L45HB2-CB-HB3      2.253     39.511      1.691      2059479 
      L45H-CB-HB3      8.085     39.514      1.691       807215 
L45HD1/L45HD2-CB/L45CB-HB2/L45HB2      0.861     39.515      2.254      1414557 
      L45H-CB-HB2      8.084     39.520      2.256       649308 
   H46H-L45CB-HB2      7.807     39.523      2.255       260555 
     L45HA-CB-HB2      3.815     39.531      2.256       648054 
L45HD1/L45HD2-CB/L45CB-HB3/L45HB3      0.865     39.544      1.692      1372155 
     K5H-F4CB-HB3      8.246     39.584      3.121       574524 
     F4HB2-CB-HB3      2.984     39.587      3.120     28208236 
      F4HA-CB-HB3      4.532     39.589      3.121      2225490 
     F4HB3-CB-HB2      3.119     39.590      2.986     27808544 
      F4QD-CB-HB3      7.226     39.593      3.121      1236826 
      F4QD-CB-HB2      7.228     39.596      2.984      1285475 
       F4H-CB-HB3      8.349     39.597      3.120       826689 
      F4HA-CB-HB2      4.532     39.608      2.987      2231117 
       F4H-CB-HB2      8.348     39.611      2.987      1146206 
     K5H-F4CB-HB2      8.253     39.626      2.988       485764 
   K15HA-D18CB-QB      3.933     39.712      2.648       549584 
      D18HA-CB-QB      4.517     39.763      2.649      1089567 
            ?-?-?      1.506     39.786      3.029       338720 
            ?-?-?      3.933     39.787      3.028       541048 
            ?-?-?      8.488     39.791      3.023      1115113 
     K39QD-CE-HE2      1.068     39.826      1.806      1004016 
    K39HE2-CE-HE3      1.815     39.833      1.007       405358 
    K39HE3-CE-HE2      1.002     39.833      1.806      1192186 
       S8HA-CB-QB      4.381     39.937      3.852      5787106 
        S8H-CB-QB      8.359     39.945      3.851      2760932 
 F95QE-I41CD1-HD1      6.842     39.972      0.925       258172 
     S26HA-CB-HB2      4.516     39.975      3.888      2366590 
      S26H-CB-HB2      7.770     39.976      3.886      1025279 
     S26HA-CB-HB3      4.512     39.978      4.023      3096025 
      S26H-CB-HB3      7.772     39.978      4.023      1275108 
I41HA/F19HB2-CD1/I41CD1-HD1/I41HD1      3.087     39.996      0.927      1588362 
F19HB3-I41CD1-HD1      3.645     39.999      0.927      1117266 
  I41HG12-CD1-HD1      1.608     39.999      0.928      2343882 
I20HG13-I41CD1-HD1      2.142     40.001      0.930       690062 
 F19QD-I41CD1-HD1      7.297     40.002      0.927       965302 
    I41HB-CD1-HD1      1.916     40.004      0.927      2266238 
T37HG2-I41CD1-HD1      1.165     40.006      0.926      2616754 
     I41H-CD1-HD1      7.988     40.007      0.927      1004211 
 A38HA-I41CD1-HD1      3.846     40.009      0.927      1431406 
I41HD1/I41HG2-CD1/I41CD1-HD1/I41HD1      0.931     40.012      0.929     36086320 
  I20H-I41CD1-HD1      8.441     40.012      0.923       361634 
 I20HA-I41CD1-HD1      3.994     40.015      0.926       671492 
 F19HZ-I41CD1-HD1      7.190     40.019      0.924       433216 
 M99HE-I41CD1-HD1      1.717     40.022      0.930      1274396 
D18H/F19H-CB/D18CB-QB/D18QB      8.505     40.028      2.664      1382442 
 N85HD21-S83CB-QB      7.505     40.116      4.061       414505 
A27H/N85HD22-S26CB/S83CB-HB3/S83QB      7.136     40.123      4.056       298620 
      S83HA-CB-QB      4.470     40.126      4.061      4006692 
S83H/N85H-CB/S83CB-QB/S83QB      7.820     40.128      4.063      2146078 
     Y44QD-CB-HB3      7.189     40.140      3.011       741844 
   N91HD22-CB-HB3      8.116     40.173      2.117       363583 
      Y44H-CB-HB3      8.354     40.174      3.013       850509 
  K80HA-N85CB-HB3      4.059     40.175      2.669       326026 
   R86H-N85CB-HB3      8.501     40.175      2.658      1299899 
   N85HD22-CB-HB2      7.148     40.179      2.508       259342 
     Y44HA-CB-HB2      4.340     40.186      3.441       572211 
    Y44HB2-CB-HB3      3.440     40.187      3.013      1561956 
   R86H-N85CB-HB2      8.513     40.187      2.508       641554 
   N91HD21-CB-HB3      6.812     40.187      2.121       371007 
   L45H-Y44CB-HB3      8.081     40.189      3.013       470838 
 K80HB2-N85CB-HB2      1.790     40.189      2.506       514941 
    Y44HB2-CB-HB2      3.440     40.190      3.438      1338256 
   N85HD21-CB-HB3      7.502     40.193      2.667       476473 
   N91HD22-CB-HB2      8.112     40.193      2.311       384188 
   L45H-Y44CB-HB2      8.084     40.195      3.445       323206 
      Y44H-CB-HB2      8.351     40.201      3.441       885506 
     N85HA-CB-HB3      4.629     40.201      2.669      1629616 
   N85HD21-CB-HB2      7.505     40.203      2.505       639391 
    Y44HB3-CB-HB2      3.021     40.205      3.440      1682656 
    N85HB2-CB-HB3      2.506     40.206      2.670      7063258 
     N85HA-CB-HB2      4.630     40.209      2.506      1141431 
      N85H-CB-HB3      7.829     40.209      2.670      1071533 
     Y44HA-CB-HB3      4.341     40.210      3.014       490769 
Y44QE/F95QE-CB/Y44CB-HB3/Y44HB3      6.856     40.210      2.999       348581 
R86HG2/K80HG2-N85CB/N85CB-HB3/N85HB3      1.675     40.210      2.673       424197 
    N85HB3-CB-HB2      2.669     40.211      2.507      7192654 
      N85H-CB-HB2      7.830     40.212      2.506      1478832 
Y44QE/F95QE-CB/Y44CB-HB2/Y44HB2      6.851     40.214      3.439       425343 
      N91H-CB-HB2      7.853     40.214      2.315       361339 
     Y44QD-CB-HB2      7.188     40.215      3.441       688250 
R86HG3/K80HG3-N85CB/N85CB-HB2/N85HB2      1.547     40.215      2.504       283188 
    N91HB3-CB-HB2      2.111     40.216      2.315      2232178 
    N91HB2-CB-HB3      2.318     40.221      2.115      1760393 
   N91HD21-CB-HB2      6.807     40.221      2.315       478284 
            ?-?-?      7.175     40.224      2.312       276480 
  K80HA-N85CB-HB2      4.056     40.224      2.507       393663 
     N91HA-CB-HB2      5.082     40.228      2.311       460765 
R86HG2/K80HG2-N85CB/N85CB-HB2/N85HB2      1.665     40.229      2.504       436203 
     N91HA-CB-HB3      5.088     40.238      2.116       430564 
   N85HD22-CB-HB3      7.137     40.244      2.669       175375 
 K80HB2-N85CB-HB3      1.790     40.294      2.670       480659 
     P92HD2-CA-HA      3.767     40.427      4.199       427014 
I89HG2/I89HD1-P92CA/P92CA-HA/P92HA      0.705     40.458      4.200      2415205 
P92HB3/P92HG2-CA/P92CA-HA/P92HA      2.038     40.460      4.199      2281272 
     P92HB2-CA-HA      2.184     40.461      4.199      2589330 
    E93H-P92CA-HA     10.029     40.463      4.200       307606 
     P92HD3-CA-HA      3.393     40.479      4.197       506222 
     D34HA-CB-HB3      4.604     40.618      3.122       602485 
     D34HA-CB-HB2      4.606     40.622      2.949       509501 
            ?-?-?      7.162     40.624      1.836       480360 
    D34HB2-CB-HB3      2.964     40.639      3.119      1574127 
            ?-?-?      6.783     40.639      1.836       664780 
    D34HB3-CB-HB2      3.116     40.641      2.965      1584352 
      D34H-CB-HB2      7.334     40.641      2.952       304372 
      D34H-CB-HB3      7.342     40.658      3.118       223646 
       I13H-CA-HA      7.186     40.758      3.520       531402 
    A16H-I13CA-HA      8.043     40.771      3.524       360502 
I13HG12/A16HB-CA/I13CA-HA/I13HA      1.540     40.813      3.516      1900181 
     I13HG2-CA-HA      0.932     40.814      3.517      2448506 
      I13HB-CA-HA      1.779     40.829      3.513       433315 
     I13HD1-CA-HA      0.872     40.841      3.513      2341356 
    R60HG3-CD-HD3      0.942     40.843      3.029       584194 
 W66HZ2-R60CD-HD3      7.312     40.844      3.031       278834 
    R60HG2-CD-HD3      1.470     40.855      3.029       383096 
    R60HG3-CD-HD2      0.940     40.868      3.332       730819 
Q63HE22-R60CD-HD3      6.772     40.869      3.028       282081 
  E64QG-R60CD-HD3      2.219     40.870      3.018       490720 
    E14H-I13CA-HA      7.414     40.871      3.508       387275 
     R60HA-CD-HD3      3.916     40.872      3.025       762493 
    R60HD2-CD-HD3      3.335     40.875      3.026      1613499 
    R60HD3-CD-HD2      3.024     40.878      3.333      1777828 
    R60HG2-CD-HD2      1.475     40.884      3.333       455932 
     R60HE-CD-HD2      7.811     40.885      3.334       596822 
  E64QG-R60CD-HD2      2.207     40.896      3.334       508182 
     R60HE-CD-HD3      7.812     40.896      3.026       713835 
     R60HA-CD-HD2      3.923     40.897      3.332       656326 
Q63HE22-R60CD-HD2      6.779     40.919      3.332       368915 
 W66HZ2-R60CD-HD2      7.305     40.922      3.334       288820 
    W77H-A78CB-HB      7.869     40.958      1.533       498659 
  P54HB2-A78CB-HB      2.491     40.971      1.533       794902 
       A78H-CB-HB      8.683     40.972      1.533      4446266 
   A75HA-A78CB-HB      3.845     40.974      1.532      2669245 
    E79H-A78CB-HB      8.628     40.974      1.533      2306030 
      A78HA-CB-HB      4.112     40.975      1.532      4132361 
  E79HB2-A78CB-HB      2.351     40.979      1.532       943832 
  P54HD3-A78CB-HB      3.533     40.981      1.532       897257 
L42HD1/V57HG2-A78CB/A78CB-HB/A78HB      0.893     40.981      1.532      5994248 
    L17HD1-CB-HB2      0.792     40.987      2.165       953296 
      A78HB-CB-HB      1.535     40.993      1.534     69102456 
   D18H-L17CB-HB2      8.499     41.006      2.164       342647 
   A75HB-A78CB-HB      1.403     41.007      1.533      4349038 
            ?-?-?      4.851     41.009      1.534      1373103 
     I20HG2-CA-HA      0.835     41.016      4.001      1161329 
      L17H-CB-HB3      8.256     41.018      1.409       392313 
I20HB/I20HG13-CA/I20CA-HA/I20HA      2.122     41.023      4.001       755939 
  E14HA-L17CB-HB3      3.817     41.024      1.412       356274 
    L17HD1-CB-HB3      0.804     41.029      1.410      1156512 
       I20H-CA-HA      8.409     41.029      4.005       491537 
    I20HG12-CA-HA      1.002     41.030      4.000       873600 
     I20HD1-CA-HA      0.925     41.030      4.000       837458 
            ?-?-?      1.956     41.033      4.003      1028220 
            ?-?-?      3.001     41.038      4.001       565532 
     L17HA-CB-HB2      4.223     41.042      2.161       444714 
    L17HD2-CB-HB2      0.889     41.047      2.165       886471 
      L17H-CB-HB2      8.253     41.049      2.167       489787 
    L17HB3-CB-HB2      1.410     41.053      2.164      1714096 
    L17HD2-CB-HB3      0.891     41.055      1.410      1466586 
    L17HB2-CB-HB3      2.163     41.059      1.405      1697151 
     L17HA-CB-HB3      4.225     41.060      1.406       538266 
   D18H-L17CB-HB3      8.489     41.068      1.409       266946 
            ?-?-?      4.252     41.101      1.538       445503 
   A59HB-V56CA-HA      1.367     41.116      3.915      2350274 
    V57H-V56CA-HA      7.165     41.119      3.913       505361 
     L17HG-CB-HB3      2.014     41.119      1.403      1198479 
     V56HG1-CA-HA      0.977     41.122      3.917      2687032 
V56H/R60H-CA/V56CA-HA/V56HA      7.600     41.123      3.915      1819359 
      V56HB-CA-HA      2.294     41.128      3.915      2102343 
     V56HG2-CA-HA      1.117     41.128      3.915      2370914 
I87HG2/I87HD1-CB/I87CB-HB/I87HB      0.762     41.179      1.553      4816877 
      I87HA-CB-HB      4.416     41.183      1.557      1626157 
    L88H-I87CB-HB      8.402     41.186      1.555      1125424 
            ?-?-?      4.748     41.198      2.023       435194 
    I87HG12-CB-HB      1.013     41.203      1.549      2049024 
            ?-?-?      8.311     41.213      2.025       404514 
       I87H-CB-HB      8.170     41.227      1.556      1015785 
      D6HA-CB-HB3      4.525     41.340      2.621      1596256 
       D6H-CB-HB3      8.204     41.342      2.621      1242460 
      D6HA-CB-HB2      4.524     41.346      2.728      1491699 
     K7H-D6CB-HB2      8.297     41.359      2.728       511638 
K80HB3-I87CG2-HG2      2.068     41.359      0.771       869971 
       D6H-CB-HB2      8.206     41.359      2.728      1279378 
     K7H-D6CB-HB3      8.300     41.366      2.622       438417 
    I87HB-CG2-HG2      1.560     41.376      0.774      6132176 
L88H/V81H-I87CG2/I87CG2-HG2/I87HG2      8.399     41.382      0.773      1398214 
    I87HA-CG2-HG2      4.416     41.386      0.774      2249320 
     I87H-CG2-HG2      8.172     41.388      0.774      2024230 
 K80QE-I87CG2-HG2      3.029     41.389      0.773       423641 
 V81HA-I87CG2-HG2      3.574     41.394      0.774       538533 
 K43QE-I87CG2-HG2      3.092     41.396      0.775       311024 
I87HG2/I87HD1-CG2/I87CG2-HG2/I87HG2      0.773     41.396      0.774    168977248 
  I87HG13-CG2-HG2      1.318     41.399      0.772      1904556 
  T71HG2-P68CA-HA      1.289     41.409      4.516       512052 
K80HB2/K80QD-I87CG2/I87CG2-HG2/I87HG2      1.767     41.413      0.776      2194668 
K80HG2-I87CG2-HG2      1.680     41.417      0.778      2427223 
   T71HB-P68CA-HA      4.243     41.418      4.515      1553161 
    K72H-P68CA-HA      8.012     41.421      4.514       377601 
            ?-?-?      5.635     41.422      4.515      1206731 
D6HB2/K15HE2-CB/K15CE-HB3/K15HE3      2.727     41.425      2.622     32400466 
     P68HB3-CA-HA      2.045     41.426      4.514      1691728 
     P68HB2-CA-HA      2.453     41.428      4.514      2992745 
      P68QG-CA-HA      2.132     41.428      4.515      1206990 
 R86HA-I87CG2-HG2      4.260     41.430      0.775       721285 
    T71H-P68CA-HA      8.677     41.434      4.513       501618 
    E69H-P68CA-HA      8.535     41.457      4.514       343935 
   F95QE-M99CE-HE      6.831     41.458      1.725       714642 
      M99HE-CE-HE      1.725     41.459      1.725    180848944 
  Y98HB2-M99CE-HE      3.096     41.461      1.723      1548481 
   F95QD-M99CE-HE      7.190     41.461      1.725      1193433 
  T37HG2-M99CE-HE      1.177     41.462      1.724      4011582 
M99HA/T37HA-CE/M99CE-HE/M99HE      3.671     41.463      1.725      1084687 
       M99H-CE-HE      7.313     41.463      1.724      1488976 
      I41HB-CA-HA      1.907     41.583      3.059       484809 
    I41HG13-CA-HA      0.725     41.603      3.058       490209 
I41HG12/V74HB-CA/V74CA-HA/V74HA      1.646     41.606      3.058       811722 
I41H/L42H-CA/I41CA-HA/I41HA      7.991     41.611      3.058       704599 
   F95QE-I41CA-HA      6.849     41.621      3.053       288044 
I41HG2/V74HG1/I41HD1-CA/V74CA/I41CA-HA/V74HA/I41HA      0.956     41.644      3.054      3058741 
W77HB3-V74CA/I41CA-HA/I41HA      3.497     41.662      3.058       742186 added.....close to diagonal
    W77H-V74CA-HA      7.868     41.662      3.051       579831 
W77HZ3/F95HZ-V74CA/I41CA-HA/I41HA      6.617     41.666      3.057       341700 
 E109H-L108CB-HB3      7.934     41.670      1.508       585147 
  W77HE3-V74CA-HA      7.129     41.678      3.054      1295698 
     V74HG2-CA-HA      0.147     41.687      3.052      1504670 
    K15HG2-CE-HE3      1.059     41.701      2.624       562648 
       V74H-CA-HA      7.571     41.705      3.053       689130 
     K15QD-CE-HE3      1.500     41.707      2.624      1807856 
 E109H-L108CB-HB2      7.935     41.709      1.816       528782 
    K15HG3-CE-HE3      0.821     41.713      2.625       950577 
    A75H-V74CA-HA      8.900     41.715      3.049       244587 
     K15HA-CE-HE2      3.924     41.716      2.717       400478 
     K15HA-CE-HE3      3.925     41.720      2.621       332933 
     K15QD-CE-HE2      1.497     41.722      2.717      1840017 
    L108HA-CB-HB2      4.105     41.724      1.815      1470567 
   A75HB-P54CA-HA      1.367     41.728      4.020       960029 
    K15HG2-CE-HE2      1.066     41.729      2.716       533247 
     L108H-CB-HB2      8.202     41.730      1.815      1623067 
   L108HB3-CB-HB2      1.507     41.731      1.814      6710957 
    K15HG3-CE-HE2      0.818     41.737      2.718       951598 
     L108H-CB-HB3      8.204     41.737      1.509      1185449 
L108HB2/L108HG-CB/L108CB-HB3/L108HB3      1.806     41.738      1.511      7620526 
  V57HG1-P54CA-HA      1.028     41.741      4.019       448885 
L108HD2/L108HD1-CB/L108CB-HB2/L108HB2      0.897     41.743      1.815      3007910 
     V81HG1-CA-HA      0.715     41.764      3.574      2082744 
L108HD2/L108HD1-CB/L108CB-HB3/L108HB3      0.894     41.764      1.514      3881138 
       V81H-CA-HA      8.371     41.766      3.572      1123612 
     V81HG2-CA-HA      0.998     41.770      3.573      2687790 
     I89H-CG2-HG2      8.463     41.776      0.707       614931 
   L103HD2-CB-HB2      0.983     41.776      2.330       375847 
   A78HB-P54CA-HA      1.527     41.779      4.017      1380094 
      V81HB-CA-HA      2.023     41.781      3.571       913817 
    V57H-P54CA-HA      7.164     41.781      4.014       569163 
N85H/S83H-V81CA/V81CA-HA/V81HA      7.814     41.782      3.573       427392 
  V57HG2-P54CA-HA      0.905     41.782      4.018      1300468 
N91HD22-I89CG2-HG2      8.104     41.782      0.706       419659 
     P54HB2-CA-HA      2.487     41.784      4.018      2579688 
   A75HA-P54CA-HA      3.848     41.784      4.019       598092 
  K90H-I89CG2-HG2      9.002     41.785      0.706       779608 
    L108HA-CB-HB3      4.111     41.786      1.507      2090031 
P92HD3-I89CG2-HG2      3.400     41.786      0.706      1102148 
   V57HB-P54CA-HA      2.357     41.787      4.018      1304441 
P92HB2-I89CG2-HG2      2.181     41.787      0.707      1366510 
    I89HA-CG2-HG2      4.078     41.790      0.707      3446500 
     P54HB3-CA-HA      2.016     41.791      4.018      1674600 
P92HD2-I89CG2-HG2      3.774     41.791      0.707      1289458 
    I89HB-CG2-HG2      1.678     41.792      0.707      4363354 
 P92HA-I89CG2-HG2      4.197     41.793      0.707      2790224 
P92HG2-I89CG2-HG2      2.002     41.793      0.706      1212341 
  N91H-I89CG2-HG2      7.864     41.797      0.706      1286333 
     P54HG3-CA-HA      1.916     41.800      4.017       332493 
 Y44QE-L103CB-HB2      6.879     41.802      2.335       278935 
 Y44QE-L103CB-HB3      6.884     41.813      1.503       370003 
    L103HA-CB-HB3      4.189     41.827      1.503      1000107 
    S96HB3-CB-HB2      3.971     41.837      4.251      3023937 
S96HA/S96HB2-CB/S96CB-HB3/S96HB3      4.244     41.837      3.971      3975282 
    L103HA-CB-HB2      4.183     41.838      2.330       321474 
L103HB2/L103HG-CB/L103CB-HB3/L103HB3      2.327     41.840      1.499      2237617 
   T97H-S96CB-HB3      8.691     41.842      3.972       508939 
  I89HG12-CG2-HG2      1.410     41.843      0.708      1666865 
   L103HB3-CB-HB2      1.497     41.847      2.335      1484860 
    E55H-P54CA-HA      8.764     41.850      4.021       365650 
   Y98H-S96CB-HB2      7.945     41.853      4.254       372671 
      S96H-CB-HB2      7.537     41.859      4.251       345838 
 K104H-L103CB-HB3      8.871     41.861      1.502       358641 
   T97H-S96CB-HB2      8.688     41.861      4.254       634732 
      S96H-CB-HB3      7.531     41.862      3.974       561582 
     L103H-CB-HB3      7.854     41.862      1.503       729665 
   L103HD1-CB-HB2      1.245     41.868      2.328       563728 
   Y98H-S96CB-HB3      7.945     41.872      3.973       252935 
     L103H-CB-HB2      7.839     41.876      2.332       468824 
 K104H-L103CB-HB2      8.867     41.877      2.334       228441 
    I13HB-CG2-HG2      1.818     41.895      0.940      3035354 
 V107H-L106CB-HB2      8.210     41.900      1.940       291066 
 V107H-L106CB-HB3      8.210     41.900      1.400       332126 
     L106H-CB-HB2      7.380     41.904      1.940       636011 
    I13HA-CG2-HG2      3.523     41.906      0.937      1906186 
  E14H-I13CG2-HG2      7.409     41.908      0.934       619116 
L42HB2-I41CG2-HG2      1.998     41.917      0.941      2177933 
 I20HG13-A38CB-HB      2.173     41.923      1.567       744739 
    L106HA-CB-HB2      4.247     41.925      1.932       628210 
     L106H-CB-HB3      7.383     41.927      1.411       543818 
I13H/Y44QD-CG2/I41CG2-HG2/I41HG2      7.183     41.927      0.946       605027 
  E79HG2-A82CB-HB      2.368     41.936      1.568       619272 
  W77HZ3-A38CB-HB      6.639     41.940      1.561      1232638 
   K39HA-A38CB-HB      3.534     41.940      1.559       507526 
   E79HA-A82CB-HB      3.990     41.940      1.587      3327745 
  V81HG1-A82CB-HB      0.713     41.940      1.579       875603 
   E35HA-A38CB-HB      3.714     41.941      1.558       797435 
  P51HB3-A82CB-HB      1.968     41.943      1.568      2452157 
  V74HG2-A38CB-HB      0.148     41.945      1.561       687749 
       A38H-CB-HB      9.120     41.947      1.563      1346941 
L106HB2/L106HG-CB/L106CB-HB3/L106HB3      1.950     41.950      1.428      2558361 
  W77HE3-A38CB-HB      7.138     41.957      1.565      1005010 
    L106HA-CB-HB3      4.256     41.961      1.409       945723 
    S83H-A82CB-HB      7.825     41.962      1.585      1788476 
      A82HA-CB-HB      4.068     41.963      1.586      7054776 
      A38HA-CB-HB      3.846     41.964      1.560      3026261 
       A82H-CB-HB      8.279     41.964      1.587      4493218 
  P51HB2-A82CB-HB      2.089     41.965      1.574      1363798 
      T97HB-CA-HA      4.037     41.965      3.571      1605030 
  P54HD3-A82CB-HB      3.544     41.966      1.589       873597 
A38HB/A82HB-CB/A82CB-HB/A82HB      1.582     41.967      1.582    120362104 
    K39H-A38CB-HB      8.101     41.975      1.563      1687488 
A38HA/E14HA-I41CG2/I13CG2-HG2/I13HG2      3.859     41.983      0.956       912823 
      K72QD-CE-QE      1.643     42.014      2.881      7833461 
  P54HB2-A75CB-HB      2.468     42.015      1.365      1821280 
I13HG2/I41HG2/I41HD1/L103HD2-CG2/I41CG2/I41CG2/I41CG2-HG2/I41HG2/I41HG2/I41HG2      0.955     42.015      0.961     86928224 
     K72HG2-CE-QE      1.505     42.016      2.883      2987144 
     K72HG3-CE-QE      1.314     42.021      2.883      2418146 
   L106HB3-CB-HB2      1.384     42.022      1.944      2965744 
       A75H-CB-HB      8.898     42.027      1.366      4335835 
     K72HB3-CE-QE      1.793     42.031      2.882      1950595 
  E55HG2-A59CB-HB      2.364     42.033      1.366      2479499 
    G76H-A75CB-HB      7.843     42.035      1.366      2443433 
  V58HG2-A75CB-HB      0.876     42.044      1.366      9018751 
      A75HA-CB-HB      3.857     42.047      1.367      6755521 
            ?-?-?      1.912     42.048      1.380      2619686 
 Q100HB3-T97CA-HA      1.546     42.049      3.573      1049644 
 A16HB-I41CG2-HG2      1.534     42.050      0.970      6565248 
    I41HB-CG2-HG2      1.905     42.052      0.970      3592846 
L42H/I41H-I41CG2/I41CG2-HG2/I41HG2      7.991     42.058      0.971      1717574 
 L42HA-I41CG2-HG2      3.999     42.063      0.972      1903752 
 Q100HB2-T97CA-HA      1.755     42.074      3.571       812251 
 F19QD-I41CG2-HG2      7.297     42.076      0.969       362219 
     T97HG2-CA-HA      1.149     42.088      3.573      1755631 
   Q100H-T97CA-HA      7.471     42.091      3.571       401359 
V58H/V58H-A75CB/A59CB-HB/A59HB      8.021     42.093      1.366      1917949 
       T97H-CA-HA      8.688     42.094      3.573       809907 
Q63HB3/E79HB3-A59CB/A75CB-HB/A75HB      2.168     42.099      1.365       829519 
  P54HG3-A75CB-HB      1.980     42.103      1.368      3047747 
 A38HB-I20CG2-HG2      1.553     42.115      0.826      1340701 
    R60H-A59CB-HB      7.582     42.127      1.368      4443282 added
    Y98H-T97CA-HA      7.949     42.133      3.575       316718 
K90QG/K5QG-CE/K5CE-QE/K5QE      1.362     42.134      2.949      5365622 
      A59HA-CB-HB      4.051     42.136      1.367      9746358 
       A59H-CB-HB      7.639     42.152      1.367      7994327 
K104HD2/K5HB2-CE/K5CE-QE/K5QE      1.765     42.162      2.956      5961676 
K5QD/K90QD-CE/K90CE-QE/K90QE      1.645     42.171      2.957     14566116 
    I20HA-CG2-HG2      4.000     42.184      0.826      1418982 
W66HZ2-I20CG2-HG2      7.306     42.185      0.828       319691 
     I20H-CG2-HG2      8.413     42.191      0.824       524789 
V74HG2-I20CG2-HG2      0.143     42.192      0.827      1386337 
    A59H-V58CA-HA      7.636     42.192      3.333       540654 
I20HD1/V74HG1-CG2/I20CG2-HG2/I20HG2      0.941     42.192      0.827     10870202 
    G61H-V58CA-HA      8.143     42.193      3.333       392592 
     L42HA-CB-HB2      4.016     42.195      1.984       614358 
     L42HA-CB-HB3      4.023     42.195      1.323      1657864 
    L42HB3-CB-HB2      1.326     42.195      1.980      1990475 
    L42HB2-CB-HB3      1.980     42.195      1.330      2322738 
    I20HB-CG2-HG2      2.089     42.196      0.828      2971181 
W66HH2-I20CG2-HG2      6.948     42.197      0.826      1011702 
  G21H-I20CG2-HG2      8.881     42.197      0.827       370689 
 F70HZ-I20CG2-HG2      6.688     42.198      0.828      1217181 
 F70QE-I20CG2-HG2      6.538     42.199      0.827      1303089 
G21HA2-I20CG2-HG2      4.222     42.204      0.825       492386 
  T71HG2-V58CA-HA      1.287     42.207      3.331      4257892 
V58HG2/V58HG1-CA/V58CA-HA/V58HA      0.859     42.210      3.331      4312891 
V58H/E62H-CA/V58CA-HA/V58HA      8.029     42.212      3.332      1394490 
      V58HB-CA-HA      1.877     42.222      3.331       998244 
L88HD1/L88HD2-CB/L88CB-QB/L88QB      0.797     42.232      1.470      4251766 
      L88HA-CB-QB      4.317     42.270      1.469      3097086 
L88H/I89H-CB/L88CB-QB/L88QB      8.409     42.277      1.470      3222977 
K80QD/K7HB2-CE/K7CE-QE/K7QE      1.745     42.283      3.020      3912601 
     V107HB-CA-HA      2.229     42.289      3.743       761814 
   K43H-L42CB-HB3      8.762     42.299      1.324       398104 
V107H/L108H-CA/V107CA-HA/V107HA      8.212     42.305      3.745      1243763 
  K39HA-L42CB-HB3      3.538     42.310      1.324       272610 
    V107HG2-CA-HA      0.931     42.317      3.744      3382277 
K7QD/K80HG2-CE/K80CE-QE/K80QE      1.658     42.328      3.024      6076339 
   K43H-L42CB-HB2      8.758     42.346      1.966       451652 
      L42H-CB-HB2      7.978     42.353      1.960       695951 
  K39HA-L42CB-HB2      3.542     42.377      1.962       380332 
K43HD2/K43HB2-CE/K43CE-QE/K43QE      1.732     42.473      3.087      3781525 
     K73HD3-CE-QE      1.652     42.478      3.026      4842178 
K73H/W77HZ2-CE/K73CE-QE/K73QE      7.379     42.478      3.036       444166 
K43HD3/K73HD2/K43QG-CE/K73CE/K43CE-QE/K73QE/K43QE      1.570     42.480      3.083      5227782 
  I89HD1-K43CE-QE      0.707     42.490      3.083       846116 
      K73QG-CE-QE      1.165     42.495      3.041      2218679 
            ?-?-?      0.896     42.510      3.037      1046506 
            ?-?-?      2.988     42.640      1.958      1784305 
            ?-?-?      8.419     42.690      1.961       461144 
   S32QB-M33CE-HE      3.999     42.705      1.958      2635653 
   A38HB-M33CE-HE      1.554     42.717      1.957      3263868 these are assigned in AS
   T37HA-M33CA-HE      3.662     42.718      1.958       577851 added
   D34HA-CA-M33HE      4.600     42.721      1.958       989102 these are assigned in AS
   T37HB-M33CE-HE      4.240     42.731      1.958      2331780 these are assigned in AS
   A38HA-M33CE-HE      3.848     42.732      1.958      1668227 these are assigned in AS
  T37HG2-M33CE-HE      1.166     42.733      1.958      5074696 these are assigned in AS
    T37H-M33CE-HE      8.093     42.733      1.959       657883 these are assigned in AS
      L48HA-CB-QB      4.201     42.734      1.640      1308472 
     L48HD1-CB-QB      0.469     42.737      1.640      1525762 
V50HG1/L45HD2-L48CB/L48CB-QB/L48QB      0.807     42.738      1.637       713224 
       L48H-CB-QB      7.604     42.738      1.641      1224383 
     L48HD2-CB-QB      0.675     42.739      1.639      1409738 
            ?-?-?      2.460     42.739      1.958      2038328 
    G49H-L48CB-QB      7.736     42.744      1.644       331364 
   L45HA-L48CB-QB      3.821     42.747      1.637       719437 
 V107HG2-L48CB-QB      0.922     42.752      1.636      1796738 
    A38H-M33CE-HE      9.119     42.754      1.958       846528 this is assigned to M33 He in AS
            ?-?-?      7.548     42.754      1.961       351488 
    V50H-L48CB-QB      8.091     42.757      1.640       330169 
    G61H-V57CA-HA      8.131     42.888      3.442       205084 
       V57H-CA-HA      7.166     42.897      3.442      1056111 
      V57HB-CA-HA      2.367     42.899      3.442       811243 
     V57HG1-CA-HA      1.024     42.903      3.442      2707401 
     V57HG2-CA-HA      0.903     42.903      3.442      4664426 
  L17HD1-V57CA-HA      0.791     42.904      3.441       993055 
    R60H-V57CA-HA      7.586     42.907      3.440       444150 
    V58H-V57CA-HA      8.031     42.918      3.443       407275 
  R60HB2-V57CA-HA      1.643     42.919      3.440       439712 
      A16HB-CB-HB      1.530     43.076      1.529     66988460 
      A16HA-CB-HB      4.004     43.082      1.529      4093639 
  I20HD1-A16CB-HB      0.881     43.082      1.528      8069156 
  I13HG2-A16CB-HB      0.972     43.083      1.530      9963376 
       A16H-CB-HB      8.049     43.083      1.531      3000671 
    L17H-A16CB-HB      8.235     43.084      1.529      2065854 
   I13HA-A16CB-HB      3.512     43.085      1.529      1976777 
    V74H-T71CA-HA      7.563     43.143      3.601       273310 
   F70QD-T71CA-HA      7.034     43.148      3.600       456292 
    E14H-A12CB-HB      7.405     43.152      1.319       459498 
    K72H-T71CA-HA      8.010     43.156      3.599       765434 
  W66HE3-T71CA-HA      8.057     43.156      3.599       955052 
  W66HZ3-T71CA-HA      6.879     43.160      3.600       400334 
     T71HG2-CA-HA      1.286     43.166      3.602      1985678 
       T71H-CA-HA      8.680     43.171      3.603       747544 
            ?-?-?      1.939     43.175      1.312      1600859 
   V74HB-T71CA-HA      1.683     43.182      3.603       587634 
      A12HA-CB-HB      3.961     43.195      1.312      3080016 
   T11HA-A12CB-HB      4.197     43.196      1.311       649915 
      A12HB-CB-HB      1.312     43.197      1.313     50802340 
  I13HD1-A12CB-HB      0.827     43.202      1.312      4690092 
       A12H-CB-HB      9.191     43.205      1.309      2308696 
            ?-?-?      8.217     43.206      1.312       555775 
I13HG2/V107HG2-A12CB/A12CB-HB/A12HB      0.944     43.208      1.313      4759850 
    I13H-A12CB-HB      7.185     43.223      1.309       746056 
            ?-?-?      0.778     43.476      3.166       561855 
     R86HG2-CD-QD      1.678     43.478      3.164      5503629 
    I87H-R86CD-QD      8.185     43.483      3.171       331281 
     R86HG3-CD-QD      1.503     43.484      3.164      4712320 
       R86H-CD-QD      8.495     43.494      3.163       376498 
      R86HE-CD-QD      7.179     43.503      3.166       406400 
     T37HG2-CA-HA      1.167     43.720      3.643     29815292 
    V52HB-CG2-HG2      2.155     43.756      0.968      2802866 
V52HG1/V52HG2-CG2/V52CG2-HG2/V52HG2      0.968     43.762      0.969    545626688 
      T37HB-CA-HA      4.238     43.842      3.655      1502081 
      T37HA-CB-HB      3.654     43.854      4.243      2458873 
       T37H-CA-HA      8.092     43.859      3.659       750305 
    A38H-T37CB-HB      9.120     43.888      4.244       346315 
   M33HE-T37CA-HA      1.958     43.894      3.654       438248 added
   M33HE-T37CB-HB      1.959     43.895      4.244       615153 assigned in AS
    A38H-T37CA-HA      9.111     43.911      3.651       276082 
     T37HG2-CB-HB      1.168     44.072      4.240       975354 
    K72H-T71CB-HB      8.014     44.119      4.244      1367454 
     T71HG2-CB-HB      1.286     44.140      4.244      1977174 
   P68HA-T71CB-HB      4.522     44.142      4.243      1181394 
            ?-?-?      5.635     44.143      4.244      1841102 
       T71H-CB-HB      8.680     44.158      4.246       872968 
  H31HD2-A27CB-HB      7.285     44.267      1.362      1253732 
    V29H-A27CB-HB      7.525     44.271      1.362      1882240 
      A27HA-CB-HB      4.277     44.274      1.362      5347468 
      A27HB-CB-HB      1.361     44.277      1.361    102021552 
            ?-?-?      4.642     44.279      1.361       904286 
            ?-?-?      6.894     44.281      1.360       613912 
    S28H-A27CB-HB      8.233     44.282      1.362      1931442 
       A27H-CB-HB      7.145     44.285      1.361      1902692 
            ?-?-?      7.645     44.326      1.360       436470 
       T97H-CB-HB      8.689     44.404      4.041      1820565 
      T97HA-CB-HB      3.577     44.407      4.041      1657085 
    Y98H-T97CB-HB      7.947     44.409      4.041      1430143 
     T97HG2-CB-HB      1.153     44.414      4.041      5098212 
    V52HB-CG1-HG1      2.156     44.565      0.972      3047524 
V52HG1/V52HG2-CG1/V52CG1-HG1/V52HG1      0.972     44.588      0.972    511656768 
     V29H-CG2-HG2      7.528     44.798      0.887      2577978 
 S28QB-V29CG2-HG2      3.879     44.802      0.886      1593028 
V2HG1/V29HG2-CG1/V29CG2-HG1/V29HG2      0.873     44.803      0.875    551005952 
   T25HG2-CG2-HG2      0.020     44.811      0.027      1614434 
    V29HB-CG2-HG2      1.995     44.816      0.894      8625670 
     V2HA-CG1-HG1      4.063     44.838      0.869      1640357 
     V2HB-CG1-HG1      1.909     44.838      0.865      2441310 
    V29HA-CG2-HG2      4.309     44.886      0.904      4060414 
    V29HB-CG2-HG2      2.000     44.894      0.902      8625670 
P30HD3-V29CG1-HG1      3.745     44.994      0.921      2281173 
G22H/M23H-CA/G22CA-HA2/G22HA2      7.563     45.029      4.390      1094098 
    G22HA3-CA-HA2      3.774     45.032      4.393      3093434 
    G22HA2-CA-HA3      4.392     45.035      3.776      4159352 
G22H/M23H-CA/G22CA-HA3/G22HA3      7.563     45.047      3.776      2002730 
E62HB3-V58CG1-HG1      2.007     45.085      0.825      1686833 
 E55HA-V58CG1-HG1      3.907     45.123      0.824       958132 
 A59HA-V58CG1-HG1      4.048     45.129      0.827      1202509 
   V58HG1-CG1-HG1      0.828     45.137      0.826    167022304 
    V58HB-CG1-HG1      1.882     45.144      0.825      6067298 
E62HG2-V58CG1-HG1      2.401     45.145      0.824      1587070 
     V58H-CG1-HG1      8.030     45.145      0.825      1765368 
  A59H-V58CG1-HG1      7.645     45.148      0.825      1417142 
    V58HA-CG1-HG1      3.335     45.150      0.825      3192264 
     V2HA-CG2-HG2      4.043     45.291      0.752      1438103 
V2HG2/V50HG2-CG2/V50CG2-HG2/V50HG2      0.748     45.306      0.752    408603840 
    G49HA2-CA-HA3      4.173     45.318      3.676      6135654 
   V50H-G49CA-HA2      8.091     45.324      4.175       645182 
    G49HA3-CA-HA2      3.677     45.328      4.173      5796502 
      G49H-CA-HA3      7.731     45.336      3.677      2170521 
   V50H-G49CA-HA3      8.086     45.349      3.675       627542 
      G49H-CA-HA2      7.732     45.364      4.173      1904498 
V2HB/V50HB-CG2/V50CG2-HG2/V50HG2      1.947     45.392      0.743      5750998 
    N3H-V2CG2-HG2      8.552     45.399      0.738      1195806 
     V50H-CG2-HG2      8.088     45.421      0.740      2193518 
    V50HA-CG2-HG2      4.364     45.422      0.739      2184585 
            ?-?-?      2.012     45.422      0.737      5049464 
            ?-?-?      8.845     45.433      0.738       580061 
            ?-?-?      2.285     45.449      0.733      1106466 
            ?-?-?      3.895     45.453      0.735      2615377 
            ?-?-?      2.244     45.456      0.738      1018302 
 T71HA-V74CG2-HG2      3.579     45.563      0.145       521728 
W77HZ3-V74CG2-HG2      6.645     45.566      0.146      1419674 
I20HG2-V74CG2-HG2      0.833     45.566      0.148      2401522 
K73H/W77HZ2-V74CG2/V74CG2-HG2/V74HG2      7.395     45.568      0.144       470190 
  A75H-V74CG2-HG2      8.902     45.568      0.145       587464 
    V74HA-CG2-HG2      3.052     45.569      0.147      2126376 
     V74H-CG2-HG2      7.569     45.569      0.147      3150298 
   V74HG2-CG2-HG2      0.146     45.570      0.147     57090900 
 A38HB-V74CG2-HG2      1.552     45.571      0.146      1349594 
W77HE3-V74CG2-HG2      7.120     45.571      0.146       913851 
    V74HB-CG2-HG2      1.684     45.574      0.146      3420363 
W66HZ3/W77HH2-V74CG2/V74CG2-HG2/V74HG2      6.866     45.576      0.147       566155 
   V74HG1-CG2-HG2      0.957     45.578      0.146      7208082 
 F70QE-V74CG2-HG2      6.543     45.579      0.147       881120 
     T11HG2-CB-HB      1.307     45.603      4.390      1265429 
      T11HA-CB-HB      4.190     45.608      4.389       966599 
    A12H-T11CB-HB      9.182     45.609      4.389       427566 
      G84H-CA-HA2      7.747     45.777      4.214      2015592 
   V56HG1-CG1-HG1      0.976     45.783      0.980    134072408 
  S53H-V56CG1-HG1      8.528     45.794      0.981       395351 
    G84HA3-CA-HA2      3.752     45.816      4.214      6892056 
      G84H-CA-HA3      7.748     45.816      3.752      2188983 
    G84HA2-CA-HA3      4.214     45.823      3.753      6858736 
    V56HA-CG1-HG1      3.910     45.832      0.978      3740860 
    V56HB-CG1-HG1      2.290     45.835      0.977      5552248 
     V56H-CG1-HG1      7.587     45.839      0.978      2435420 
  V57H-V56CG1-HG1      7.164     45.854      0.980       905314 
   V107HB-CG2-HG2      2.230     45.877      0.916      4968568 
    V107H-CG2-HG2      8.206     45.878      0.915      2069394 
E55HB3-V56CG1-HG1      2.017     45.884      0.977      1889606 
L48QB-V107CG2-HG2      1.639     45.886      0.916      2808050 
   V107HA-CG2-HG2      3.757     45.891      0.916      2475189 
L108HA-V107CG2-HG2      4.123     45.908      0.914      1062461 
 A78HA-L42CD2-HD2      4.122     46.060      0.837      1160844 
            ?-?-?      2.264     46.066      0.798      1061184 
    L42HA-CD2-HD2      3.991     46.074      0.837      3425893 
A38HB/A78HB-L42CD2/L42CD2-HD2/L42HD2      1.535     46.083      0.836      3301411 
     L42H-CD2-HD2      7.981     46.094      0.839       920547 
 V81HB-L42CD2-HD2      2.039     46.103      0.841      5296487 
            ?-?-?      1.693     46.140      0.797       856956 
    V50HA-CG1-HG1      4.373     46.141      0.793      2804502 
    V50HB-CG1-HG1      1.958     46.148      0.794      6185906 
    L106H-CD2-HD2      7.381     46.153      0.879       848248 
     V50H-CG1-HG1      8.088     46.153      0.794       930166 
P51HD3-V50CG1-HG1      3.580     46.177      0.790       791936 
     V56H-CG2-HG2      7.587     46.181      1.117      3923802 
    V56HA-CG2-HG2      3.911     46.181      1.117      3775834 
    V56HB-CG2-HG2      2.294     46.181      1.118      5553730 
  S53H-V56CG2-HG2      8.539     46.184      1.118      1192405 
E55HB3-V56CG2-HG2      2.017     46.188      1.119      1497769 
  V57H-V56CG2-HG2      7.165     46.191      1.118      1486449 
    T97HB-CG2-HG2      4.042     46.206      1.150      5346721 
     T97H-CG2-HG2      8.688     46.213      1.155      1269844 
  R60H-V57CG1-HG1      7.582     46.227      1.026       734330 
            ?-?-?      4.605     46.229      1.282      1071415 
  Y98H-T97CG2-HG2      7.962     46.232      1.158       664907 
    T97HA-CG2-HG2      3.580     46.242      1.154      2671039 
  K43H-V81CG1-HG1      8.756     46.256      0.710       392313 
 A82HA-V81CG1-HG1      4.071     46.257      0.709      1028277 
            ?-?-?      4.413     46.261      1.286       756142 
     V81H-CG1-HG1      8.366     46.267      0.709       915150 
  A82H-V81CG1-HG1      8.303     46.267      0.708       755734 
K43HB2-V81CG1-HG1      1.697     46.267      0.704       847457 
    V81HB-CG1-HG1      2.015     46.273      0.709      3992196 
    V81HA-CG1-HG1      3.571     46.276      0.710      2340510 
 K43HA-V81CG1-HG1      3.916     46.281      0.709      2437186 
  H46H-V81CG1-HG1      7.800     46.281      0.709       754020 
 H46QB-V81CG1-HG1      3.394     46.283      0.709      2759733 
 H46HA-V81CG1-HG1      3.737     46.283      0.708       532576 
 K43QG-V81CG1-HG1      1.572     46.289      0.706      1328256 
L17HA/L106HA-CD2/L106CD2-HD2/L106HD2      4.244     46.298      0.881      5911907 
H46HD2-V81CG1-HG1      7.167     46.305      0.709       623057 
     V57H-CG1-HG1      7.164     46.313      1.028      1080385 
L106HG/L106HB2-CD2/L106CD2-HD2/L106HD2      1.978     46.315      0.882      7880433 
    V57HB-CG1-HG1      2.371     46.316      1.029      3501850 
 Y98QD-T97CG2-HG2      7.000     46.316      1.151      -182403 
W66HZ3-V57CG1-HG1      6.868     46.320      1.030      1918558 
W66HH2-V57CG1-HG1      6.966     46.321      1.029       641038 
 A75HA-V57CG1-HG1      3.846     46.322      1.029      1607066 
    T37HB-CG2-HG2      4.248     46.323      1.165      2691818 
    V57HA-CG1-HG1      3.442     46.325      1.029      2551834 
  A75H-V57CG1-HG1      8.898     46.327      1.029      1347391 
V58H/W66HE3-V57CG1/V57CG1-HG1/V57HG1      8.036     46.327      1.029      1277706 
V74HB/R60HB2-V57CG1/V57CG1-HG1/V57HG1      1.680     46.332      1.029      2214364 
 T71HA-V57CG1-HG1      3.588     46.339      1.028       881226 
 M33HE-T37CG2-HG2      1.958     46.342      1.167      3565828 assigned in AS
V74HG2-V57CG1-HG1      0.140     46.344      1.028       928701 
    T37HA-CG2-HG2      3.656     46.364      1.167      1517765 
 A78HB-V57CG1-HG1      1.540     46.368      1.024      1162969 
W66HH2-V57CG2-HG2      6.953     46.445      0.890      1147866 
    V57HA-CG2-HG2      3.440     46.530      0.902      4491866 
K104HA-L48CD2-HD2      3.848     46.539      0.668      1058890 
     V57H-CG2-HG2      7.165     46.542      0.908      4049582 
    V57HB-CG2-HG2      2.368     46.545      0.907      4706398 
    L17HG-CD2-HD2      1.978     46.550      0.887      6476059 
    L48HG-CD2-HD2      1.348     46.567      0.667      5082029 
   L48HD1-CD2-HD2      0.450     46.567      0.666      8019858 
    L48QB-CD2-HD2      1.649     46.570      0.667      3793146 
    L48HA-CD2-HD2      4.201     46.571      0.667      6029711 
     L48H-CD2-HD2      7.609     46.575      0.668       904540 
D47HB2-L48CD2-HD2      2.948     46.582      0.666       603034 
 Y44QE-L48CD2-HD2      6.875     46.588      0.666       639222 
 A75HB-V58CG2-HG2      1.370     46.609      0.884      8818320 
 E55HA-V58CG2-HG2      3.890     46.623      0.888      3048224 
      G65H-CA-HA2      7.604     46.632      3.911      1812318 
      G65H-CA-HA3      7.603     46.637      4.021      1889358 
    V58HB-CG2-HG2      1.884     46.641      0.882      7868105 
   W66H-G65CA-HA2      8.273     46.643      3.913       409429 
    G65HA3-CA-HA2      4.023     46.648      3.909      5114744 
  A59H-V58CG2-HG2      7.631     46.649      0.885      1640832 
     V58H-CG2-HG2      8.031     46.651      0.884      6383576 
    V58HA-CG2-HG2      3.332     46.656      0.883      4694660 
   W66H-G65CA-HA3      8.274     46.657      4.023       366547 
  A75H-V74CG1-HG1      8.848     46.659      0.967      1858163 
    G65HA2-CA-HA3      3.906     46.660      4.022      5157742 
            ?-?-?      8.157     46.697      0.882       970046 
 P10HA-T11CG2-HG2      4.527     46.778      1.307       652612 
    T11HA-CG2-HG2      4.190     46.804      1.307      1901265 
    T11HB-CG2-HG2      4.391     46.804      1.307      2703046 
   T11HG2-CG2-HG2      1.307     46.805      1.307     92149608 
     T11H-CG2-HG2      8.509     46.818      1.308      1014880 
 W66HE1-G21CA-HA2     10.667     46.823      4.183       148360 added....should be stronger!
  A12H-T11CG2-HG2      9.200     46.839      1.307       415562 
 W66HE1-G21CA-HA3     10.664     46.844      3.741       160235 added....should be stronger!
     V74H-CG1-HG1      7.572     46.891      0.956       813297 
    G21HA2-CA-HA3      4.187     46.911      3.727       921277 
    G21HA3-CA-HA2      3.728     46.912      4.188      1130463 
 W66HZ2-G21CA-HA3      7.295     46.912      3.718       235050 
      G21H-CA-HA3      8.878     46.916      3.725       419184 
V74HG1/V107HG1-CG1/V107CG1-HG1/V107HG1      0.966     46.916      0.964    170684096 
   V74HG2-CG1-HG1      0.147     46.917      0.958      6340006 
      G21H-CA-HA2      8.877     46.919      4.190       646692 
    V74HA-CG1-HG1      3.052     46.921      0.958      2401426 
L42HD2/I20HG2-V74CG1/V74CG1-HG1/V74HG1      0.848     46.921      0.965     23908328 
 W66HZ2-G21CA-HA2      7.296     46.923      4.189       307746 
    V74HB-CG1-HG1      1.680     46.924      0.961      5361570 
 E79HB2-G76CA-HA2      2.378     46.990      3.896       525322 
  L108HB3-CD2-HD2      1.494     46.996      0.867      3771942 
G76H/W77H-CA/G76CA-HA3/G76HA3      7.848     46.998      3.849      2147204 
G76H/W77H-CA/G76CA-HA2/G76HA2      7.849     47.002      3.894      2213963 
 E79HB2-G76CA-HA3      2.376     47.006      3.848       550615 
   E79H-G76CA-HA2      8.649     47.021      3.908       284254 
   E79H-G76CA-HA3      8.630     47.023      3.841       270874 
   L108HG-CD2-HD2      1.770     47.035      0.865      6903031 
   L108HA-CD2-HD2      4.114     47.049      0.865      6115890 
    L108H-CD2-HD2      8.201     47.053      0.866      1450816 
    G40HA3-CA-HA2      3.479     47.106      3.398      2847606 
F19QE-L103CD2-HD2      7.373     47.120      0.984      1073036 
      G40H-CA-HA2      7.890     47.122      3.393       863069 
      G40H-CA-HA3      7.887     47.126      3.495       994636 
L103HG/L103HB2-CD2/L103CD2-HD2/L103HD2      2.296     47.131      0.983      3175058 
A16HA-L103CD2-HD2      3.979     47.131      0.985      2272553 
   L103HA-CD2-HD2      4.182     47.139      0.986      3763138 
    G40HA2-CA-HA3      3.403     47.143      3.492      2745732 
 I89HD1-G40CA-HA3      0.677     47.144      3.491       693569 
 I89HD1-G40CA-HA2      0.680     47.145      3.404       525524 
  K80H-V81CG2-HG2      8.053     47.147      0.986      1230774 
L103HB3/K43QG-CD2/V81CG2-HD2/V81HG2      1.525     47.147      0.985      5829817 
    L103H-CD2-HD2      7.840     47.167      0.987      1037107 
L42HB3-V81CG2-HG2      1.302     47.174      0.983      5047223 
I41H/E62H/E64H-G40CA/G61CA/G61CA-HA2/G61HA2/G61HA2      8.012     47.234      3.394      1117867 
 W66HB3-G61CA-HA2      3.130     47.267      3.395       424492 false positive
   V107HB-CG1-HG1      2.235     47.269      0.951      4319264 
 E64HB3-G61CA-HA3      1.287     47.284      2.184       657133 
 W66HB2-G61CA-HA3      3.288     47.284      2.180       663256 false positive
 W66HB2-G61CA-HA2      3.281     47.284      3.395       565921 false positive
      G61H-CA-HA2      8.134     47.294      3.394      1476900 
    G61HA3-CA-HA2      2.181     47.294      3.394      2632094 
    G61HA2-CA-HA3      3.394     47.297      2.181      2568156 
    G61HA3-CA-HA3      2.177     47.298      2.176      3183662 
 W66HB3-G61CA-HA3      3.143     47.300      2.180       356840 false positive
 E64HB3-G61CA-HA2      1.287     47.303      3.395       786324 
      G61H-CA-HA3      8.137     47.305      2.182      1145170 
E62H/E64H-G61CA/G61CA-HA3/G61HA3      8.026     47.305      2.182       746328 
    V81HB-CG2-HG2      2.009     47.335      0.994      5134030 
  K43H-V81CG2-HG2      8.744     47.346      0.996       540488 
    V81HA-CG2-HG2      3.570     47.353      0.994      3905549 
   V107HA-CG1-HG1      3.769     47.355      0.950      2897560 
     V81H-CG2-HG2      8.371     47.366      0.994      3267894 
    V107H-CG1-HG1      8.211     47.374      0.951      3233935 
     K15QD-CG-HG2      1.523     47.518      1.057      1182147 
    K15HB2-CG-HG2      1.701     47.536      1.061       761012 
     K15HA-CG-HG3      3.947     47.652      0.833       936799 
            ?-?-?      2.113     47.654      0.831       301897 
L45HB3/K15HB2-CD2/K15CG-HD2/K15HG3      1.671     47.658      0.833      2341524 
     K15QD-CG-HG3      1.526     47.662      0.832      3655620 
   L45HB2-CD2-HD2      2.253     47.674      0.834      2163459 
L45H/A16H-CD2/K15CG-HD2/K15HG3      8.078     47.680      0.833      1285622 
    L45HG-CD2-HD2      1.924     47.687      0.834      4653224 
    L45HA-CD2-HD2      3.816     47.689      0.834      4550302 
 Y44QD-L45CD2-HD2      7.194     47.691      0.834       786712 
            ?-?-?      1.326     47.692      0.834      3426556 
 Y44QE-L45CD2-HD2      6.888     47.713      0.834       309278 
    L88QB-CD2-HD2      1.474     48.262      0.773      4472816 
    L88HA-CD2-HD2      4.323     48.271      0.776      1810588 
    L88HG-CD2-HD2      1.384     48.281      0.773      4157082 
  I89H-L88CD2-HD2      8.448     48.293      0.776       632039 
L88HD1/L88HD2-CD1/L88CD1-HD1/L88HD1      0.816     48.333      0.815    357452960 
    L88HA-CD1-HD1      4.316     48.338      0.815      2307972 
  I89H-L88CD1-HD1      8.450     48.341      0.817      1481361 
    L88QB-CD1-HD1      1.437     48.356      0.814      3907366 
        K5H-CG-QG      8.247     48.765      1.321       882683 
       K5QD-CG-QG      1.642     48.765      1.322      8017604 
      K5HB2-CG-QG      1.759     48.765      1.322      3601127 
      K5HB3-CG-QG      1.719     48.765      1.322      3663529 
       K7HA-CG-QG      4.315     48.768      1.428      1130490 
        K7H-CG-QG      8.299     48.788      1.424       730663 
            ?-?-?      1.657     48.806      1.412      9009521 
      K7HB3-CG-QG      1.888     48.822      1.425      2262334 
K7QG/K104QG-CG/K104CG-QG/K104QG      1.425     48.827      1.431    109034288 
K7QE/K104QE-CG/K104CG-QG/K104QG      2.959     48.937      1.444      1912957 
L108HD1-K104CG-QG      0.901     48.955      1.450      2207616 
      K104H-CG-QG      8.871     48.974      1.445       437364 
 L48HD1-K104CG-QG      0.461     48.999      1.447       741557 
    K104HB3-CG-QG      2.447     48.999      1.447      1672892 
 L48HD2-K104CG-QG      0.674     49.000      1.449      1303161 
            ?-?-?      3.091     49.003      1.456      1092625 
    K104HB2-CG-QG      1.969     49.011      1.449      3130686 
     K104HA-CG-QG      3.845     49.012      1.447      2134012 
     K43HB3-CG-QG      1.991     49.042      1.518      1307343 
    T71HB-CG2-HG2      4.240     49.060      1.289      3322413 
     T71H-CG2-HG2      8.678     49.068      1.289       628470 
 V58HA-T71CG2-HG2      3.337     49.075      1.288      5634524 
            ?-?-?      5.635     49.079      1.288      2135190 
  G61H-T71CG2-HG2      8.118     49.083      1.289      1074319 
    T71HA-CG2-HG2      3.602     49.083      1.288      2478460 
      K43QE-CG-QG      3.082     49.084      1.532      1101933 
V57HG1-T71CG2-HG2      1.044     49.085      1.288      3176144 
K72H/W66HE3-T71CG2/T71CG2-HG2/T71HG2      8.023     49.087      1.290      2355877 
V58HG2-T71CG2-HG2      0.877     49.138      1.291      5434977 
     K73HB2-CG-QG      0.779     49.142      1.166      1640267 
  V81HG1-K43CG-QG      0.725     49.151      1.532       755381 
     K43HB3-CG-QG      2.010     49.160      1.522      1091722 
            ?-?-?      3.750     49.194      1.163       644769 
     K73HD3-CG-QG      1.635     49.218      1.161      1670687 
      K73HA-CG-QG      3.548     49.219      1.167      1326844 
K72QD/K90QB/K90QD-CG/K90CG/K90CG-HG3/K90QG/K90QG      1.633     49.227      1.325     15697842 
     K73HB3-CG-QG      1.510     49.237      1.161      2518214 
      K73QE-CG-QG      3.032     49.237      1.166      1409459 
   F70HA-K73CG-QG      3.783     49.237      1.164       561126 
       K73H-CG-QG      7.389     49.240      1.164      1249455 
     K72HA-CG-HG3      3.741     49.241      1.313      1435092 
    K72HB3-CG-HG3      1.766     49.247      1.318      3235386 
      K90QE-CG-QG      2.927     49.251      1.326      1987440 
      K72H-CG-HG2      8.003     49.271      1.505       973315 
     K72HA-CG-HG2      3.743     49.272      1.508      1151346 
      K90HA-CG-QG      3.950     49.273      1.338      1508691 
     K72QE-CG-HG2      2.884     49.285      1.508      1326078 
     K72QE-CG-HG3      2.882     49.285      1.321      1167389 
      K72H-CG-HG3      8.008     49.285      1.319       968624 
       K90H-CG-QG      9.002     49.295      1.340       611413 
E109H-L108CD1-HD1      7.952     49.389      0.902       396473 
  L108HB3-CD1-HD1      1.501     49.418      0.904      4371362 
L108HG/L108HB2-CD1/L108CD1-HD1/L108HD1      1.790     49.422      0.905      4833108 
    L108H-CD1-HD1      8.209     49.425      0.904       698142 
L108HD2/L108HD1-CD1/L108CD1-HD1/L108HD1      0.903     49.427      0.904    208799680 
K104QE-L108CD1-HD1      2.951     49.442      0.905      1214352 
   L108HA-CD1-HD1      4.085     49.451      0.905      1619122 
    K80HB3-CG-HG3      2.103     49.506      1.539      1345167 
      K80H-CG-HG3      8.094     49.511      1.538       922005 
     K80HA-CG-HG3      4.057     49.515      1.540      1219161 
     K80QE-CG-HG2      3.023     49.517      1.661      1422098 
     K80HA-CG-HG2      4.056     49.525      1.662       972364 
      K80H-CG-HG2      8.094     49.527      1.661      1022177 
    K80HB3-CG-HG2      2.102     49.532      1.661      1596221 
     L48H-CD1-HD1      7.607     49.714      0.469       401563 
V107HB-L48CD1-HD1      2.232     49.717      0.468       771981 
L45HA/K104HA-L48CD1/L48CD1-HD1/L48HD1      3.829     49.719      0.467      1992124 
    L48QB-CD1-HD1      1.641     49.720      0.467      2967890 
    L48HA-CD1-HD1      4.201     49.722      0.467       541283 
K104QG-L48CD1-HD1      1.454     49.722      0.467      1122782 
 L45HG-L48CD1-HD1      1.949     49.723      0.467       498012 
   L48HD1-CD1-HD1      0.466     49.723      0.467     86188752 
    L48HG-CD1-HD1      1.348     49.727      0.466      1839500 
 Y44QD-L48CD1-HD1      7.185     49.729      0.469       450421 
 Y44QE-L48CD1-HD1      6.883     49.730      0.467      1085891 
K104HB3-L48CD1-HD1      2.436     49.741      0.467       278443 
 V50HG1-P51CD-HD2      0.767     49.861      3.250       372936 
 V50HG1-P51CD-HD3      0.774     49.881      3.580       551797 
V50HA/P51HA-P51CD/P51CD-HD2/P51HD2      4.371     49.902      3.250      1839336 
P51HB3/P51HG3-CD/P51CD-HD2/P51HD2      1.957     49.904      3.250      1815881 
P51HB2/P51HG2-CD/P51CD-HD2/P51HD2      2.060     49.910      3.249      1615041 
    P51HD3-CD-HD2      3.580     49.913      3.250      5331851 
    P51HD2-CD-HD3      3.251     49.917      3.580      6000057 
V50HA/P51HA-P51CD/P51CD-HD3/P51HD3      4.372     49.923      3.580      2892812 
   V50H-P51CD-HD2      8.085     49.927      3.253       431448 
P51HB2/P51HG2-CD/P51CD-HD3/P51HD3      2.058     49.935      3.580      2036983 
P51HB3/P51HG3-CD/P51CD-HD3/P51HD3      1.956     49.959      3.579      2320793 
   V50H-P51CD-HD3      8.080     49.960      3.577       373912 
A38HB/A78HB-L42CD1/L42CD1-HD1/L42HD1      1.541     50.072      0.885      2178645 
 A78HA-L42CD1-HD1      4.116     50.082      0.885      1350856 
 K39HA-L42CD1-HD1      3.544     50.097      0.885      1578662 
W77HB2-L42CD1-HD1      2.844     50.097      0.886       864691 
W77HB3-L42CD1-HD1      3.494     50.099      0.883      1471576 
  A78H-L42CD1-HD1      8.696     50.107      0.885       879450 
W77HE3-L42CD1-HD1      7.126     50.114      0.884       548120 
   L42HB3-CD1-HD1      1.315     50.125      0.885      1525246 
    L42HA-CD1-HD1      3.990     50.131      0.884       638111 
   L42HB2-CD1-HD1      1.974     50.148      0.884      1914959 
    L42HG-CD1-HD1      2.088     50.177      0.885      2926014 
     L42H-CD1-HD1      7.981     50.193      0.885       927772 
     L42HD1-CG-HG      0.876     50.372      2.095      3559313 
 V57HA-L17CD1-HD1      3.443     50.396      0.789       470275 
   E55H-P54CD-HD3      8.784     50.425      3.540       400910 
A78HB/A82HB-P54CD/P54CD-HD2/P54HD2      1.565     50.429      4.045       369089 
    P54HG2-CD-HD3      2.300     50.432      3.541      1219173 
   E55H-P54CD-HD2      8.783     50.437      4.052       625198 
    P54HG2-CD-HD2      2.301     50.439      4.049      1301550 
 S53HB2-P54CD-HD2      4.294     50.440      4.051      1049285 
P54HA/P54HD2/S53HB3-CD/P54CD/P54CD-HD3/P54HD3/P54HD3      4.043     50.445      3.540      5758450 
 S53HB2-P54CD-HD3      4.294     50.445      3.541      1079832 
  S53HA-P54CD-HD2      4.739     50.447      4.049      2429911 
    P54HD3-CD-HD2      3.540     50.447      4.048      4813984 
 E14HA-L17CD1-HD1      3.811     50.449      0.787       947189 
    P54HG3-CD-HD2      1.972     50.450      4.049      1203395 
    P54HB2-CD-HD2      2.488     50.454      4.052       398726 
A78HB/A82HB-P54CD/P54CD-HD3/P54HD3      1.564     50.457      3.542       634989 
 E79HB3-P54CD-HD3      2.179     50.469      3.548       343054 
    P54HB2-CD-HD3      2.481     50.470      3.538       450352 
  S53HA-P54CD-HD3      4.739     50.471      3.540      2721705 
     L42HB3-CG-HG      1.315     50.480      2.094       435359 
            ?-?-?      4.827     50.486      2.076       405933 
       L42H-CG-HG      7.981     50.495      2.096      1073112 
      L42HA-CG-HG      3.990     50.496      2.095       415544 
    P54HG3-CD-HD3      1.965     50.497      3.548      1852134 
   E93H-P92CD-HD2     10.041     50.511      3.751       214870 
            ?-?-?      8.455     50.511      2.077       272551 
            ?-?-?      4.821     50.516      2.211       378047 
            ?-?-?      2.913     50.522      2.208       438587 
     L17H-CD1-HD1      8.244     50.528      0.788       955825 
            ?-?-?      2.207     50.538      2.079      4137162 
   E93H-P92CD-HD3     10.029     50.543      3.404       161258 
            ?-?-?      2.078     50.548      2.208      3930613 
  N91HA-P92CD-HD3      5.082     50.552      3.400      1533291 
            ?-?-?      2.907     50.552      2.078       448490 
  N91HA-P92CD-HD2      5.080     50.553      3.749      2188794 
L17HD1/L106HD1-CD1/L106CD1-HD1/L106HD1      0.793     50.554      0.792     69082328 
    P92HD3-CD-HD2      3.402     50.555      3.749      4419099 
    P92HG3-CD-HD3      1.975     50.561      3.402      1771637 
    P92HB2-CD-HD3      2.181     50.564      3.400       590000 
 I89HG2-P92CD-HD2      0.712     50.564      3.750       315630 
   N91H-P92CD-HD2      7.848     50.566      3.742       187274 
 I89HG2-P92CD-HD3      0.699     50.571      3.397       453251 
   N91H-P92CD-HD3      7.838     50.572      3.400       265723 
    P92HD2-CD-HD3      3.749     50.573      3.401      4562162 
    P92HB2-CD-HD2      2.175     50.593      3.749       749997 
L17HB3/L106HB3-CD1/L106CD1-HD1/L106HD1      1.415     50.619      0.794      3075826 
P92HG3/V29HB-CD/P30CD-HD2/P30HD3      1.971     50.628      3.745      2778078 
L17HD1/L106HD1-CG/L106CG-HG/L106HG      0.796     50.646      1.985      8392744 
      L106H-CG-HG      7.383     50.652      1.981       914043 
L17HG/L106HG/L106HB2-CD1/L106CD1/L106CD1-HD1/L106HD1/L106HD1      1.978     50.659      0.795      8993484 
L17HD2/L106HD2-CG/L106CG-HG/L106HG      0.909     50.667      1.983      3228433 
       L17H-CG-HG      8.248     50.667      1.986       824096 
L17HB3/L106HB3-CG/L106CG-HG/L106HG      1.414     50.672      1.983      1114726 
   L17HB2-CD1-HD1      2.161     50.679      0.792      1991874 
R60HB3-L17CD1-HD1      1.709     50.711      0.798      1585962 
L17HA/L106HA-CD1/L106CD1-HD1/L106HD1      4.216     50.720      0.799      1326238 
 V29HG1-P30CD-HD3      0.910     50.722      3.728       962354 
  V29HA-P30CD-HD3      4.311     50.730      3.739      2190274 
  V29HA-P30CD-HD2      4.311     50.738      3.767      2172364 
   V29H-P30CD-HD2      7.523     50.760      3.764       172555 
L17HA/L106HA-CG/L106CG-HG/L106HG      4.230     50.780      1.983       930989 
            ?-?-?      1.159     50.788      3.762       327680 
    L106H-CD1-HD1      7.378     50.792      0.803      1132453 
            ?-?-?      8.025     50.798      0.800       546353 
      L48HA-CG-HG      4.203     50.801      1.344       964690 
       L48H-CG-HG      7.607     50.801      1.344      1156669 
     L48HD1-CG-HG      0.463     50.817      1.342       890509 
A12HA-L106CD1-HD1      3.961     50.824      0.802      1845022 not assigned by AS
            ?-?-?      1.161     50.832      3.731       280306 
P10QG/M9QB-CD/P10CD-HD2/P10HD2      1.964     50.850      3.593      2586858 
F95HZ-L103CD1-HD1      6.589     50.870      1.246       472473 
Y44QE-L103CD1-HD1      6.859     50.870      1.242       727526 
Y44QD-L103CD1-HD1      7.195     50.874      1.241       798553 
F19QE-L103CD1-HD1      7.362     50.894      1.243       552920 
    L45HA-CD1-HD1      3.821     50.908      0.883       596228 
 L42HA-L45CD1-HD1      3.989     50.911      0.883       951552 
 L88H-I87CG1-HG13      8.401     50.911      1.336       630687 
L103HG/L103HB2-CD1/L103CD1-HD1/L103HD1      2.307     50.914      1.243      3184491 
    L103H-CD1-HD1      7.840     50.920      1.243       764060 
   L45HB2-CD1-HD1      2.256     50.920      0.884      1808729 
    P10HD2-CD-HD3      3.588     50.925      3.905      3092600 
P10QG/M9QB-CD/P10CD-HD3/P10HD3      1.966     50.926      3.904      1814354 
    L45HG-CD1-HD1      1.926     50.926      0.882      2225902 
I87HD1/L48HD2-CG1/L48CG-HG13/L48HG      0.707     50.927      1.334      4011675 
    P10HD3-CD-HD2      3.904     50.929      3.590      3309214 
   L103HA-CD1-HD1      4.183     50.929      1.246       410383 
   L45HB3-CD1-HD1      1.680     50.934      0.882      2152530 
L103HB3/A16HB-L45CD1/L45CD1-HD1/L45HD1      1.530     50.934      0.884      5326304 
    I87H-CG1-HG12      8.172     50.934      1.037      1166974 
    I87H-CG1-HG13      8.171     50.943      1.332       862700 
   I87HB-CG1-HG12      1.560     50.945      1.037      1354896 
 I87HG12-CG1-HG13      1.033     50.945      1.330      9216509 
 I87HG13-CG1-HG12      1.332     50.946      1.037      8130923 
I87HD1/I87HG2-CG1/I87CG1-HG12/I87HG12      0.744     50.947      1.036      3448183 
   M9HA-P10CD-HD3      4.760     50.957      3.902      1817404 
   I87HA-CG1-HG13      4.411     50.963      1.333       764110 
R86HA-I87CG1-HG12      4.247     50.966      1.036       280472 
   I87HA-CG1-HG12      4.412     50.971      1.039       439647 
   M9HA-P10CD-HD2      4.760     50.973      3.593      1784289 
    L103HD1-CG-HG      1.241     50.988      2.299      2177724 
 L88H-I87CG1-HG12      8.402     50.989      1.037       394972 
     K39HA-CG-HG2      3.519     51.001      0.885      1135280 
K39H/L45H-CG/L45CD1-HG2/L45HD1      8.083     51.001      0.885       969039 
    L103HB3-CG-HG      1.499     51.042      2.295       427827 
    L103HD2-CG-HG      0.980     51.054      2.301      1003714 
  F19QE-L103CG-HG      7.377     51.058      2.302       337952 
      L103H-CG-HG      7.843     51.058      2.298       572978 
      L108H-CG-HG      8.203     51.064      1.765      2087915 
     L108HA-CG-HG      4.106     51.078      1.766      1040238 
L108HD2/L108HD1-CG/L108CG-HG/L108HG      0.874     51.080      1.766      3546328 
    P92HD3-CG-HG3      3.400     51.163      1.956      1471326 
    P92HD3-CG-HG2      3.398     51.166      1.995      1306727 
            ?-?-?      2.207     51.189      2.862       465299 
   I87H-R86CG-HG2      8.174     51.197      1.659       759516 
            ?-?-?      1.960     51.197      2.868       318692 
      R86H-CG-HG2      8.510     51.203      1.658       896806 
     P68HA-CD-HD2      4.510     51.214      3.845       361484 
 N67HB3-P68CD-HD3      2.894     51.215      4.055       295396 
            ?-?-?      2.069     51.217      2.936       533468 
   I87H-R86CG-HG3      8.172     51.218      1.503       664894 
     R86HA-CG-HG2      4.244     51.220      1.657      1303158 
     R86QD-CG-HG2      3.164     51.221      1.657      3353026 
     R86QD-CG-HG3      3.164     51.225      1.503      3815084 
 N67HB3-P68CD-HD2      2.890     51.227      3.841       345513 
            ?-?-?      2.069     51.230      2.867       559557 
     R86HA-CG-HG3      4.241     51.235      1.502      1175754 
    R86HG3-CG-HG2      1.506     51.235      1.655     15651587 
    K39HB2-CG-HG3      1.569     51.238      0.320       407939 
  N67HA-P68CD-HD2      4.805     51.241      3.848      2226446 
    P68HB2-CD-HD2      2.453     51.241      3.848       498815 
     P68HA-CD-HD3      4.523     51.241      4.049       318573 
    R86HG2-CG-HG3      1.660     51.241      1.503     17534260 
     K39QD-CG-HG3      1.062     51.244      0.318       678867 
    P68HD2-CD-HD3      3.847     51.248      4.049      4685488 
      R86H-CG-HG3      8.507     51.249      1.502       754115 
   E69H-P68CD-HD2      8.527     51.249      3.846       332318 
   E69H-P68CD-HD3      8.526     51.249      4.046       226472 
    K39HG2-CG-HG3      0.892     51.249      0.317       964004 
            ?-?-?      2.213     51.259      2.936       511830 
     P68QG-CD-HD2      2.146     51.260      3.847      2061987 
  N67HA-P68CD-HD3      4.808     51.262      4.049      2196188 
    P68HD3-CD-HD2      4.050     51.262      3.846      4825770 
    K39HG3-CG-HG2      0.318     51.262      0.888       781554 
     P68QG-CD-HD3      2.144     51.266      4.049      1846406 
    P92HD2-CG-HG2      3.753     51.273      2.002      1914884 
    P68HB2-CD-HD3      2.452     51.280      4.051       420044 
     K39HA-CG-HG2      3.538     51.283      0.889       557376 
    K39HB3-CG-HG3      1.321     51.283      0.324       401430 
     K39HA-CG-HG3      3.543     51.283      0.315       360891 
    K39HB3-CG-HG2      1.341     51.288      0.891      1068369 
P30HD3/P92HD2-CG/P92CG-QG/P92HG3      3.742     51.295      1.944      2670161 
      K39H-CG-HG3      8.095     51.317      0.315       255897 
      L88HA-CG-HG      4.317     51.338      1.380       730023 
L88H/I89H-CG/L88CG-HG/L88HG      8.417     51.353      1.380      1062274 
L88HD1/L88HD2-CG/L88CG-HG/L88HG      0.787     51.371      1.383      3583668 
            ?-?-?      6.869     51.430      1.894       311213 
            ?-?-?      7.026     51.441      1.898       335802 
            ?-?-?      6.871     51.458      1.841       263598 
     K15HE2-CD-QD      2.709     51.504      1.499       909866 
     K15HE3-CD-QD      2.638     51.542      1.497      1058643 
      K15HA-CD-QD      3.928     51.554      1.491      1371378 
     K15HG3-CD-QD      0.821     51.554      1.490      2046236 
     K15HG2-CD-QD      1.060     51.554      1.493      1166710 
P10HD2/P51HD3-CG/P51CG-QG/P51HG3      3.587     51.611      1.957      3626542 
     P51HA-CG-HG3      4.352     51.617      1.957       776607 
 H46HD2-P51CG-HG2      7.165     51.618      2.052       272889 
    P51HD2-CG-HG3      3.252     51.627      1.958      1397889 
 H46HD2-P51CG-HG3      7.170     51.631      1.958       411627 
            ?-?-?      3.021     51.636      1.488       488693 
    P51HD3-CG-HG2      3.583     51.641      2.051      1631181 
    P51HD2-CG-HG2      3.250     51.643      2.054      1212493 
     P10HD3-CG-QG      3.902     51.649      1.957      1812804 
     P51HA-CG-HG2      4.349     51.657      2.055       704734 
 W66HZ2-R60CG-HG2      7.307     51.665      1.481       356938 
    M9HA-P10CG-QG      4.755     51.707      1.958       497679 
     E93HA-CB-HB2      4.076     51.750      1.954      1818710 
    I89H-CG1-HG12      8.465     51.778      1.428       836397 
   I89HA-CG1-HG13      4.090     51.788      0.650       386267 
   I89HA-CG1-HG12      4.081     51.795      1.431       680068 
    R60HG2-CG-HG3      1.471     51.796      0.949      1418845 
      E93H-CB-HB3     10.038     51.797      1.823       315138 
I89HG13/I89HD1-CG1/I89CG1-HG12/I89HG12      0.664     51.799      1.429      5325412 
 I89HG12-CG1-HG13      1.432     51.801      0.650      2006105 
      E93H-CB-HB2     10.031     51.805      1.945       299839 
   I89HB-CG1-HG13      1.678     51.807      0.637       510806 
     E93HA-CB-HB3      4.101     51.808      1.830      1280185 
    E93HG2-CB-HB3      2.158     51.812      1.839      1940755 
 W66HZ2-R60CG-HG3      7.306     51.819      0.944       241792 
    R60HD2-CG-HG3      3.335     51.841      0.951       386861 
   A78H-W77CB-HB2      8.693     51.866      2.841       403769 
  V74HA-W77CB-HB3      3.059     51.882      3.489       336141 added
    R60HD3-CG-HG3      3.018     51.885      0.939       288000 
W77HD1/W77HE3-CB/W77CB-HB3/W77HB3      7.126     51.894      3.500       577510 
W77HD1/W77HE3-CB/W77CB-HB2/W77HB2      7.129     51.895      2.843       578329 
    R60HB2-CG-HG3      1.623     51.895      0.947       499441 
    W77HB3-CB-HB2      3.503     51.897      2.842      2141400 
    W77HB2-CB-HB3      2.844     51.899      3.498      1934411 
   A78H-W77CB-HB3      8.689     51.900      3.500       492688 
    R60HD3-CG-HG2      3.025     51.903      1.469       383759 
    R60HD2-CG-HG2      3.340     51.903      1.471       306876 
 L42HD1-W77CB-HB2      0.889     51.905      2.841       904337 
     W77HA-CB-HB3      4.637     51.906      3.501       473751 
    R60HB3-CG-HG3      1.749     51.906      0.942       549563 
      W77H-CB-HB3      7.870     51.907      3.495       605148 
 L42HD1-W77CB-HB3      0.887     51.912      3.498       694825 
     W77HA-CB-HB2      4.638     51.916      2.842       680695 
      P68HA-CG-QG      4.512     51.921      2.149      1018450 
      W77H-CB-HB2      7.872     51.925      2.845       551916 
   N67HA-P68CG-QG      4.808     51.927      2.143       560854 
     P68HD2-CG-QG      3.847     51.936      2.141      2239537 
P68HB2/E69HG3-CG/P68CG-QG/P68QG      2.450     51.939      2.141      2991197 
    E69H-P68CG-QG      8.531     51.941      2.138       632453 
     P68HD3-CG-QG      4.050     51.942      2.142      2340292 
  V74HA-W77CB-HB2      3.051     51.958      2.837       260546 added....close to diagonal
  A78HB-P54CG-HG3      1.536     52.027      1.953      1291919 
    R60HG3-CG-HG2      0.943     52.069      1.473      1093032 
    P54HG2-CG-HG3      2.300     52.084      1.958      6725000 
    P54HD3-CG-HG3      3.550     52.089      1.961      1847434 
    P54HB2-CG-HG3      2.479     52.099      1.958      1935548 
P54HA/P54HD2/E79HA-CG/P54CG/P54CG-HG3/P54HG3/P54HG3      4.028     52.100      1.958      2794005 
    P54HD3-CG-HG2      3.538     52.112      2.302      1277057 
    P54HG3-CG-HG2      1.969     52.116      2.301      6987888 
    P54HB2-CG-HG2      2.473     52.117      2.301      2296619 
P54HA/P54HD2/E79HA-CG/P54CG/P54CG-HG2/P54HG2/P54HG2      4.030     52.120      2.301      2736947 
   E55H-P54CG-HG2      8.782     52.130      2.300       978626 
  S53HA-P54CG-HG2      4.739     52.132      2.298       420887 
  S53HA-P54CG-HG3      4.736     52.132      1.961       400396 
   E79H-P54CG-HG3      8.634     52.135      1.957       637936 
  A78HB-P54CG-HG2      1.533     52.136      2.302       526135 
     L45HD2-CG-HG      0.845     52.145      1.912      2548386 
     L45HD1-CG-HG      0.901     52.145      1.912      1548215 
   E79H-P54CG-HG2      8.636     52.151      2.301       330507 
       L45H-CG-HG      8.083     52.183      1.914      1127969 
    V29H-A27CA-HA      7.529     52.224      4.278       668116 
    S28H-A27CA-HA      8.233     52.224      4.279      5125366 
      A27HB-CA-HA      1.363     52.231      4.279      4858483 
       A27H-CA-HA      7.147     52.241      4.277       517446 
 T97HA-Q100CB-HB2      3.574     52.248      1.758       643954 
   Q100HG2-CB-HB3      1.079     52.259      1.548       575836 
     Q100H-CB-HB3      7.474     52.277      1.547       659186 
 T97HA-Q100CB-HB3      3.573     52.277      1.548       566254 
   Q100HG3-CB-HB3      0.970     52.277      1.550       613185 
   Q100HG2-CB-HB2      1.071     52.283      1.754       780036 
 E101H-Q100CB-HB3      8.490     52.284      1.546       632253 
    Q100HA-CB-HB2      3.291     52.285      1.756       802883 
   Q100HB2-CB-HB3      1.755     52.292      1.554      3283217 
   Q100HB3-CB-HB2      1.548     52.293      1.753      3957737 
 E101H-Q100CB-HB2      8.488     52.297      1.754       653339 
    Q100HA-CB-HB3      3.289     52.301      1.550       507025 
     Q100H-CB-HB2      7.479     52.301      1.753       726997 
R60HG3/Q100HG3-CB/Q100CB-HB3/Q100HB2      0.948     52.305      1.752      1047068 
       N91H-CA-HA      7.851     52.309      5.080       715978 
  P92HD2-N91CA-HA      3.748     52.312      5.082      2508822 
  P92HD3-N91CA-HA      3.401     52.314      5.083      1686016 
    E93H-N91CA-HA     10.007     52.314      5.083       296087 
     N91HB2-CA-HA      2.322     52.317      5.086       687507 
    N91HD22-CA-HA      8.117     52.318      5.081       426280 
    R60HG3-CB-HB2      0.941     52.318      1.629       635759 
    N91HD21-CA-HA      6.821     52.322      5.083       328647 
     N91HB3-CA-HA      2.122     52.338      5.087       676747 
  P92HG3-N91CA-HA      1.994     52.343      5.083       598384 
     R60HA-CB-HB2      3.920     52.349      1.634       355624 
 L17HD1-R60CB-HB3      0.790     52.351      1.749       478962 
     R60HA-CB-HB3      3.926     52.468      1.751       457370 
    E55HG3-CB-HB2      2.244     52.701      1.923      3112160 
   K43HA-H46CB-QB      3.916     52.717      3.393       517493 
       H46H-CB-QB      7.801     52.725      3.391       970124 
  V81HG1-H46CB-QB      0.712     52.726      3.388      1099985 
   V56H-E55CB-HB2      7.587     52.733      1.919       756096 
    E55HG2-CB-HB2      2.391     52.733      1.923      2346437 
      H46HA-CB-QB      3.744     52.734      3.387       723256 
     E55HA-CB-HB2      3.899     52.735      1.923      2282008 
    D47H-H46CB-QB      9.005     52.735      3.392       519048 
      E55H-CB-HB2      8.781     52.741      1.923      1777580 
   V56H-E55CB-HB3      7.589     52.756      2.027       668011 
      E55H-CB-HB3      8.781     52.761      2.029      1737072 
     E55HA-CB-HB3      3.896     52.767      2.036      2068439 
    E55HG2-CB-HB3      2.393     52.767      2.032      2420916 
    E55HG3-CB-HB3      2.235     52.767      2.036      3515291 
    E55HB3-CB-HB2      2.028     52.791      1.925     10899176 
        N3H-CA-HA      8.569     52.798      4.675       875331 
     H46HD2-CB-QB      7.176     52.808      3.388       204998 
    E55HB2-CB-HB3      1.930     52.823      2.029     10843166 
      F4H-N3CA-HA      8.349     52.842      4.679      3262090 
      N3HB3-CA-HA      2.668     52.872      4.669      1516370 
      N3HB2-CA-HA      2.761     52.892      4.673      1129092 
   S36H-E35CB-HB2      8.101     52.900      1.965       380245 
   S36H-E35CB-HB3      8.110     52.900      2.060       524626 
     K73HA-CD-HD2      3.545     52.971      1.544      1002959 
     E35HA-CB-HB2      3.717     52.977      1.959       506752 
     E35HA-CB-HB3      3.720     52.977      2.068       495780 
  S32HA-E35CB-HB2      4.228     52.977      1.954       455713 
K73H/W77HZ2-CD/K73CD-HD2/K73HD2      7.375     53.004      1.543       508776 
K73H/W77HZ2-CD/K73CD-HD3/K73HD3      7.367     53.022      1.641       570586 
     K73QE-CD-HD2      3.051     53.079      1.554      2206247 
       K7HA-CD-QD      4.301     53.092      1.656       728158 
  F70HA-K73CD-HD3      3.772     53.094      1.633       617629 
     K73QE-CD-HD3      3.039     53.100      1.653      4262014 
       K7QE-CD-QD      3.002     53.166      1.657      5399620 
 N91HD22-K90CD-QD      8.102     53.178      1.654       478411 
       K80H-CD-QD      8.090     53.182      1.758       352457 
K90QE/K5QE-CD/K5CD-QD/K5QD      2.947     53.191      1.628      9837804 
   I89HA-K90CD-QD      4.069     53.193      1.652       960110 
      K80QE-CD-QD      3.035     53.193      1.752      2835472 
      K80HA-CD-QD      4.056     53.202      1.755       998693 
     N85HB2-CA-HA      2.508     53.205      4.632      1371032 
     N85HB3-CA-HA      2.671     53.215      4.634      2407348 
K43HA/K90HA-CD/K90CD-HD3/K90QD      3.949     53.224      1.614      1176437 
    N85HD21-CA-HA      7.509     53.230      4.629       454878 
    R86H-N85CA-HA      8.513     53.232      4.633      4871000 
       N85H-CA-HA      7.830     53.242      4.633      1256148 
      Q63H-CB-HB3      7.681     53.313      2.151      2654883 
     K43QE-CD-HD3      3.086     53.341      1.586      2450950 
Q63H/Q63H/Q102HE22-E62CB/Q63CB/Q102CB-HB2/Q63HB2/Q102HB3      7.681     53.356      2.048      3620099 
E62HA/Q63HA/E101HA-CB/Q63CB/E101CB-HB2/Q63HB2/E101QB      3.971     53.372      2.048      6284768 
     Q63HA-CB-HB3      3.967     53.403      2.149      3566305 
K43HA/E101HA-CD/K104CD-HD2/K104HD3      3.951     53.412      1.746       756837 
     K43QE-CD-HD2      3.090     53.412      1.743      2178490 
   E64H-Q63CB-HB3      7.990     53.418      2.147      2701460 
E62HG2/Q63HG2/E101HG2-CB/Q63CB/E101CB-HB2/Q63HB2/E101QB      2.378     53.423      2.068      7921308 
   P10HD2-M9CA-HA      3.588     53.431      4.753      1215727 
   Q63H-E62CB-HB3      7.680     53.436      1.956      1498104 
K15H/E62H/E64H-E14CB/E62CB/Q63CB-QB/E62HB2/Q63HB2      8.009     53.436      2.050      4855231 
     E62HA-CB-HB3      3.986     53.438      1.958      3090546 
    E62HG2-CB-HB3      2.396     53.444      1.963      2769866 
   P10HD3-M9CA-HA      3.909     53.445      4.752      1623186 
       M9QB-CA-HA      1.975     53.447      4.750      1298152 
       E14H-CB-QB      7.402     53.449      2.049      1648298 
      E14HA-CB-QB      3.832     53.459      2.047      1664544 
E14HG2/E62HG3/E69HB2/Q102HB2/Q102HG2-CB/E62CB/E69CB/Q102CB/Q102CB-QB/E62HB2/E69HB3/Q102HB3/Q102HB3      2.225     53.459      2.049     16523599 
      E62H-CB-HB3      8.008     53.464      1.957      2742755 
      E101H-CB-QB      8.506     53.464      2.045      2105728 
      K72QE-CD-QD      2.927     53.466      1.646      4672073 
       M9QG-CA-HA      2.512     53.470      4.750       480362 
        M9H-CA-HA      8.325     53.482      4.754       699123 
    K104QE-CD-HD2      2.964     53.502      1.763      2578414 
   K104HB3-CD-HD3      2.444     53.505      1.735      1090365 
    K104QE-CD-HD3      2.956     53.508      1.738      2354096 
   K104HB3-CD-HD2      2.442     53.513      1.761      1096778 
Q102H/Q102H/L103H-E101CB/Q102CB/Q102CB-QB/Q102HB3/Q102HB3      7.828     53.572      2.048      1727016 
E69HA/E109HA-CB/E109CB-HB3/E109QB      4.151     53.645      2.063      2546722 
  S28QB-E69CB-HB2      3.881     53.645      2.227       595613 
   F70H-E69CB-HB2      7.729     53.645      2.225       265618 false positive
    I13H-CG1-HG13      7.193     53.650      1.020       329412 
Q102HA/A59HA-CB/E62CB-HB3/E62HB2      4.056     53.654      2.064      3617735 
    Q102HA-CB-HB2      4.054     53.654      2.206      1352041 
      E69H-CB-HB3      8.525     53.660      2.061      1495224 
     E69HA-CB-HB2      4.150     53.660      2.228      1292659 
      E69H-CB-HB2      8.528     53.684      2.228       812474 
L106HA/S28HA-E109CB/E69CB-QB/E69HB3      4.224     53.684      2.050      1854313 
  S28HA-E69CB-HB2      4.230     53.684      2.226       816343 
    I13H-CG1-HG12      7.190     53.701      1.555       498221 
Q102H/L103H-CB/Q102CB-HB2/Q102HB2      7.828     53.716      2.212      1211810 
 I13HG13-CG1-HG12      1.017     53.724      1.563      4136301 
   I13HA-CG1-HG12      3.512     53.737      1.569       699916 
  I13HD1-CG1-HG12      0.851     53.738      1.566      3525307 
   I13HA-CG1-HG13      3.514     53.745      1.023       837714 
I13HG12/A38HB-CG1/I20CG1-HG13/I20HG12      1.566     53.747      1.025      4615664 
            ?-?-?      1.956     53.767      1.019       792456 
   I13HB-CG1-HG13      1.806     53.768      1.022       798582 
            ?-?-?      4.114     53.778      3.111       705420 
            ?-?-?      4.605     53.779      3.110      5407846 
            ?-?-?      4.609     53.779      3.151      5385286 
            ?-?-?      7.116     53.779      3.099       869959 
            ?-?-?      4.118     53.781      3.146       752899 
   K80H-E79CB-HB3      8.090     53.787      2.164       652486 
G76HA2/G76HA3-E79CB/E79CB-HB2/E79HB2      3.876     53.787      2.380       536928 
E79HB2/E79HG2-CB/E79CB-HB3/E79HB3      2.370     53.787      2.155      8550217 
   I20HA-CG1-HG13      3.998     53.787      2.155      2757227 
 G76HA3-E79CB-HB3      3.873     53.787      2.158       831188 
   K80H-E79CB-HB2      8.096     53.798      2.380       754583 
     E79HA-CB-HB2      3.992     53.798      2.380      1321587 
    E79HB3-CB-HB2      2.175     53.799      2.378      4311672 
I13HD1/I20HG2/I20HD1-CG1/I20CG1/I20CG1-HG13/I20HG12/I20HG12      0.868     53.803      1.025      5377960 
            ?-?-?      7.110     53.815      3.143       995296 
      E79H-CB-HB3      8.630     53.822      2.160      1193376 
      E79H-CB-HB2      8.630     53.825      2.379      1267026 
E79HB2/E79HG2-CB/E79CB-HB2/E79HB2      2.376     53.831      2.379      9104926 
            ?-?-?      8.250     53.850      3.158      1229107 
     E79HA-CB-HB3      4.001     53.856      2.162      2291650 
A38HA-I20CG1-HG12      3.871     53.858      1.022       279287 
  I20HD1-CG1-HG13      0.922     53.868      2.151      2544411 
   I20HB-CG1-HG12      2.107     53.872      1.014      1544745 
    I20H-CG1-HG13      8.408     53.872      2.150       713979 
    I20H-CG1-HG12      8.411     53.884      1.008       401858 
 I20HG12-CG1-HG13      0.996     53.885      2.153      2191543 
            ?-?-?      8.247     53.886      3.102      1356441 
   I20HA-CG1-HG12      3.999     53.889      1.015       583240 
 I20HG13-CG1-HG12      2.172     53.892      1.014      1554825 
            ?-?-?      8.240     54.002      3.224       800299 
            ?-?-?      4.507     54.030      3.229      2153997 
            ?-?-?      6.963     54.036      3.229       457105 
            ?-?-?      7.977     54.047      3.229      1333513 
     K39HE2-CD-QD      1.792     54.138      1.067       613165 
     K39HB3-CD-QD      1.325     54.177      1.077       713876 
     K39HG3-CD-QD      0.322     54.192      1.076       433719 
      R86QD-CB-QB      3.164     54.272      1.730      2395602 
    I87H-R86CB-QB      8.172     54.286      1.730      1311422 
       R86H-CB-QB      8.513     54.290      1.730      3554725 
      R86HA-CB-QB      4.242     54.291      1.730      3678514 
     R86HG3-CB-QB      1.505     54.307      1.729      5927696 
    W66HE3-CB-HB3      8.058     54.366      3.133       398778 
   I41HA-CG1-HG12      3.075     54.376      1.628       454937 
I41HG2/I41HD1-CG1/I41CG1-HG12/I41HG12      0.944     54.376      1.619      1727120 
  F70QD-W66CB-HB3      7.028     54.386      3.121       220587 added.....weak!
  F70QD-W66CB-HB2      7.025     54.386      3.283       169784 added.....weak!
 G61HA3-W66CB-HB3      2.187     54.386      3.139       277058 
   I41HA-CG1-HG13      3.076     54.392      0.723       505042 
 I41HG12-CG1-HG13      1.618     54.404      0.729       987495 
 I41HG13-CG1-HG12      0.728     54.411      1.620      1101159 
      D6HB3-CA-HA      2.619     54.422      4.525      2064741 
      D6HB2-CA-HA      2.732     54.425      4.525      2012026 
    I41H-CG1-HG13      7.993     54.432      0.725       510024 
     W66HA-CB-HB3      4.587     54.432      3.148       447524 
     W66HA-CB-HB2      4.572     54.432      3.283       926686 
 G61HA3-W66CB-HB2      2.178     54.432      3.293       199834 
            ?-?-?      5.634     54.438      3.125       446127 
      K7H-D6CA-HA      8.296     54.438      4.524      3958684 
   I41HB-CG1-HG13      1.907     54.451      0.725       317503 
            ?-?-?      5.633     54.469      3.291       301077 
   N67H-W66CB-HB2      8.797     54.480      3.275       393236 
        D6H-CA-HA      8.193     54.481      4.523      1297685 
       H31H-CB-QB      9.371     54.531      3.275       371851 
     H31HD2-CB-QB      7.309     54.553      3.274       316383 
      H31HA-CB-QB      4.566     54.579      3.275       968764 
    S32H-H31CB-QB      8.803     54.579      3.275       364350 
      V74HA-CB-HB      3.055     54.644      1.680       596522 
       L88H-CA-HA      8.388     54.668      4.320      2112840 
     V74HG1-CB-HB      0.966     54.681      1.683      3499790 
     V74HG2-CB-HB      0.146     54.690      1.685      2066106 
   T71HA-V74CB-HB      3.595     54.691      1.685       460009 
    I89H-L88CA-HA      8.460     54.693      4.318      5289100 
    A75H-V74CB-HB      8.899     54.693      1.680      1011297 
       V74H-CB-HB      7.569     54.694      1.684      1429518 
      L88QB-CA-HA      1.470     54.699      4.319      3668439 
L88HD1/L88HD2-CA/L88CA-HA/L88HA      0.793     54.711      4.319      2134247 
  H46HD2-A82CA-HA      7.167     54.757      4.072       968466 
       A82H-CA-HA      8.278     54.757      4.074      1280396 
K15H/A16H-CB/K15CB-HB3/K15HB3      8.023     54.762      1.578       682730 
      A82HB-CA-HA      1.587     54.770      4.073      4785381 
   I89HB-L88CA-HA      1.678     54.772      4.316       572167 
    S83H-A82CA-HA      7.807     54.777      4.072       551657 
    K15HG3-CB-HB2      0.828     54.810      1.695      1295686 
K15H/A16H-CB/K15CB-HB2/K15HB2      8.031     54.834      1.703       823802 
    E62H-A59CA-HA      8.016     54.851      4.055       784285 
      A59HB-CA-HA      1.367     54.852      4.056      7390972 
E62HB3/P51HB3-A59CA/A82CA-HA/A82HA      1.955     54.854      4.059      1091404 
  E62HG2-A59CA-HA      2.395     54.855      4.058       353780 
A59H/Q63H-CA/A59CA-HA/A59HA      7.647     54.856      4.056      2415757 
E62HB2/P51HB2-A59CA/A82CA-HA/A82HA      2.043     54.857      4.060      1452627 
    K15HG3-CB-HB3      0.822     54.865      1.576       831147 
K15HA/A12HA-CB/K15CB-HB3/K15HB3      3.936     54.869      1.569       556097 
  V81HG1-A82CA-HA      0.704     54.870      4.081       561967 
  E62HG3-A59CA-HA      2.182     54.892      4.058       357141 
K15HA/A12HA-CB/K15CB-HB2/K15HB2      3.937     54.897      1.698       660244 
  V58HG1-A59CA-HA      0.837     54.903      4.058      1016395 
    K15HG2-CB-HB3      1.059     54.904      1.576       473167 
    K15HG2-CB-HB2      1.063     54.904      1.697      1568316 
    S96H-F95CA-HA      7.537     54.974      5.054       624450 
      F95QD-CA-HA      7.175     55.022      5.054       566942 
      F95HA-CA-HA      5.046     55.062      5.050      1757786 
       W66H-CA-HA      8.263     55.067      4.555       431463 
  T37HG2-F95CA-HA      1.162     55.069      5.054       351820 
     F95HB2-CA-HA      3.340     55.081      5.060       367031 
      L48HG-CA-HA      1.346     55.103      4.203      1255536 
    N67H-W66CA-HA      8.803     55.109      4.550      1467291 
       A78H-CA-HA      8.689     55.161      4.118      1067177 
    V81H-A78CA-HA      8.343     55.161      4.111       440680 
   V81HB-A78CA-HA      2.020     55.161      4.114      1173756 
      L48QB-CA-HA      1.639     55.161      4.200      2797321 
      A78HB-CA-HA      1.537     55.161      4.115      3363679 
  L42HD2-A78CA-HA      0.844     55.161      4.116      1969520 
     W66HD1-CA-HA      6.938     55.161      4.552      1369937 
     W66HB2-CA-HA      3.291     55.161      4.550      1113472 
     W66HB3-CA-HA      3.131     55.161      4.551       743808 
     L48HD2-CA-HA      0.666     55.161      4.200      4091079 
     L48HD1-CA-HA      0.459     55.161      4.200       647725 
    G49H-L48CA-HA      7.731     55.161      4.199       635482 
       L48H-CA-HA      7.605     55.161      4.201      1295740 
  V81HG1-A78CA-HA      0.696     55.161      4.117       772511 
  V81HG2-A78CA-HA      0.977     55.161      4.116       871938 
  L42HD1-A78CA-HA      0.895     55.161      4.116      1972575 
;

   loop_
      _Spectral_dim.ID
      _Spectral_dim.Atom_type
      _Spectral_dim.Atom_isotope_number
      _Spectral_dim.Spectral_region
      _Spectral_dim.Magnetization_linkage_ID
      _Spectral_dim.Sweep_width
      _Spectral_dim.Sweep_width_units
      _Spectral_dim.Encoding_code
      _Spectral_dim.Encoded_reduced_dimension_ID
      _Spectral_dim.Entry_ID
      _Spectral_dim.Spectral_peak_list_ID

      1 H 1 'all H's'       .  8618.832 . . . 15089 1 
      2 C 1 'aliphatic C's' .  4522.840 . . . 15089 1 
      3 H 1 'aliphatic H's' . 13522.650 . . . 15089 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

      4 $SPARKY . . 15089 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                        15089
   _Spectral_peak_list.ID                              2
   _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.Experiment_ID                   4
   _Spectral_peak_list.Experiment_name                '3D 1H-13C NOESY'
   _Spectral_peak_list.Number_of_spectral_dimensions   3
   _Spectral_peak_list.Details                        
;
Aromatic C13 NOESY peak list from 3D C13-NOESY in H2O, Varian 750
This peak list was combined with the aliphatic C13 NOESY peak list in H2O for
AutoStructure calculations and RPF analysis.
;
   _Spectral_peak_list.Text_data_format                text
   _Spectral_peak_list.Text_data                      
;
      Assignment         w1         w2         w3   Data Height     Note    

G21HA3-W66CZ2-HZ2      3.726    113.927      7.300       182701 
 I20HB-W66CZ2-HZ2      2.109    113.927      7.298       144801 
L17HA/G21HA2-W66CZ2/W66CZ2-HZ2/W66HZ2      4.195    113.969      7.300       271061 
   W66HE1-CZ2-HZ2     10.665    113.971      7.300       614128 
 E64QG-W66CZ2-HZ2      2.216    113.976      7.304       162745 
  G21H-W66CZ2-HZ2      8.871    113.979      7.298       281294 
   W66HH2-CZ2-HZ2      6.947    113.994      7.302      1415779 
   W66HZ2-CZ2-HZ2      7.301    114.002      7.301      6331522 
L17HD2-W66CZ2-HZ2      0.922    114.039      7.301       411635 
I20HG2-W66CZ2-HZ2      0.852    114.044      7.298       332947 
R60HG2-W66CZ2-HZ2      1.460    114.073      7.301       226458 
            ?-?-?      1.913    114.346      7.365       200605 
K73HB3/K73HD2-W77CZ2/W77CZ2-HZ2/W77HZ2      1.526    114.346      7.370       285475 
K73HB2-W77CZ2-HZ2      0.776    114.354      7.354       161923 
   W77HH2-CZ2-HZ2      6.866    114.357      7.366      1244098 
K73HD3/E35HG3-W77CZ2/W77CZ2-HZ2/W77HZ2      1.623    114.359      7.368       328012 
   W77HE1-CZ2-HZ2     10.244    114.367      7.367       884841 
   W77HZ2-CZ2-HZ2      7.363    114.368      7.366     10070759 
 E35HA-W77CZ2-HZ2      3.716    114.386      7.367       146174 
E35HG2-W77CZ2-HZ2      1.337    114.440      7.366       189678 
 K73QE-W77CZ2-HZ2      3.040    114.441      7.365       167065 
   W77HZ3-CZ2-HZ2      6.637    114.461      7.367       180828 
    Y98HB2-QCE-QE      3.094    118.154      6.802       322990 
     Y98QD-QCE-QE      7.034    118.234      6.801     16274720 
     Y98HA-QCE-QE      4.295    118.263      6.805       200811 
    Y98HB3-QCE-QE      2.766    118.286      6.799       359300 
Y94QE/Y98QE-QCE/Y98QCE-QE/Y98QE      6.796    118.341      6.798    116590952 
            ?-?-?      2.270    118.376      6.797       725419 
            ?-?-?      2.131    118.438      6.794       988920 
            ?-?-?      1.953    118.454      6.795       354281 
     Y98QD-QCE-QE      7.033    118.466      6.802     12537560 
            ?-?-?      1.717    118.466      6.791       478711 
            ?-?-?      1.820    118.500      6.793       613054 
     Y94QD-QCE-QE      7.167    118.506      6.792      9785802 
            ?-?-?      4.115    118.522      6.793       562687 
 K104HA-Y44QCE-QE      3.829    119.221      6.886       289257 
 L48HD1-Y44QCE-QE      0.466    119.237      6.885       767140 
Q100HB2/K104HD3-Y44QCE/Y44QCE-QE/Y44QE      1.743    119.239      6.890       277785 
L103HB3-Y44QCE-QE      1.491    119.241      6.885       695605 
    H31HA-CD2-HD2      4.549    119.242      7.300       179234 
L103HB2-Y44QCE-QE      2.334    119.243      6.886       792100 
     Y44QE-QCE-QE      6.884    119.255      6.886     24404788 
  K104H-Y44QCE-QE      8.866    119.256      6.883       495614 
K104HB2-Y44QCE-QE      1.959    119.257      6.886       300156 
Q100HG3-Y44QCE-QE      0.939    119.264      6.882       461856 
 Q100HA-Y44QCE-QE      3.286    119.273      6.889       417104 
K104HB3-Y44QCE-QE      2.441    119.273      6.884       428340 
   H31HD2-CD2-HD2      7.294    119.284      7.297     22370242 
 A27HB-H31CD2-HD2      1.364    119.287      7.298       431545 
 L48HD2-Y44QCE-QE      0.670    119.292      6.881       266661 
L103HD1-Y44QCE-QE      1.253    119.296      6.881       297852 
     H31H-CD2-HD2      9.361    119.311      7.300       155247 
    Y44HB3-QCE-QE      3.009    119.323      6.886       119869 
    H31QB-CD2-HD2      3.270    119.338      7.298       379171 
     Y44QD-QCE-QE      7.183    119.387      6.886      6038914 
   W77HB2-CE3-HE3      2.849    119.867      7.121       220873 
 V74HA-W77CE3-HE3      3.061    119.897      7.129      1274845 
L42HD1-W77CE3-HE3      0.909    119.903      7.124       789031 
 A38HB-W77CE3-HE3      1.559    119.908      7.129       356668 
   W77HB3-CE3-HE3      3.520    119.923      7.132       394531 
 T71HA-W66CZ3-HZ3      3.591    120.521      6.862       136733 
I20HD1/V57HG2-W66CZ3/W66CZ3-HZ3/W66HZ3      0.912    120.580      6.867       643954 
T71HG2-W66CZ3-HZ3      1.290    120.603      6.872       177083 
   W66HE3-CZ3-HZ3      8.057    120.604      6.868       856118 
V57HG1-W66CZ3-HZ3      1.013    120.620      6.868       845572 
   W66HZ3-CZ3-HZ3      6.868    120.638      6.867      5300588 
 F70QD-W66CZ3-HZ3      7.026    120.638      6.867       503427 
V81HG1-H46CD2-HD2      0.709    120.950      7.171       226714 
P51HB3/P51HG3-H46CD2/H46CD2-HD2/H46HD2      1.949    120.970      7.170       415106 
    H46QB-CD2-HD2      3.382    120.970      7.168       271263 
P51HB2/P51HG2-H46CD2/H46CD2-HD2/H46HD2      2.067    120.975      7.166       472731 
 A82HA-H46CD2-HD2      4.070    120.996      7.164       539424 
     H46H-CD2-HD2      7.817    121.010      7.167       174689 
    H46HA-CD2-HD2      3.748    121.050      7.166       165196 
 E35HA-W77CZ3-HZ3      3.712    121.404      6.639       209037 
 V74HA-W77CZ3-HZ3      3.055    121.412      6.648       115602 
L42HD1-W77CZ3-HZ3      0.925    121.444      6.642       155968 
   W77HE3-CZ3-HZ3      7.122    121.445      6.638       624599 
   W77HZ3-CZ3-HZ3      6.638    121.494      6.641      2962286 
 A38HB-W77CZ3-HZ3      1.564    121.501      6.638       439264 
   W77HH2-CZ3-HZ3      6.866    121.515      6.639       682007 
V74HG2-W77CZ3-HZ3      0.147    121.528      6.637       274731 
   W66HB2-CE3-HE3      3.303    122.183      8.058       245051 
V57HG1-W66CE3-HE3      1.013    122.188      8.057       115955 
   W66HB3-CE3-HE3      3.138    122.237      8.064       230600 
T71HG2-W66CE3-HE3      1.285    122.253      8.051       299804 
   W66HE3-CE3-HE3      8.054    122.266      8.058      3815845 
G61HA3-W66CE3-HE3      2.185    122.271      8.059       222298 
 T71HA-W66CE3-HE3      3.600    122.271      8.058       495208 
   W66HZ3-CE3-HE3      6.867    122.273      8.058       790777 
 F70QD-W66CE3-HE3      7.024    122.277      8.056       509535 
            ?-?-?      5.623    122.285      8.060       197019 
 F70QE-W66CE3-HE3      6.519    122.307      8.054       178499 
G61HA2-W66CE3-HE3      3.382    122.318      8.055       302376 
E35HB3-W77CH2-HH2      2.065    123.029      6.862       295378 
   W77HZ2-CH2-HH2      7.365    123.036      6.864       939682 
   W77HZ3-CH2-HH2      6.635    123.043      6.864       768890 
   W77HH2-CH2-HH2      6.860    123.061      6.862      2740037 
 E35HA-W77CH2-HH2      3.716    123.089      6.865       300622 
            ?-?-?      1.906    123.097      6.864       384683 
E35HG3-W77CH2-HH2      1.635    123.166      6.866       175772 
I20HG2-W66CH2-HH2      0.840    123.954      6.954      1007331 
V57HG1-W66CH2-HH2      0.990    123.954      6.958       677272 
   W66HZ2-CH2-HH2      7.298    123.987      6.951      1421870 
   W66HH2-CH2-HH2      6.947    124.000      6.954     10101168 
   W66HZ3-CH2-HH2      6.833    124.000      6.954      1293629 
            ?-?-?      1.422    124.021      6.949       264389 
  G21H-W66CH2-HH2      8.889    124.047      6.959       157181 
 L17HA-W66CH2-HH2      4.217    124.080      6.959       166226 
W66HE3/E64H-CH2/W66CD1-HH2/W66HD1      8.043    124.307      6.945       298966 
  N67H-W66CD1-HD1      8.798    124.465      6.946       163482 
  G65H-W66CD1-HD1      7.597    124.502      6.945       162393 
E64HB2-W66CD1-HD1      2.242    124.516      6.943       763862 
G61HA2-W66CD1-HD1      3.381    124.530      6.946       246215 
     W66H-CD1-HD1      8.269    124.533      6.938       486978 
   W66HE1-CD1-HD1     10.665    124.538      6.943      2004233 
E64HB3-W66CD1-HD1      1.286    124.560      6.942       450694 
    W66HA-CD1-HD1      4.546    124.569      6.941       409051 
   W66HB2-CD1-HD1      3.309    124.610      6.940       223048 
   W77HB2-CD1-HD1      2.841    125.182      7.130       141029 
I87HD1-W77CD1-HD1      0.752    125.232      7.136       197794 
   W77HD1-CD1-HD1      7.125    125.246      7.128      7787597 
   W77HE1-CD1-HD1     10.244    125.247      7.127      1756720 
    W77HA-CD1-HD1      4.632    125.254      7.126       460046 
   W77HB3-CD1-HD1      3.507    125.255      7.126       165195 
K39HE2-W77CD1-HD1      1.796    125.263      7.127       220608 
K80HG2-W77CD1-HD1      1.657    125.280      7.123       224360 
     W77H-CD1-HD1      7.869    125.289      7.127       402343 
K39HE3-W77CD1-HD1      0.993    125.368      7.140       133970 
 Q100HG3-F95CZ-HZ      0.958    127.808      6.587       218865 
 L103HD1-F95CZ-HZ      1.241    127.824      6.588       489041 
 Q100HG2-F95CZ-HZ      1.089    127.824      6.588       230919 
  Y44HB3-F95CZ-HZ      3.033    127.836      6.588       296612 
      F95QD-CZ-HZ      7.186    127.842      6.590       640332 
  Y44HB2-F95CZ-HZ      3.432    127.843      6.598       192034 
      F95HZ-CZ-HZ      6.586    127.844      6.588      3888367 
      F95QE-CZ-HZ      6.841    127.850      6.590      1658529 
  Q100HA-F95CZ-HZ      3.287    127.867      6.587       361514 
      F70QD-CZ-HZ      7.027    128.722      6.692       248787 
  I20HG2-F70CZ-HZ      0.830    128.767      6.687       461127 
      F70QE-CZ-HZ      6.533    128.778      6.692      1767139 
      F70HZ-CZ-HZ      6.688    128.784      6.692      4072627 
  V74HG2-F70CZ-HZ      0.150    128.830      6.691       177780 
   I20HB-F70CZ-HZ      2.097    128.840      6.695       192395 
            ?-?-?      1.994    128.865      6.690       121846 
      F19HZ-CZ-HZ      7.215    129.423      7.206      7719242 
      F19QE-CZ-HZ      7.370    129.423      7.201      2427010 
 Q102HB3-F19CZ-HZ      2.051    129.438      7.206       335832 
   M99HA-F19CZ-HZ      3.695    129.443      7.206       321178 
Q102HB2/Q102HG2-F19CZ/F19CZ-HZ/F19HZ      2.227    129.464      7.208       574633 
      F19HZ-CZ-HZ      7.215    129.504      7.210      7899016 
  M99HG3-F19CZ-HZ      1.504    129.533      7.207       234156 
F4QE/F4HZ-CZ/F4CZ-HZ/F4HZ      7.279    129.932      7.280     55908628 
     F19HA-QCD-QD      4.733    130.462      7.299       172221 
L103HD1-F19QCD-QD      1.235    130.504      7.299       185679 
  A16HA-F19QCD-QD      4.000    130.525      7.293       447664 
    F19HB3-QCD-QD      3.646    130.556      7.296       373014 
      F19H-QCD-QD      8.472    130.560      7.296       260126 
    F19HB2-QCD-QD      3.089    130.561      7.294       390784 
L103HD2-F19QCD-QD      0.978    130.574      7.296       593940 
I41HG12-F19QCD-QD      1.616    130.575      7.292       187222 
 I41HD1-F19QCD-QD      0.928    130.579      7.294       543945 
     F19QD-QCD-QD      7.291    130.595      7.292     16994368 
     F95HA-QCD-QD      5.051    130.722      7.182       149732 
 I41HG2-F95QCD-QD      0.955    130.734      7.175       152416 
    F95HB2-QCD-QD      3.341    130.736      7.176       774371 
    F95HB3-QCD-QD      3.045    130.751      7.176       620814 
 M99HB2-F95QCD-QD      1.856    130.770      7.174       241333 
 M99HB3-F95QCD-QD      1.628    130.777      7.175       411860 
 T37HG2-F95QCD-QD      1.166    130.779      7.176       265028 
     F95QD-QCD-QD      7.174    130.781      7.177     10232259 
     F95QE-QCD-QD      6.840    130.789      7.175      1274275 
I41HG13-F95QCD-QD      0.759    130.856      7.172       134743 
     F19QE-QCE-QE      7.370    131.064      7.378     11075665 
 M99HG3-F19QCE-QE      1.510    131.075      7.383       229934 
L103HD2-F19QCE-QE      0.985    131.114      7.379       323771 
L103HD1-F19QCE-QE      1.249    131.138      7.381       207124 
     F19HZ-QCE-QE      7.215    131.145      7.383      3533032 
     F19QD-QCE-QE      7.289    131.145      7.383      6493448 
     F19QE-QCE-QE      7.379    131.145      7.378     11406876 
 V74HG2-F70QCE-QE      0.138    131.167      6.538       210860 
 M99HG2-F19QCE-QE      2.223    131.169      7.380       358236 
 L103HG-F19QCE-QE      2.286    131.177      7.385       432370 
F19HB3/M99HA-QCE/F19QCE-QE/F19QE      3.687    131.191      7.384       136126 
     F70QE-QCE-QE      6.533    131.222      6.536      5375390 
     F70HZ-QCE-QE      6.682    131.227      6.536      1359683 
 I20HG2-F70QCE-QE      0.828    131.240      6.538       364798 
     F70QD-QCE-QE      7.035    131.315      6.537       571540 
 Q100HA-F95QCE-QE      3.281    131.377      6.839       160588 
      F4QE-QCE-QE      7.315    131.438      7.320     49662096 
      F4QD-QCE-QE      7.229    131.438      7.324     27370384 
I41HG12-F95QCE-QE      1.628    131.464      6.841       401909 
Q100HG3-F95QCE-QE      0.976    131.470      6.842       280238 
     F95QD-QCE-QE      7.145    131.473      6.829       381074 
F95HB3/I41HA-QCE/F95QCE-QE/F95QE      3.038    131.475      6.839       300688 
 M99HB2-F95QCE-QE      1.879    131.498      6.840       199308 
L103HD1-F95QCE-QE      1.233    131.520      6.841       376742 
     F95QE-QCE-QE      6.840    131.521      6.841      6863775 
     F95HZ-QCE-QE      6.584    131.529      6.840      1390248 
 Y44HB2-F95QCE-QE      3.439    131.540      6.836       246770 
I41HG13-F95QCE-QE      0.731    131.566      6.842       157792 
F4QE/F4HZ-QCE/F4QCE-QE/F4QE      7.304    131.582      7.318     55252476 
     F4HB3-QCE-QE      3.115    131.654      7.312       214538 
      F4HA-QCE-QE      4.540    131.672      7.310       151810 
      F4QD-QCE-QE      7.241    131.672      7.317     33370572 
      F4QE-QCE-QE      7.315    131.672      7.315     53418220 
     F4HB2-QCE-QE      2.983    131.682      7.315       334158 
     F70QE-QCD-QD      6.533    131.776      7.031       453467 
      F4QD-QCD-QD      7.230    131.795      7.228     79662872 
     F4HB3-QCD-QD      3.114    131.801      7.228       755124 
      F4HA-QCD-QD      4.529    131.827      7.222       345918 
      F4QE-QCD-QD      7.325    131.835      7.229     26088778 
     F4HB2-QCD-QD      2.985    131.846      7.225       908883 
 W66HB2-F70QCD-QD      3.280    131.856      7.032       189997 added.....weak!
     F70QD-QCD-QD      7.031    131.899      7.033      5905074 
 W66HZ3-F70QCD-QD      6.879    131.904      7.023       379041 
      F70H-QCD-QD      7.732    131.916      7.033       183969 
   T71H-F70QCD-QD      8.678    131.935      7.035       250621 
    F70HB2-QCD-QD      3.550    131.960      7.030       549432 
    F70HB3-QCD-QD      3.620    131.962      7.034       591548 
     F70HA-QCD-QD      3.788    131.980      7.035       352779 
 W66HE3-F70QCD-QD      8.051    131.981      7.033       436932 
            ?-?-?      1.872    132.021      7.033       263684 
    Y94HB2-QCD-QD      3.382    132.222      7.175       810644 
     Y94HA-QCD-QD      4.497    132.245      7.173       603669 
  E93HA-Y94QCD-QD      4.106    132.248      7.172       583079 
    Y94HB3-QCD-QD      2.714    132.253      7.173       582621 
 E93HB3-Y94QCD-QD      1.819    132.264      7.174       313548 
  L45HA-Y44QCD-QD      3.795    132.285      7.177       267187 
            ?-?-?      2.128    132.316      7.171       445066 
     Y94QE-QCD-QD      6.800    132.327      7.175      6325468 
            ?-?-?      1.704    132.328      7.172       302186 
            ?-?-?      2.311    132.365      7.173       610623 
  L45HG-Y44QCD-QD      1.922    132.429      7.189       337860 
   L45H-Y44QCD-QD      8.082    132.430      7.188       454482 
  F95HZ-Y44QCD-QD      6.592    132.457      7.188       524998 
     Y44QE-QCD-QD      6.873    132.473      7.199      4496079 
L103HB2-Y44QCD-QD      2.311    132.482      7.192       576038 
L103HB3-Y44QCD-QD      1.501    132.502      7.195       320795 
L103HD1-Y44QCD-QD      1.241    132.535      7.193       547340 
     Y44HA-QCD-QD      4.339    132.543      7.193       796459 
      Y44H-QCD-QD      8.351    132.553      7.191       410751 
 L45HD1-Y44QCD-QD      0.847    132.558      7.194       475091 
    Y44HB2-QCD-QD      3.434    132.590      7.187       868814 
    Y44HB3-QCD-QD      3.026    132.590      7.192       975172 
 L48HD1-Y44QCD-QD      0.465    132.626      7.195       215405 
  M99HA-Y98QCD-QD      3.679    133.150      7.034       186862 
 E101QB-Y98QCD-QD      2.104    133.168      7.029       343639 
 M99HG2-Y98QCD-QD      2.222    133.192      7.033       541339 
 M99HG3-Y98QCD-QD      1.486    133.198      7.034       226094 
      Y98H-QCD-QD      7.939    133.209      7.032       519569 
     Y98QE-QCD-QD      6.797    133.210      7.032     13915106 
     Y98QD-QCD-QD      7.029    133.213      7.032     55337188 
    Y98HB2-QCD-QD      3.099    133.221      7.032      1351734 
    Y98HB3-QCD-QD      2.778    133.228      7.032      1520156 
     Y98HA-QCD-QD      4.302    133.233      7.033      1057028 
;

   loop_
      _Spectral_dim.ID
      _Spectral_dim.Atom_type
      _Spectral_dim.Atom_isotope_number
      _Spectral_dim.Spectral_region
      _Spectral_dim.Magnetization_linkage_ID
      _Spectral_dim.Sweep_width
      _Spectral_dim.Sweep_width_units
      _Spectral_dim.Encoding_code
      _Spectral_dim.Encoded_reduced_dimension_ID
      _Spectral_dim.Entry_ID
      _Spectral_dim.Spectral_peak_list_ID

      1 H 1 'all H's'      .  8618.832 . . . 15089 2 
      2 C 1 'aromatic C's' .  5653.710 . . . 15089 2 
      3 H 1 'aromatic H's' . 13522.650 . . . 15089 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

      4 $SPARKY . . 15089 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                        15089
   _Spectral_peak_list.ID                              3
   _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.Experiment_ID                   3
   _Spectral_peak_list.Experiment_name                '3D 1H-15N NOESY'
   _Spectral_peak_list.Number_of_spectral_dimensions   3
   _Spectral_peak_list.Details                        
;
N15 NOESY peak list from 3D 15N-NOESY in H2O, Varian 750.
This peak list is the final N15 NOESY peak list used for AutoStructure
calculations and RPF analysis.
;
   _Spectral_peak_list.Text_data_format                text
   _Spectral_peak_list.Text_data                      
;
        Assignment         w1         w2         w3   Data Height     Note    

   E64QG-R60NE-HE      2.211     83.267      7.820      1165268 
     R60HG2-NE-HE      1.462     83.300      7.805      1030455 
     R60HB2-NE-HE      1.650     83.319      7.807       660065 
     R60HD2-NE-HE      3.332     83.327      7.810      2466480 
     R60HD3-NE-HE      3.026     83.327      7.810      2809327 
     R60HG3-NE-HE      0.937     83.330      7.810      1001434 
     R60HB3-NE-HE      1.732     83.333      7.811       781036 
      R60HA-NE-HE      3.919     83.412      7.814      1471491 
      R86QD-NE-HE      3.162     84.539      7.180       823394 
     L17HA-G21N-H      4.240    105.800      8.873      5771976 
     I20HB-G21N-H      2.083    105.907      8.875      4100632 
    I20HG2-G21N-H      0.860    105.912      8.875      2276566 
     I20HA-G21N-H      4.004    105.913      8.874      1788844 
    W66HZ2-G21N-H      7.297    105.916      8.876      2041280 
       G21HA2-N-H      4.191    105.919      8.874      8049433 
     D18HA-G21N-H      4.518    105.919      8.872      2138120 
      I20H-G21N-H      8.416    105.920      8.876      5226198 
         G21H-N-H      8.874    105.920      8.874     44703720 
      G22H-G21N-H      7.560    105.927      8.874      4979364 
       G21HA3-N-H      3.720    105.931      8.875      5163207 
      K39H-G40N-H      8.093    106.043      7.885      6720642 
         G40H-N-H      7.888    106.045      7.887     50626780 
    K39HG2-G40N-H      0.904    106.046      7.882       948004 
       G40HA3-N-H      3.476    106.054      7.886      9665090 
    K39HB2-G40N-H      1.572    106.057      7.886      3699521 
       G40HA2-N-H      3.406    106.059      7.887     10468749 
I89HD1/I41HG13-G40N/G40N-H/G40H      0.686    106.076      7.886      3492865 
I41H/L42H-G40N/G40N-H/G40H      8.007    106.100      7.889      7352818 
    K39HB3-G40N-H      1.317    106.103      7.884      1404883 
     F19HA-G22N-H      4.741    106.412      7.565      1387309 
G22H/M23H-N/G22N-H/G22H      7.564    106.473      7.564     71082104 
       G22HA2-N-H      4.395    106.474      7.564      7418770 
G22HA3/G21HA3-N/G22N-H/G22H      3.774    106.474      7.565     12560933 
      G21H-G22N-H      8.877    106.476      7.564      5879654 
      I20H-G22N-H      8.435    106.480      7.569      1228405 
    G21HA2-G22N-H      4.204    106.500      7.567      2545882 
     L48QB-G49N-H      1.633    106.519      7.727      3209860 
     I20HA-G22N-H      4.013    106.527      7.567      1130645 added 
    V50HG2-G49N-H      0.745    106.535      7.727      1677850 
         G49H-N-H      7.728    106.537      7.728     79661184 
L48HA/G49HA2-G49N/G49N-H/G49H      4.183    106.540      7.729     14421465 
       G49HA3-N-H      3.680    106.542      7.729     15043143 
      V50H-G49N-H      8.089    106.548      7.729     16470135 
      L48H-G49N-H      7.606    106.551      7.731     13361868 
      V74H-G76N-H      7.585    106.720      7.834      2234502 
A75HA/G76HA3-G76N/G76N-H/G76H      3.857    106.772      7.840     23201040 
      W77H-G76N-H      7.882    106.772      7.840     50512032 
     A75HB-G76N-H      1.366    106.773      7.840      7751426 
         G76H-N-H      7.840    106.773      7.839     92296808 
      A75H-G76N-H      8.893    106.780      7.839      9250353 
     K73HA-G76N-H      3.544    106.782      7.838      3874008 
      A78H-G76N-H      8.668    106.787      7.836      1732118 
    R60HG3-G61N-H      0.922    107.225      8.137      1908042 
    R60HB2-G61N-H      1.638    107.226      8.138      4052615 
    T71HG2-G61N-H      1.294    107.226      8.136      3931530 
       G61HA2-N-H      3.388    107.229      8.137     12549054 
       G61HA3-N-H      2.182    107.229      8.138      8032828 
      R60H-G61N-H      7.568    107.230      8.138      8150444 
         G61H-N-H      8.135    107.231      8.137     62160456 
     R60HA-G61N-H      3.928    107.233      8.138      2300617 
      E62H-G61N-H      8.009    107.237      8.139     10804468 
     E64HA-G65N-H      4.215    108.790      7.600      4462762 
      A82H-G84N-H      8.259    108.798      7.736      1626519 
      E64H-G65N-H      8.038    108.799      7.601     16599394 
      W66H-G65N-H      8.271    108.801      7.602     12791224 
G65HA3/E62HA-N/G65N-H/G65H      3.989    108.802      7.601     18766684 
       G65HA2-N-H      3.923    108.807      7.602     20440948 
         G65H-N-H      7.601    108.809      7.601     97215200 
    G61HA3-G65N-H      2.215    108.814      7.602      4194513 
    E64HB3-G65N-H      1.287    108.822      7.603      2536397 
    Q63HB2-G65N-H      2.060    108.841      7.603      1527820 
       G84HA2-N-H      4.213    108.859      7.743     11686274 
S83H/N85H-G84N/G84N-H/G84H      7.843    108.866      7.742     26017676 
         G84H-N-H      7.746    108.868      7.743     99192368 
S83QB/K80HA-G84N/G84N-H/G84H      4.075    108.870      7.743      6335777 
       G84HA3-N-H      3.754    108.870      7.743     15728344 
     V81HA-G84N-H      3.588    108.879      7.745      2633166 
     A82HB-G84N-H      1.589    108.881      7.743      1452463 
     S83HA-G84N-H      4.473    108.885      7.742      3915506 
    N85HB2-G84N-H      2.513    108.893      7.746      1179738 
Q100HE21-NE2-HE21      6.667    111.664      6.665     73473184 
Q100HE22-NE2-HE22      5.930    111.683      5.931      9695275 
 Q100HG2-NE2-HE21      1.072    111.690      6.672      1656275 
 Q100HG3-NE2-HE22      1.004    111.690      5.924       795997 
Q100HE21-NE2-HE22      6.665    111.693      5.931     12173418 
Q100HE22-NE2-HE21      5.932    111.695      6.665     32248010 
 Q100HG3-NE2-HE21      0.981    111.719      6.664      2029872 
    G84HA3-S83N-H      3.746    111.741      7.813      1092582 
      A82H-S83N-H      8.271    111.758      7.819     12156755 
        S83HA-N-H      4.468    111.760      7.819     10682252 
      G84H-S83N-H      7.748    111.766      7.816     34522784 
         S83H-N-H      7.817    111.770      7.819    137277744 
A82HA/S83QB/K80HA-S83N/S83N/S83N-H/S83H/S83H      4.064    111.772      7.820     25709874 
     A82HB-S83N-H      1.584    111.773      7.819      9664313 
     V81HA-S83N-H      3.572    111.774      7.825      1593265 
  Q63HG3-NE2-HE21      2.313    111.988      7.668      4985131 
Q63HE22/Q102HE21-NE2/Q102NE2-HE21/Q102HE22      6.808    112.010      7.669    136696416 
 Q63HE21-NE2-HE22      7.655    112.011      6.796    117657496 
 Q102HG3-NE2-HE21      2.139    112.013      6.838      3662056 
Q63HE21/Q102HE22-NE2/Q102NE2-HE21/Q102HE22      7.672    112.016      7.668    259314720 
  Q63HG3-NE2-HE22      2.322    112.020      6.808      2951724 
Q102HE22-NE2-HE21      7.665    112.034      6.825     58639492 
 Q102HG2-NE2-HE21      2.260    112.034      6.834      4464206 
            ?-?-?      1.369    112.254      7.660      1380791 
 N24HD21-ND2-HD22      7.638    112.333      6.887     61013980 
 N24HD22-ND2-HD21      6.880    112.342      7.644     52397576 
  N24HB2-ND2-HD21      2.559    112.355      7.642      2084474 
            ?-?-?      1.365    112.355      6.895      1584693 
  N24HB2-ND2-HD22      2.561    112.372      6.893      1268102 
  N24HB3-ND2-HD22      2.804    112.395      6.888      1705641 
  N24HB3-ND2-HD21      2.807    112.414      7.641      2448101 
  N3HD21-ND2-HD22      7.603    112.795      6.899    118084216 
   N3HB2-ND2-HD22      2.746    112.795      6.907      1543841 
  N3HD22-ND2-HD22      6.898    112.797      6.900    471634048 
   N3HB2-ND2-HD21      2.752    112.800      7.606      3258979 
  N3HD22-ND2-HD21      6.901    112.831      7.601    124483816 
   N3HB3-ND2-HD21      2.670    112.832      7.602      4680038 
  N3HD21-ND2-HD21      7.602    112.836      7.602    414598336 
   N3HB3-ND2-HD22      2.686    112.852      6.908      1643626 
   N91HA-ND2-HD22      5.082    113.138      8.111       943508 
  N91HB2-ND2-HD22      2.308    113.181      8.101      1262228 
   N91HA-ND2-HD21      5.076    113.196      6.826      1889646 
 N91HD21-ND2-HD21      6.830    113.220      6.831     64614680 
 N91HD22-ND2-HD21      8.113    113.243      6.830     31026648 
 N91HD21-ND2-HD22      6.828    113.244      8.112     19590706 
  N91HB2-ND2-HD21      2.307    113.247      6.827      1522864 
  N91HB3-ND2-HD21      2.113    113.253      6.829      2458961 
E35HG3/K90QB-S36N/N91ND2-H/N91HD22      1.638    113.279      8.105      1782730 
            ?-?-?      0.797    113.292      7.813      1279054 
E35HB3/N91HB3-S36N/N91ND2-H/N91HD22      2.076    113.320      8.110      4737635 
S36H/N91HD22-N/N91ND2-H/N91HD22      8.109    113.323      8.113     55259556 
P92HD2-N91ND2-HD22      3.775    113.356      8.109      3243458 
        S36QB-N-H      4.075    113.362      8.111      6153088 
      T37H-S36N-H      8.083    113.372      8.110     40055140 
    E35HB2-S36N-H      1.985    113.372      8.108      3196810 
      E35H-S36N-H      8.718    113.374      8.110      3363042 
        S36HA-N-H      3.997    113.417      8.109      4531806 
   N85HA-ND2-HD21      4.628    113.460      7.504      1889405 
S83QB-N85ND2-HD22      4.064    113.463      7.134      3183716 
  N85HB2-ND2-HD21      2.503    113.465      7.501      4727993 
  N85HB3-ND2-HD22      2.672    113.479      7.133      1201024 
S83QB-N85ND2-HD21      4.062    113.482      7.502      4926060 
 N85HD21-ND2-HD22      7.500    113.483      7.137     71683816 
 N85HD22-ND2-HD21      7.134    113.483      7.502     91717200 
  N85HB2-ND2-HD22      2.497    113.484      7.134      2130721 
  N85HB3-ND2-HD21      2.665    113.493      7.501      2727633 
   N85HA-ND2-HD22      4.633    113.528      7.140       861917 
         N91H-N-H      7.852    114.214      7.855     23071030 
     K90QB-N91N-H      1.640    114.220      7.858      3412348 
    P92HD2-N91N-H      3.770    114.223      7.855      1558008 
      K90H-N91N-H      8.983    114.232      7.865      1194812 
       N91HB2-N-H      2.319    114.233      7.857      1518767 
     K90HA-N91N-H      3.951    114.236      7.854      2874298 
    W66HE1-E64N-H     10.650    114.236      8.034       929089 
    I89HG2-N91N-H      0.716    114.246      7.862      1749149 
      N24H-T25N-H      8.237    114.246      7.325       747548 
      Q63H-E64N-H      7.660    114.251      8.040     14690724 
     Q63HA-E64N-H      3.957    114.253      8.037      6287406 
        E64QG-N-H      2.219    114.253      8.038     15626461 
        N91HA-N-H      5.082    114.255      7.856      2284793 
       E64HB3-N-H      1.291    114.255      8.039      8477804 
    Q63HB2-E64N-H      2.058    114.260      8.038      8585338 
     I89HA-N91N-H      4.056    114.261      7.843      1269693 
         E64H-N-H      8.040    114.265      8.040     73113480 
      G65H-E64N-H      7.611    114.268      8.037     13916606 
        E64HA-N-H      4.219    114.270      8.040      6980694 
     N24HA-T25N-H      4.728    114.319      7.328      6874173 
         T25H-N-H      7.326    114.329      7.327     37998200 
       T25HG2-N-H      0.018    114.338      7.328      2872466 
      S26H-T25N-H      7.765    114.341      7.328      4481878 
     A27HB-S26N-H      1.355    114.641      7.764      1018468 
      T25H-S26N-H      7.325    114.653      7.764      4448046 
      A27H-S26N-H      7.139    114.658      7.763      2670458 
       S26HB2-N-H      3.888    114.661      7.764      3025804 
       S26HB3-N-H      4.016    114.673      7.767      2586054 
        S26HA-N-H      4.515    114.678      7.763      2592152 
     S36HA-K39N-H      4.000    114.784      8.094      1476788 
        I13HA-N-H      3.530    114.809      7.176       807167 
      A12H-I13N-H      9.202    114.812      7.182       908598 
        I13HB-N-H      1.811    114.828      7.185      1876108 
      E14H-I13N-H      7.408    114.841      7.180      2246860 
         I13H-N-H      7.182    114.845      7.178     14119624 
      I13HG12-N-H      1.554    114.853      7.179      1163163 
    V29HG2-S28N-H      0.891    114.860      8.228      1595417 
       I13HD1-N-H      0.889    114.867      7.183       874425 
E35HA/T37HA-K39N/K39N-H/K39H      3.691    114.873      8.101      1186622 
         S28H-N-H      8.224    114.882      8.225    115302656 
     A27HB-S28N-H      1.363    114.884      8.227      9094388 
        S28QB-N-H      3.875    114.887      8.226     17243462 
A27HA/S28HA-S28N/S28N-H/S28H      4.270    114.887      8.227     36565704 
      V29H-S28N-H      7.519    114.890      8.226     17393296 
    H31HD2-S28N-H      7.271    114.890      8.225      2224587 
       I13HG2-N-H      0.947    114.901      7.193       766844 
     V29HB-S28N-H      2.023    114.903      8.232      1578723 
      A38H-K39N-H      9.112    114.905      8.097      3024554 
       K39HB3-N-H      1.318    114.905      8.098      3724991 
       K39HG3-N-H      0.317    114.913      8.098      1907852 
       K39HG2-N-H      0.898    114.917      8.096      5337812 
     A38HA-K39N-H      3.850    114.918      8.103      1657133 
K39H/T37H-N/K39N-H/K39H      8.096    114.920      8.096     54453540 
     S53HA-E55N-H      4.726    114.927      8.782      1578955 
     A12HB-I13N-H      1.317    114.928      7.194       803929 
A38HB/K39HB2-K39N/K39N-H/K39H      1.566    114.932      8.096     12424457 
        K39HA-N-H      3.543    114.935      8.097      5047201 
            ?-?-?      0.709    114.938      8.094      1422571 
      G40H-K39N-H      7.887    114.938      8.097      6822942 
    V58HG2-E55N-H      0.910    114.953      8.785      1592239 
        K39QD-N-H      1.040    114.955      8.097      2488782 
         E55H-N-H      8.782    114.957      8.781    129494040 
    V56HG2-E55N-H      1.117    114.957      8.784      1211289 
      V56H-E55N-H      7.584    114.962      8.782     12635639 
        E55HA-N-H      3.902    114.964      8.782     13258014 
    S53HB2-E55N-H      4.291    114.966      8.783      6785377 
P54HA/P54HD2-E55N/E55N-H/E55H      4.031    114.966      8.782     12090004 
P54HB3/E55HB3-E55N/E55N-H/E55H      2.023    114.966      8.782     22301820 
      V57H-E55N-H      7.168    114.967      8.779      1764437 
E55HG3/P54HG2-N/E55N-H/E55H      2.277    114.971      8.783      9768610 
    P54HD3-E55N-H      3.543    114.977      8.783      2482038 
      V58H-E55N-H      8.027    114.983      8.782      1204969 
 N67HD21-ND2-HD21      7.273    115.281      7.276     29427318 
P68HD2/S28QB-N67ND2/N67ND2-HD21/N67HD21      3.872    115.294      7.275      2101477 
S28HA-N67ND2-HD21      4.232    115.299      7.275      1729033 
  N67HB3-ND2-HD22      2.886    115.311      7.575      1854999 
  N67HB3-ND2-HD21      2.890    115.325      7.277      2761859 
            ?-?-?      8.230    115.327      7.281       622004 to S28HN very weak!!
 N67HD21-ND2-HD22      7.273    115.332      7.578     12999795 
 N67HD22-ND2-HD21      7.578    115.338      7.275     18818480 
 N67HD22-ND2-HD22      7.574    115.357      7.577     18282302 
       L17HB2-N-H      2.160    116.050      8.257      3370522 
D18H/F19H-L17N/L17N-H/L17H      8.485    116.054      8.257      4060596 
     A16HB-L17N-H      1.529    116.062      8.255      4008178 
       L17HB3-N-H      1.418    116.062      8.257      2546720 
       L17HD2-N-H      0.884    116.065      8.255      3379690 
        L17HG-N-H      1.993    116.072      8.256      5052427 
A16H/K15H-L17N/L17N-H/L17H      8.047    116.074      8.257      4348693 
         L17H-N-H      8.254    116.087      8.255     29737520 
        L17HA-N-H      4.227    116.099      8.250      2862718 
L45HD1/L45HD2-N/L45N-H/L45H      0.866    116.103      8.081      5390408 
    Y44HB3-L45N-H      3.021    116.107      8.079      4536566 
     E14HA-L17N-H      3.835    116.111      8.254      1368552 
    Y44HB2-L45N-H      3.432    116.112      8.079      2806073 
      H46H-L45N-H      7.795    116.114      8.081      5911626 
        L45HG-N-H      1.917    116.114      8.080      6999764 
        L45HA-N-H      3.813    116.120      8.080      5106394 
       L45HB3-N-H      1.690    116.120      8.081      7694779 
         L45H-N-H      8.081    116.121      8.081     52752672 
       L45HB2-N-H      2.250    116.127      8.079      4037850 
      Y44H-L45N-H      8.346    116.128      8.083      5483694 
     Y44HA-L45N-H      4.336    116.128      8.082      1811549 
      F70H-T71N-H      7.731    116.260      8.676      8069475 
     F70QD-T71N-H      7.026    116.261      8.674      2010840 
     P68HA-T71N-H      4.518    116.263      8.678      3037628 
            ?-?-?      5.630    116.265      8.678      7411538 
       T71HG2-N-H      1.293    116.269      8.678      3146394 
         T71H-N-H      8.677    116.272      8.681     80035776 
      E69H-T71N-H      8.545    116.272      8.681      4957012 
      K72H-T71N-H      8.001    116.272      8.675      7335124 
     F70HA-T71N-H      3.800    116.289      8.678      2439241 
T71HA/T97HA/F70HB2-N/T97N/T71N-H/T97H/T71H      3.586    116.322      8.678     12831877 
      K72H-T71N-H      7.987    116.332      8.678      7568546 
         T97H-N-H      8.679    116.352      8.680     80035776 
T71HB/S96HA/S96HB2-N/T97N/T97N-H/T97H/T97H      4.227    116.397      8.681     20074894 
       E105QG-N-H      2.405    116.426      7.970      8230160 
   K104QG-E105N-H      1.462    116.441      7.971      2401488 
    L106H-E105N-H      7.384    116.444      7.970      7038614 
    K104H-E105N-H      8.862    116.448      7.970      5315559 
E105HA/Q102HA-N/E105N-H/E105H      4.059    116.448      7.970     11131461 
        T97HB-N-H      4.031    116.480      8.685      6113866 
   K104HA-E105N-H      3.839    116.480      7.972      2956574 
       T97HG2-N-H      1.156    116.482      8.687      2828836 
       E105QB-N-H      2.122    116.513      7.970     16185490 
        E105H-N-H      7.972    116.533      7.972     92048048 
  K104HB2-E105N-H      1.968    116.543      7.971     10402042 
  K104HB3-E105N-H      2.442    116.543      7.973      5683796 
        K7H-S8N-H      8.261    116.763      8.371     10347043 
         S8HA-N-H      4.388    116.763      8.371     10578990 
          S8H-N-H      8.364    116.792      8.367    279279296 
       K7HA-S8N-H      4.320    116.799      8.370     24477896 
      K7HB3-S8N-H      1.887    116.800      8.368      3400124 
         S8QB-N-H      3.850    116.801      8.370     17862836 
      K7HB2-S8N-H      1.746    116.810      8.371      2899285 
        E69HA-N-H      4.152    116.914      8.527      5925938 
P68HB2/E69HG3-E69N/E69N-H/E69H      2.443    116.919      8.525      5229334 
    P68HD2-E69N-H      3.852    116.922      8.524      3748481 
         E69H-N-H      8.523    116.924      8.525     62074892 
    P68HD3-E69N-H      4.063    116.924      8.529      1671147 
P68HB3/E69HB3-E69N/E69N-H/E69H      2.051    116.928      8.526     11288486 
      F70H-E69N-H      7.728    116.929      8.526      9449586 
       E69HG2-N-H      2.291    116.931      8.526      8147739 
      T71H-E69N-H      8.661    116.944      8.518      3205944 
     P68HA-E69N-H      4.513    116.958      8.523      1867243 
      L103HD2-N-H      0.977    117.025      7.842      2147684 
      L103HD1-N-H      1.247    117.037      7.848      1674829 
       L42HD1-N-H      0.883    117.053      7.978      6977383 
      K43H-L42N-H      8.751    117.067      7.976      4690191 
       L42HB3-N-H      1.317    117.076      7.979      3168398 
    K104H-L103N-H      8.865    117.077      7.845      4399622 
       L103HA-N-H      4.184    117.077      7.844      3500066 
I41H/L42H-L42N/L42N-H/L42H      7.979    117.083      7.977     48572696 
L103HB2/L103HG-N/L103N-H/L103H      2.295    117.091      7.841     12117592 
Q102H/L103H-L103N/L103N-H/L103H      7.842    117.091      7.844     51247200 
      L103HB3-N-H      1.502    117.100      7.847      3398515 
     K39HA-L42N-H      3.549    117.105      7.985      1709032 
        L42HA-N-H      4.000    117.117      7.978      3967950 
  Q102HB2-L103N-H      2.209    117.142      7.839      9084837 
  Q102HB3-L103N-H      2.071    117.142      7.838      6084160 
         N24H-N-H      8.250    117.214      8.260     10922466 
            ?-?-?      4.801    117.231      8.259       886318 
    M23HB2-N24N-H      2.111    117.234      8.254      1423007 
    M23HB3-N24N-H      1.977    117.264      8.259      2217824 
     M23HA-N24N-H      4.440    117.280      8.261      1235501 
       N24HB3-N-H      2.801    117.289      8.253      1002085 
       N24HB2-N-H      2.551    117.291      8.255       580526 
L45HB2/Q102HB2/Q102HG2-H46N/Q102N/Q102N-H/Q102H/Q102H      2.239    117.489      7.818     15393098 
       Q102HA-N-H      4.040    117.504      7.818      7493597 
E101QB/Q102HB3-Q102N/Q102N-H/Q102H      2.078    117.523      7.818     13419690 
    E101H-Q102N-H      8.484    117.523      7.817      7280510 
      L106HB2-N-H      1.962    117.527      7.383      8472310 
V107H/L108H-L106N/L106N-H/L106H      8.206    117.542      7.383      4924378 
      L106HB3-N-H      1.414    117.549      7.386      2538016 
    E105H-L106N-H      7.971    117.549      7.385      4011707 
E105HA/Q102HA-L106N/L106N-H/L106H      4.060    117.553      7.385      1481630 
       L106HA-N-H      4.251    117.556      7.387      3113704 
      L106HD2-N-H      0.869    117.557      7.388      3163241 
   E105QB-L106N-H      2.099    117.562      7.388      3467548 
        L106H-N-H      7.389    117.564      7.388     31896276 
        Q102H-N-H      7.812    117.568      7.814    102861408 
    L103H-Q102N-H      7.857    117.568      7.814     54318384 
   M99HB2-Q100N-H      1.857    117.691      7.473      2081325 
        Q100H-N-H      7.465    117.700      7.469     28233922 
      Q100HB3-N-H      1.550    117.701      7.471      3455597 
      Q100HG3-N-H      0.967    117.705      7.471      2411644 
      Q100HB2-N-H      1.762    117.708      7.471      2523753 
       Q100HA-N-H      3.282    117.727      7.471      2097775 
     M99H-Q100N-H      7.338    117.729      7.473      5932418 
    T97HA-Q100N-H      3.576    117.736      7.471      1168852 
    E101H-Q100N-H      8.485    117.737      7.474      3498794 
E101HA/K43HA-Q102N/H46N-H/H46H      3.930    117.797      7.802      3477980 
         H46H-N-H      7.791    117.817      7.795     85223520 
      L45H-H46N-H      8.080    117.858      7.798      6110618 
      D47H-H46N-H      9.006    117.877      7.798      6535818 
        H46QB-N-H      3.394    117.879      7.796     12642806 
    L45HB3-H46N-H      1.701    117.920      7.797      3248723 
        H46HA-N-H      3.755    117.923      7.800      6429248 
    V81HG1-H46N-H      0.716    117.942      7.796      2384234 
V58HG1/K15HG3-N/K15N-H/K15H      0.799    118.073      8.010     10574767 
     E14QB-K15N-H      2.032    118.073      8.014      6982578 
K15HA/E55HA/A12HA-N/V58N/K15N-H/V58H/K15H      3.917    118.125      8.023      8190156 
   Q100HA-E101N-H      3.293    118.156      8.487      1052796 
    Q100H-E101N-H      7.469    118.170      8.486      5060920 
      E101HG2-N-H      2.397    118.173      8.489      4662522 
  Q100HB2-E101N-H      1.761    118.176      8.487      3104911 
Q102H/L103H-E101N/E101N-H/E101H      7.817    118.177      8.486      7492046 
       E101HA-N-H      3.962    118.180      8.488      5909896 
  Q100HB3-E101N-H      1.548    118.180      8.492      3503270 
        E101H-N-H      8.485    118.181      8.488     54457556 
      E101HG3-N-H      2.292    118.183      8.487      4785536 
       E101QB-N-H      2.069    118.183      8.488     11079029 
    T97HA-E101N-H      3.575    118.190      8.492       835230 
V57H/I13H-V58N/K15N-H/K15H      7.166    118.205      8.024     10955502 
       V58HG2-N-H      0.879    118.205      8.025     23325884 
    Y98HA-E101N-H      4.312    118.208      8.496      1372938 
     V57HB-V58N-H      2.370    118.210      8.026      8762565 
        V58HA-N-H      3.331    118.211      8.025      6197144 
      A59H-V58N-H      7.631    118.216      8.024     11013878 
            ?-?-?      3.139    118.217      8.229      3580696 
            ?-?-?      4.568    118.218      8.227      3366728 
            ?-?-?      8.212    118.257      7.964      5335099 
            ?-?-?      3.229    118.265      7.969      7407561 
     P68HA-K72N-H      4.528    118.307      7.990      3549188 
L108H/V107H-E109N/E109N-H/E109H      8.200    118.372      7.922      6622077 
    G84HA3-N85N-H      3.755    118.420      7.827      4309431 
T71HG2/K72HG3-K72N/K72N-H/K72H      1.320    118.425      8.015      6354111 
     V81HA-N85N-H      3.571    118.478      7.829      1695004 
    G84HA2-N85N-H      4.215    118.485      7.830      3976571 
       K72HG2-N-H      1.515    118.487      8.010      6702192 
      N85HD22-N-H      7.122    118.498      7.820      1400338 
         N85H-N-H      7.829    118.500      7.830    102134768 
      G84H-N85N-H      7.726    118.501      7.831     15132536 
       N85HB3-N-H      2.668    118.504      7.828      6788233 
        N85HA-N-H      4.632    118.511      7.830      7417875 
       N85HB2-N-H      2.512    118.513      7.830     12797394 
      N85HD21-N-H      7.504    118.530      7.829      3641412 
     E69HA-K72N-H      4.141    118.540      7.989      9748030 
     S83QB-N85N-H      4.072    118.546      7.832      4207651 
     K73HA-V74N-H      3.563    118.548      7.567      2191416 
       V74HG2-N-H      0.148    118.552      7.567      7914572 
      K73H-K72N-H      7.397    118.561      8.005      9178600 
      A75H-V74N-H      8.895    118.562      7.569      6323740 
       K72HB2-N-H      1.817    118.569      8.007     19183552 
        V74HA-N-H      3.051    118.569      7.564      2722058 
  L108HB3-E109N-H      1.504    118.570      7.924      2778978 
       E109QB-N-H      2.079    118.592      7.918     10661206 
      S83H-V81N-H      7.832    118.593      8.369      1943584 
L108HA/E109HA-E109N/E109N-H/E109H      4.117    118.596      7.918     12234776 
      R86H-N85N-H      8.517    118.602      7.829      2114777 
  L108HB2-E109N-H      1.810    118.607      7.923      4513356 
      E109HG3-N-H      2.276    118.607      7.917      3740442 
            ?-?-?      4.167    118.617      7.915      8096192 
  L108HD2-E109N-H      0.895    118.620      7.921      2276488 
        K72HA-N-H      3.747    118.625      8.007      8010379 
    K80HB2-V81N-H      1.801    118.632      8.369      3018712 
         V81H-N-H      8.367    118.633      8.372     47914268 
      A82H-V81N-H      8.273    118.633      8.372     10953630 
        V81HA-N-H      3.572    118.634      8.370      4535220 
       V81HG1-N-H      0.718    118.641      8.370      3041014 
      T71H-K72N-H      8.680    118.642      8.006      5299248 
       V81HG2-N-H      0.993    118.642      8.369      8083526 
        V81HB-N-H      2.029    118.642      8.369     10316394 
     T71HB-K72N-H      4.239    118.645      8.004      9910124 
      K80H-V81N-H      8.093    118.647      8.368      6987696 
      K73H-V74N-H      7.415    118.649      7.574      9322102 
     T71HA-K72N-H      3.601    118.649      8.010      2040712 
K80HA/A78HA-V81N/V81N-H/V81H      4.081    118.651      8.368      3319726 
K80HG3/A82HB-V81N/V81N-H/V81H      1.565    118.659      8.375      1756508 
            ?-?-?      5.630    118.681      8.006      1754170 
      E55H-V56N-H      8.783    118.695      7.581      8449986 
       V56HG2-N-H      1.116    118.696      7.582      9853031 
         V81H-N-H      8.373    118.698      8.372     47914268 
    K73HB3-V74N-H      1.493    118.708      7.567      3917968 
    K80HG2-V81N-H      1.674    118.715      8.375      1325660 
        V56HB-N-H      2.296    118.720      7.582     10216599 
      V57H-V56N-H      7.161    118.721      7.582     14205553 
    E55HB3-V56N-H      2.025    118.732      7.583      3571042 
V56HG1/V74HG1-N/V74N-H/V74H      0.973    118.734      7.581     10231836 
    E55HB2-V56N-H      1.939    118.750      7.582      2592148 
S53HB3/P54HA-V56N/V56N-H/V56H      4.012    118.823      7.588      3777145 
E55HA/V56HA/R60HA/V56HA-V56N/V56N/R60N/R60N-H/V56H/R60H/R60H      3.910    118.829      7.581     11668102 
         M99H-N-H      7.323    118.961      7.325     27856096 
     Y98HA-M99N-H      4.281    118.962      7.312       891878 
       M99HG3-N-H      1.509    118.965      7.322      1278438 
      Y98H-M99N-H      7.946    118.982      7.321      3055638 
       M99HB3-N-H      1.626    118.994      7.319      1827633 
       M99HG2-N-H      2.211    118.995      7.323      2814172 
        M99HA-N-H      3.707    118.996      7.319      1497084 
       M99HB2-N-H      1.864    119.000      7.320      2473559 
     Q100H-M99N-H      7.453    119.037      7.321      4785804 
      G61H-R60N-H      8.133    119.106      7.578      6166396 
     A59HB-R60N-H      1.363    119.106      7.590     10165768 added
    Y98HB3-M99N-H      2.772    119.109      7.321      1654522 
            ?-?-?      4.548    119.149      8.786       853627 
     T11HA-E14N-H      4.186    119.275      7.411      1201762 
         E14H-N-H      7.406    119.281      7.408     35786856 
        E14HA-N-H      3.816    119.281      7.407      3004820 
K15H/A16H-E14N/E14N-H/E14H      8.022    119.287      7.408      4178640 
     I13HA-E14N-H      3.530    119.298      7.405      1017910 
    I13HG2-E14N-H      0.933    119.302      7.409      2054106 
       E14HG3-N-H      2.194    119.303      7.407      3774824 
     I13HB-E14N-H      1.813    119.304      7.408      3686060 
        E14QB-N-H      2.041    119.311      7.409      7716528 
      I13H-E14N-H      7.184    119.317      7.409      5311667 
L48QB/R60HB2-N/R60N-H/R60H      1.639    119.324      7.600     16341240 
       T37HG2-N-H      1.167    119.327      8.083      1829388 
      D47H-L48N-H      9.006    119.351      7.605      7966178 
        L48HA-N-H      4.206    119.369      7.605      8015222 
      G49H-L48N-H      7.738    119.372      7.605     11820162 
L48H/A59H/R60H-N/A59N/A59N-H/A59H/A59H      7.607    119.372      7.605    126718256 
        L48HG-N-H      1.362    119.372      7.598     14710010 
     S36QB-T37N-H      4.098    119.397      8.083      4112950 
      A38H-T37N-H      9.106    119.400      8.086      3069940 
    D47HB2-L48N-H      2.953    119.400      7.600      2275751 
T37H/K39H-N/T37N-H/T37H      8.082    119.408      8.083     68836544 
      S36H-T37N-H      8.132    119.408      8.083     23110372 
     V58HA-A59N-H      3.337    119.409      7.644      3625230 
        A59HA-N-H      4.053    119.411      7.643     13414859 
    V58HG1-A59N-H      0.852    119.414      7.640     10428505 
        A59HB-N-H      1.362    119.469      7.639     31009492 
        T37HB-N-H      4.232    119.475      8.083      7062151 
     V58HB-A59N-H      1.908    119.494      7.651     12021013 
         Y94H-N-H      7.340    119.498      7.338     23331748 
      F95H-Y94N-H      7.698    119.548      7.339      3041692 
            ?-?-?      4.081    119.554     10.046       503464 
        Y94HA-N-H      4.508    119.557      7.341      1577467 
       E93HB2-N-H      1.978    119.562     10.039       667844 
       Y94HB3-N-H      2.718    119.568      7.334      1992986 
       Y94HB2-N-H      3.369    119.596      7.341      1286004 
      E93H-Y94N-H     10.021    119.613      7.342      1022227 
E64H/E62H-Q63N/Q63N-H/Q63H      8.035    119.620      7.689     22129962 
Q63HA/R60HA/E62HA-N/Q63N/Q63N-H/Q63H/Q63H      3.955    119.621      7.673     20573784 
      V58H-A59N-H      8.023    119.628      7.655     25262320 
E62HG2/Q63HG2-Q63N/Q63N-H/Q63H      2.376    119.643      7.677      7425247 
Q63HG3/E64HB2-N/Q63N-H/Q63H      2.276    119.644      7.676      5941846 
       Q63HB3-N-H      2.149    119.651      7.677     19914486 
E62HB2/Q63HB2-Q63N/Q63N-H/Q63H      2.050    119.651      7.678     23268710 
T37HA/G49HA3-N/V50N-H/V50H      3.679    119.731      8.088      6225919 
     A27HB-V29N-H      1.362    119.816      7.522      6496597 
         V29H-N-H      7.519    119.821      7.519    108238160 
        V29HB-N-H      2.002    119.824      7.520     12047808 
     S28HA-V29N-H      4.267    119.826      7.520      8819086 
       V29HG2-N-H      0.896    119.826      7.520     10895240 
     S28QB-V29N-H      3.874    119.830      7.521      6613212 
      S28H-V29N-H      8.227    119.832      7.521     12843062 
        V29HA-N-H      4.312    119.849      7.520      7100112 
        V50HA-N-H      4.361    119.897      8.089      5939872 
      G49H-V50N-H      7.725    119.904      8.086     15397137 
        V50HB-N-H      1.956    119.906      8.087      8006903 
    P51HD2-V50N-H      3.252    119.907      8.092      2211382 
      L48H-V50N-H      7.613    119.917      8.090      3776333 
V50HG2/V50HG1-N/V50N-H/V50H      0.756    119.928      8.090      8473020 
         V50H-N-H      8.084    119.939      8.084    114344672 
    T71HG2-E62N-H      1.298    119.946      8.001      2799302 
      Q63H-E62N-H      7.677    119.978      8.003     15186222 
      G61H-E62N-H      8.134    119.987      8.001     11128356 
       E62HG2-N-H      2.398    119.987      8.002      8215648 
G61HA3/E62HG3-E62N/E62N-H/E62H      2.171    119.988      8.001     10403402 
    G61HA2-E62N-H      3.386    119.991      8.003      5208028 
         E62H-N-H      8.008    119.995      8.003    118264320 
        E62HA-N-H      3.989    120.000      8.004     12854564 
       E62HB2-N-H      2.045    120.000      8.003     17828270 
    V58HG1-E62N-H      0.839    120.031      8.011      2150424 
  L103HB2-K104N-H      2.348    120.056      8.865      1690058 
       K104HA-N-H      3.836    120.058      8.862      1664339 
    Y44QE-K104N-H      6.894    120.064      8.870       643152 
      K104HB3-N-H      2.442    120.074      8.868      2495672 
      K104HB2-N-H      1.971    120.094      8.866      2411423 
    E105H-K104N-H      7.969    120.096      8.867      2040868 
        K104H-N-H      8.867    120.099      8.868     13475712 
L103H/Q102H-K104N/K104N-H/K104H      7.841    120.107      8.872      2449402 
L103HB3/K104QG-K104N/K104N-H/K104H      1.476    120.121      8.860      1246235 
        F19QD-N-H      7.295    120.308      8.486      1158865 
      I20H-F19N-H      8.436    120.332      8.477     24735312 
      D18H-F19N-H      8.501    120.332      8.477     35591860 
            ?-?-?      0.934    120.344      8.477      1440442 
       F19HB3-N-H      3.644    120.349      8.479      2906999 
     D18HA-F19N-H      4.520    120.360      8.482       844005 
L108HB2/L108HG-N/L108N-H/L108H      1.797    120.362      8.199     13336792 
        F19HA-N-H      4.739    120.366      8.483      2318695 
    E109H-L108N-H      7.938    120.366      8.199      6972148 
         F19H-N-H      8.474    120.373      8.479     41846464 
V107HG2/L108HD1-L108N/L108N-H/L108H      0.913    120.373      8.201      7324021 
       F19HB2-N-H      3.060    120.379      8.479      4031734 
   V107HA-L108N-H      3.771    120.379      8.201      2891863 
     D18QB-F19N-H      2.654    120.384      8.482      2074496 
     A16HA-F19N-H      3.991    120.388      8.480      1981832 
   V107HB-L108N-H      2.231    120.393      8.202      6128598 
       L108HA-N-H      4.130    120.417      8.198      6235700 
      L108HB3-N-H      1.510    120.434      8.200      5463196 
     T97HA-Y98N-H      3.569    120.451      7.941      2218232 
    T97HG2-Y98N-H      1.155    120.460      7.940      2255536 
         Y98H-N-H      7.942    120.467      7.941     89838064 
     T97HB-Y98N-H      4.034    120.477      7.944      8109131 
      V74H-K73N-H      7.557    120.481      7.395     10353556 
      T97H-Y98N-H      8.681    120.482      7.942      6113913 
      M99H-Y98N-H      7.316    120.485      7.942      6214232 
       Y98HB3-N-H      2.778    120.485      7.942     11380545 
       Y98HB2-N-H      3.101    120.488      7.942     10457098 
     E69HA-K73N-H      4.166    120.493      7.397      1523320 
       K73HB3-N-H      1.491    120.495      7.396     13594629 
        K73QG-N-H      1.166    120.495      7.396      7233587 
      K72H-K73N-H      8.003    120.497      7.396      8752410 
     K72HA-K73N-H      3.758    120.498      7.397      4348567 
    K72HG3-K73N-H      1.333    120.498      7.397      2404776 
       K73HB2-N-H      0.765    120.498      7.396      5606902 
         K73H-N-H      7.396    120.499      7.396     97172352 
        Y98HA-N-H      4.290    120.499      7.942     11635932 
    V74HG2-K73N-H      0.150    120.502      7.397      1179678 
K73HD3/K72QD-N/K73N-H/K73H      1.622    120.505      7.396      3116624 
      A75H-K73N-H      8.894    120.508      7.396      1414296 
        K73HA-N-H      3.547    120.508      7.397      9265219 
    K72HB3-K73N-H      1.794    120.512      7.397      8647735 
         K80H-N-H      8.098    120.517      8.093     94390944 
        Y98QD-N-H      7.025    120.523      7.943      1728894 
       K80HG2-N-H      1.666    120.529      8.095      7048042 
    G61HA3-W66N-H      2.199    120.536      8.256      2799838 
       K80HB2-N-H      1.799    120.538      8.095      7307499 
    E79HB2-K80N-H      2.379    120.542      8.093      7680583 
       K80HB3-N-H      2.114    120.545      8.094     12471129 
        K80HA-N-H      4.050    120.552      8.094      8918850 
     W77HA-K80N-H      4.638    120.556      8.094      2412268 
      E79H-K80N-H      8.632    120.561      8.095      7657301 
      V81H-K80N-H      8.368    120.566      8.095      8207773 
        W66HA-N-H      4.551    120.575      8.268      2172540 
    G65HA3-W66N-H      4.008    120.580      8.262      2629779 
       K80HG3-N-H      1.548    120.587      8.095      5725908 
      G65H-W66N-H      7.602    120.588      8.268      6583332 
       W66HB2-N-H      3.280    120.591      8.262      1834320 
       W66HB3-N-H      3.130    120.596      8.265      3015410 
     S96HA-F95N-H      4.211    120.604      7.700      1060276 
       W66HD1-N-H      6.936    120.613      8.269      1406400 
    G65HA2-W66N-H      3.917    120.621      8.262      2540190 
            ?-?-?      0.901    120.636      8.357      1048105 
     E93HA-F95N-H      4.106    120.655      7.696      1177432 
       F95HB3-N-H      3.038    120.661      7.698      4933127 
      Y94H-F95N-H      7.343    120.668      7.698      6731941 
        F95HA-N-H      5.048    120.669      7.699      2334250 
     Y94HA-F95N-H      4.505    120.673      7.699      1668826 
F95HB2/Y94HB2-N/F95N-H/F95H      3.344    120.673      7.698      7482490 
        F95QD-N-H      7.186    120.680      7.693      2291534 
       Y44HB3-N-H      3.020    120.704      8.346      8144610 
     K43HA-Y44N-H      3.918    120.711      8.341      1902338 
    K43HB3-Y44N-H      1.995    120.716      8.349      4762264 
         F95H-N-H      7.697    120.718      7.696     51780752 
      L45H-Y44N-H      8.082    120.724      8.345      6798821 
        Y44QD-N-H      7.187    120.730      8.348      1726131 
        Y44HA-N-H      4.340    120.738      8.349      5187647 
      K43H-Y44N-H      8.754    120.738      8.347      6422984 
       Y44HB2-N-H      3.438    120.743      8.346      8792436 
    K43HB2-Y44N-H      1.696    120.747      8.347      2862566 
     K43QG-Y44N-H      1.554    120.812      8.351      1607882 
     S32HA-E35N-H      4.228    120.833      8.717      2380858 
         E35H-N-H      8.718    120.833      8.715     36360176 
       E35HB3-N-H      2.058    120.840      8.716      7058328 
    D34HB2-E35N-H      2.962    120.841      8.717      2580232 
      D34H-E35N-H      7.348    120.846      8.717      4720583 
    D34HB3-E35N-H      3.108    120.848      8.719      1572815 
        E35HA-N-H      3.708    120.850      8.719      3453136 
S36H/T37H-E35N/E35N-H/E35H      8.104    120.851      8.716      4880602 
       E35HB2-N-H      1.967    120.861      8.718      7007562 
     D34HA-E35N-H      4.606    120.862      8.719      2158622 
    G22HA3-M23N-H      3.776    120.965      7.531       601486 
G22HA2/M23HA-M23N/M23N-H/M23H      4.419    120.968      7.532      1354202 
       M23HG3-N-H      2.453    120.977      7.543       818710 
      N24H-M23N-H      8.261    121.007      7.525       829498 
       M23HB2-N-H      2.120    121.010      7.543      1757176 
       M23HG2-N-H      2.993    121.019      7.546       978399 
G22H/M23H-M23N/M23N-H/M23H      7.539    121.031      7.528     17460582 
       M23HB3-N-H      1.978    121.034      7.538      1522446 
     I13HA-A16N-H      3.524    121.102      8.042      1322954 
K15H/A16H-A16N/A16N-H/A16H      8.045    121.120      8.046     46162424 
      L17H-A16N-H      8.251    121.121      8.046      3825872 
A16HA/A12HA-N/A16N-H/A16H      3.995    121.126      8.043      4081098 
A16HB/K15HB3-N/A16N-H/A16H      1.537    121.128      8.047      8610448 
    I13HG2-A16N-H      0.967    121.134      8.045      3535733 
            ?-?-?      0.877    121.134      8.042      2731344 
      K5HB3-D6N-H      1.729    121.210      8.195      5659091 
        D6HB2-N-H      2.721    121.231      8.195     10548817 
          D6H-N-H      8.190    121.232      8.194    381200064 
      E14H-A16N-H      7.397    121.233      8.043      1011895 
         D6HA-N-H      4.530    121.263      8.196     11452472 
       K5HA-D6N-H      4.201    121.269      8.196     23984624 
        D6HB3-N-H      2.625    121.272      8.197     11382426 
     V81HA-A82N-H      3.570    121.481      8.274      1689213 
     V81HB-A82N-H      2.020    121.483      8.275      5079118 
        A82HB-N-H      1.587    121.488      8.273     14266253 
        A82HA-N-H      4.069    121.492      8.274      8368470 
    V81HG1-A82N-H      0.715    121.509      8.275      2195918 
V81H/S8H-A82N/K7N-H/K7H      8.395    121.522      8.268      9176930 
         A82H-N-H      8.274    121.522      8.273    200280064 
      S83H-A82N-H      7.830    121.556      8.277      8642436 
     W77HA-A78N-H      4.640    121.559      8.690      2099450 
      E79H-A78N-H      8.624    121.562      8.687     23606760 
W77HD1/W77HE3-A78N/A78N-H/A78H      7.128    121.566      8.686      1048166 
    W77HB2-A78N-H      2.845    121.567      8.690      2246302 
W77H/G76H-A78N/A78N-H/A78H      7.864    121.571      8.689     10754438 
    V81HG2-K43N-H      0.965    121.578      8.747      2359711 
        A78HA-N-H      4.116    121.578      8.690      5906913 
         A78H-N-H      8.682    121.583      8.688     76785744 
    V81HG1-K43N-H      0.714    121.584      8.752      1815750 
        A78HB-N-H      1.537    121.585      8.690     15390890 
    W77HB3-A78N-H      3.507    121.586      8.694      4662118 
    L42HB3-K43N-H      1.319    121.586      8.752      1928512 
            ?-?-?      2.204    121.589      8.445      1197128 
L42HB2/K43HB3-K43N/K43N-H/K43H      1.988    121.590      8.753     11379926 
    L42HD1-A78N-H      0.891    121.591      8.692      6409620 
K39HA/G40HA3-K43N/K43N-H/K43H      3.512    121.595      8.749      2362032 
         K43H-N-H      8.748    121.597      8.751     53893144 
    L42HD1-K43N-H      0.879    121.600      8.744      2573308 
            ?-?-?      2.077    121.602      8.445      2554681 
        K43HA-N-H      3.921    121.603      8.752      5384674 
     A75HA-A78N-H      3.853    121.603      8.692      4680536 
L42H/I41H-K43N/K43N-H/K43H      7.974    121.604      8.755      6088782 
       K43HB2-N-H      1.694    121.608      8.753      7480748 
            ?-?-?      4.365    121.615      8.447      5639801 
    P54HG3-E79N-H      1.971    121.618      8.628      2618926 
            ?-?-?      3.873    121.618      8.444      1345148 
A75HA/G76HA3-E79N/E79N-H/E79H      3.867    121.618      8.626      2675053 
    P54HG2-E79N-H      2.312    121.618      8.627      4301870 
     A78HB-E79N-H      1.537    121.634      8.634      6386216 
      A78H-E79N-H      8.684    121.634      8.631     26434756 
            ?-?-?      2.910    121.636      8.447       825046 
      N85H-R86N-H      7.823    121.639      8.506      2598240 
      I87H-R86N-H      8.170    121.644      8.504      5200500 
        R86QB-N-H      1.725    121.649      8.507     22745860 
        R86HA-N-H      4.238    121.650      8.506      8817880 
    N85HB3-R86N-H      2.667    121.650      8.507      7880291 
     N85HA-R86N-H      4.629    121.652      8.507     28051438 
         R86H-N-H      8.504    121.655      8.505    115218048 
    N85HB2-R86N-H      2.509    121.659      8.508      3993996 
      Y44H-K43N-H      8.343    121.660      8.756      7408139 
         E79H-N-H      8.631    121.662      8.632     50623508 
E79HB2/E79HG2-N/E79N-H/E79H      2.376    121.663      8.627      9489285 
        E79HA-N-H      3.990    121.663      8.627      6531899 
       R86HG3-N-H      1.512    121.668      8.509      3101463 
       E79HB3-N-H      2.163    121.670      8.628      6715502 
      K80H-E79N-H      8.096    121.674      8.629      6016575 
       N3HA-F4N-H      4.682    121.810      8.344     25803360 
        F4HB3-N-H      3.119    121.822      8.346      5935289 
        F4HB2-N-H      2.985    121.825      8.345     10986932 
      N3HB3-F4N-H      2.665    121.830      8.342      2063117 
          F4H-N-H      8.343    121.854      8.344    351881152 
      N3HB2-F4N-H      2.745    121.865      8.345      2176754 
         F4HA-N-H      4.531    121.876      8.343     10358986 
         K7QG-N-H      1.435    121.896      8.283      5415482 
          K7H-N-H      8.277    121.902      8.283    330288000 
        K7HB3-N-H      1.884    121.902      8.281      5258486 
      D6HB3-K7N-H      2.626    121.928      8.289      2194184 
      D6HB2-K7N-H      2.725    121.936      8.289      2308974 
       D6HA-K7N-H      4.527    121.983      8.284     24926270 
         K7HA-N-H      4.317    121.984      8.284     10086204 
     V56HB-V57N-H      2.300    122.000      7.159      5955798 
        K7HB2-N-H      1.743    122.007      8.280     11340304 
        I87HB-N-H      1.555    122.012      8.166      8218598 
        I87HA-N-H      4.407    122.015      8.164      7126567 
     R86QB-I87N-H      1.720    122.016      8.165      8449767 
      I87HG12-N-H      1.029    122.019      8.165      6969457 
     R86HA-I87N-H      4.245    122.026      8.167     41622616 
       I87HG2-N-H      0.773    122.032      8.167      7602974 
         I87H-N-H      8.167    122.040      8.166    157879072 
      I87HG13-N-H      1.340    122.044      8.168      3723669 
      R86H-I87N-H      8.505    122.073      8.174      3523992 
        V57HB-N-H      2.364    122.165      7.162     10532471 
     V56HA-V57N-H      3.909    122.165      7.162      3681780 
        V57HA-N-H      3.442    122.167      7.162      3994590 
       V57HG2-N-H      0.914    122.168      7.164     13974719 
      V56H-V57N-H      7.585    122.169      7.163     12442408 
         V57H-N-H      7.162    122.170      7.162     52608336 
      V58H-V57N-H      8.024    122.173      7.163      8701912 
     P54HA-V57N-H      4.007    122.175      7.163      2790608 
  L106HB3-V107N-H      1.402    122.200      8.216      1996279 
      E55H-V57N-H      8.779    122.203      7.164      1243781 
  L106HB2-V107N-H      1.939    122.246      8.218      1554422 
       V107HA-N-H      3.772    122.306      8.213      2458604 
      V107HG2-N-H      0.943    122.318      8.216      7286995 
    L106H-V107N-H      7.387    122.320      8.214      4374208 
       V107HB-N-H      2.231    122.351      8.220      6079724 
      T11H-A12N-H      8.486    122.380      9.181       878523 
     T11HA-A12N-H      4.185    122.386      9.182      2498832 
V52HG1/V52HG2-N/V52N-H/V52H      0.965    122.406      8.840      4484170 
    I13HD1-A12N-H      0.833    122.416      9.185      1069641 
        V52HA-N-H      3.853    122.417      8.847      1942127 
    L42HD2-V52N-H      0.859    122.417      8.842      2230028 
      I13H-A12N-H      7.186    122.421      9.186      1405852 
        A12HB-N-H      1.314    122.422      9.188      6126549 
         A12H-N-H      9.187    122.422      9.184     23212660 
K5HA/L103HA-N/V107N-H/V107H      4.200    122.423      8.242     11969120 
        K5HB3-N-H      1.705    122.423      8.245     14744149 
       F4HA-K5N-H      4.529    122.425      8.246     26030768 
         K5QG-N-H      1.330    122.425      8.245      6812814 
      F4HB3-K5N-H      3.118    122.428      8.244      3309174 
K5H/V107H-N/V107N-H/V107H      8.239    122.429      8.243    441159552 
     P51HA-V52N-H      4.334    122.430      8.842      8777368 
     T11HB-A12N-H      4.385    122.435      9.185      2603643 
        A12HA-N-H      3.959    122.437      9.184      2072849 
    V81HG1-V52N-H      0.742    122.444      8.839      1573728 
    P51HB2-V52N-H      2.048    122.451      8.843      5097031 
      F4HB2-K5N-H      2.990    122.478      8.250      2450910 
         A75H-N-H      8.890    122.580      8.893     75760888 
    V57HG1-A75N-H      1.008    122.581      8.891      6902430 
        A75HA-N-H      3.839    122.583      8.893      7552311 
     V74HB-A75N-H      1.682    122.584      8.894      5843056 
      V74H-A75N-H      7.564    122.588      8.893      7420574 
        A75HB-N-H      1.363    122.588      8.895     14874030 
     T71HA-A75N-H      3.581    122.590      8.892      1598301 
G76H/W77H-A75N/A75N-H/A75H      7.840    122.596      8.895      8797832 
    V74HG2-A75N-H      0.147    122.609      8.894      1665653 
      K73H-A75N-H      7.399    122.620      8.895      1672092 
    F19HB3-I20N-H      3.642    122.680      8.403      1781028 
     L17HA-I20N-H      4.223    122.684      8.411      2047217 
I20HA/A16HA-N/I20N-H/I20H      4.002    122.695      8.411      2699915 
        I20HB-N-H      2.101    122.698      8.409      6451092 
      G21H-I20N-H      8.870    122.704      8.412      3111310 
    F19HB2-I20N-H      3.090    122.706      8.408      1327536 
       I20HD1-N-H      0.925    122.709      8.411      4350541 
         I20H-N-H      8.417    122.716      8.415     33023506 
F19H/D18H-I20N/I20N-H/I20H      8.486    122.716      8.409      7454441 
       D34HB2-N-H      2.944    122.779      7.352       648408 
        D34HA-N-H      4.601    122.873      7.349       473574 
S96HA/S96HB2-N/S96N-H/S96H      4.220    122.890      7.533      1558842 
            ?-?-?      8.087    122.928      9.133      1013494 
     F95HA-S96N-H      5.048    122.950      7.533      2658755 
        A38HB-N-H      1.562    122.951      9.122       994670 
       S96HB3-N-H      3.966    122.969      7.541      1152300 
            ?-?-?      4.532    122.972      9.453       558424 
      I41HG13-N-H      0.724    122.975      7.992      2705442 
      G40H-I41N-H      7.879    122.981      7.986      7117325 
I41H/L42H-N/I41N-H/I41H      7.989    122.994      7.990     44045704 
     T37HB-A38N-H      4.240    123.000      9.100       557021 
I41HD1/I41HG2-N/I41N-H/I41H      0.943    123.001      7.990      4910755 
        I41HA-N-H      3.060    123.003      7.992      3089146 
     A38HA-I41N-H      3.843    123.005      7.998      1589823 
     L17HA-D18N-H      4.227    123.008      8.487      1494936 
        I41HB-N-H      1.905    123.011      7.991      7300243 
    G40HA3-I41N-H      3.476    123.012      7.993      1949158 
    G40HA2-I41N-H      3.401    123.012      7.994      2342046 
      I41HG12-N-H      1.618    123.017      7.992      4474551 
    L17HB2-D18N-H      2.150    123.042      8.485      3173626 
      F19H-D18N-H      8.484    123.059      8.488     66382024 
    L17HD2-D18N-H      0.889    123.061      8.485      1579431 
        D18QB-N-H      2.651    123.067      8.488      4155510 
        D18HA-N-H      4.515    123.071      8.486      4649653 
      A16H-D18N-H      8.042    123.072      8.489      1759869 
      L17H-D18N-H      8.256    123.079      8.486      6391616 
            ?-?-?      7.382    123.084      8.490       810107 
    L17HB3-D18N-H      1.412    123.084      8.489      1633390 
            ?-?-?      3.026    123.088      8.488      6271963 
     K15HA-D18N-H      3.929    123.091      8.488      3438432 
         D18H-N-H      8.491    123.093      8.489     66382024 
     A16HB-D18N-H      1.521    123.103      8.491      1523430 
            ?-?-?      6.764    123.130      8.491       925458 
     F19QD-D18N-H      7.298    123.144      8.488       832393 
     K43HA-D47N-H      3.907    123.318      9.006      1266906 
      H46H-D47N-H      7.789    123.339      9.005      6802444 
       D47HB2-N-H      2.944    123.340      9.005      7926612 
       D47HB3-N-H      2.654    123.341      9.005      5131278 
      L45H-D47N-H      8.085    123.353      9.007      1414745 
         D47H-N-H      9.009    123.356      9.007     57897364 
     H46QB-D47N-H      3.400    123.359      9.007      6697424 
        D47HA-N-H      4.293    123.362      9.006      7022840 
      L48H-D47N-H      7.606    123.364      9.008      7534304 
     H46HA-D47N-H      3.761    123.389      9.009      2277354 
       S8QB-M9N-H      3.850    123.390      8.319      6760230 
         M9QB-N-H      1.980    123.397      8.318     16708307 
    V81HG1-D47N-H      0.711    123.402      9.003      1086238 
         M9HA-N-H      4.754    123.412      8.322      4838501 
         M9QG-N-H      2.514    123.415      8.320      4854922 
       S8HA-M9N-H      4.391    123.419      8.321     20988492 
          M9H-N-H      8.325    123.424      8.321    156231008 
     L48QB-D47N-H      1.650    123.437      9.007      1126216 
          N3H-N-H      8.571    123.516      8.572    331580544 
        N3HB3-N-H      2.666    123.523      8.573      7194929 
        N3HB2-N-H      2.748    123.524      8.572      5748237 
       V2HA-N3N-H      4.060    123.526      8.574     29553610 
         N3HA-N-H      4.682    123.548      8.576      6424901 
        N67HA-N-H      4.828    123.885      8.809      1295885 
    E69HB3-F70N-H      2.054    123.911      7.727      1968488 
    N67HB3-F70N-H      2.890    123.913      7.732      2541298 
         F70H-N-H      7.729    123.913      7.729     26989268 
      E69H-F70N-H      8.527    123.915      7.730      7450088 
       F70HB3-N-H      3.666    123.915      7.731      3976280 
      T71H-F70N-H      8.676    123.919      7.730      6298738 
        F70HA-N-H      3.812    123.920      7.730      3568030 
       F70HB2-N-H      3.570    123.926      7.732      4656919 
T71HB/S28HA-F70N/F70N-H/F70H      4.212    123.941      7.731      2002982 
        F70QD-N-H      7.037    123.942      7.727      1251194 
    W66HB2-N67N-H      3.285    123.968      8.803       984828 
    E69HB2-F70N-H      2.240    123.971      7.730      1320435 
        N67HA-N-H      4.832    123.985      8.803      1295885 
         N67H-N-H      8.799    123.992      8.797     10906900 
       N67HB3-N-H      2.891    123.996      8.799      3786993 
     W66HA-N67N-H      4.541    124.005      8.798      4173310 
    V56HG2-S53N-H      1.110    124.543      8.541      2441560 
            ?-?-?      0.744    124.571      8.541      2934851 
            ?-?-?      3.892    124.573      8.540     13855650 
       S53HB2-N-H      4.290    124.582      8.542      3072258 
      G76H-W77N-H      7.835    124.582      7.868     79864272 
       S53HB3-N-H      4.020    124.583      8.541      6082166 
V52HG1/V52HG2-S53N/S53N-H/S53H      0.968    124.585      8.543      3273186 
     V52HA-S53N-H      3.837    124.600      8.538      6256952 
       W77HB3-N-H      3.505    124.607      7.871      8643120 
         S53H-N-H      8.539    124.608      8.542     46712912 
     V74HA-W77N-H      3.053    124.608      7.872      3908093 
         W77H-N-H      7.867    124.609      7.870    102029896 
    G76HA3-W77N-H      3.858    124.610      7.871      8481912 
      A78H-W77N-H      8.687    124.610      7.870     13305442 
       W77HE1-N-H     10.251    124.612      7.877       767873 
      A75H-W77N-H      8.896    124.614      7.874      1143104 
    L42HD1-W77N-H      0.898    124.615      7.872      2624084 
       W77HB2-N-H      2.845    124.615      7.871      4639267 
W77HD1/W77HE3-N/W77N-H/W77H      7.125    124.615      7.870      3636403 
        W77HA-N-H      4.636    124.616      7.870      7034965 
     A78HB-W77N-H      1.536    124.639      7.872      2279365 
        S53HA-N-H      4.722    124.657      8.534      2654043 
L88QB/I89HG12-I89N/I89N-H/I89H      1.447    126.068      8.458      6207552 
        I89HB-N-H      1.679    126.069      8.459      6077878 
    L88HD1-I89N-H      0.787    126.070      8.457      3674091 
         I89H-N-H      8.455    126.091      8.458     53984968 
I89HG13/I89HG2-N/I89N-H/I89H      0.687    126.092      8.459      3774553 
     L88HA-I89N-H      4.320    126.093      8.460     19423376 
        I89HA-N-H      4.081    126.103      8.458      3227386 
        L88HA-N-H      4.334    127.517      8.399      8418643 
   I87HG12-L88N-H      1.040    127.545      8.397      1273923 
        L88QB-N-H      1.475    127.549      8.398     17489540 
     I87HA-L88N-H      4.410    127.550      8.399     21326078 
         L88H-N-H      8.396    127.554      8.398     70972824 
L88HD2/I87HG2-N/L88N-H/L88H      0.769    127.566      8.397      4465136 
        K90QB-N-H      1.644    128.831      8.996      2009034 
      N91H-K90N-H      7.860    128.853      8.991       685799 
        K90HA-N-H      3.951    128.853      8.995      1052362 
     I89HA-K90N-H      4.086    128.867      9.006      2191548 
        K90QG-N-H      1.371    128.954      8.998       714876 
K39HE2-W77NE1-HE1      1.794    129.547     10.236       900442 
K73HB2-W77NE1-HE1      0.762    129.593     10.241       670396 
K39HE3-W77NE1-HE1      0.993    129.599     10.242       798296 
K73HB3-W77NE1-HE1      1.535    129.619     10.238       655500 
   W77HD1-NE1-HE1      7.128    129.620     10.243      8767858 
 V74HA-W77NE1-HE1      3.046    129.620     10.243       875177 
   W77HE1-NE1-HE1     10.246    129.624     10.244     77135552 
    W77HA-NE1-HE1      4.636    129.629     10.244      1634461 
   W77HZ2-NE1-HE1      7.366    129.629     10.245      5033690 
K73HD3-W77NE1-HE1      1.641    129.645     10.249       760359 
 K73HA-W77NE1-HE1      3.545    129.680     10.248       670048 
  G21H-W66NE1-HE1      8.858    130.025     10.657       611609 
G21HA3-W66NE1-HE1      3.714    130.036     10.658      1648810 
G21HA2-W66NE1-HE1      4.191    130.039     10.658      2560496 
   W66HZ2-NE1-HE1      7.301    130.040     10.659      3932460 
   W66HE1-NE1-HE1     10.657    130.041     10.658     64959320 
E64HB3-W66NE1-HE1      1.284    130.047     10.659      4129585 
   W66HD1-NE1-HE1      6.939    130.048     10.660      7567844 
E64HB2-W66NE1-HE1      2.248    130.049     10.658      7640598 
  E64H-W66NE1-HE1      8.043    130.064     10.660       966247 
    W66HA-NE1-HE1      4.556    130.070     10.657       751285 
;

   loop_
      _Spectral_dim.ID
      _Spectral_dim.Atom_type
      _Spectral_dim.Atom_isotope_number
      _Spectral_dim.Spectral_region
      _Spectral_dim.Magnetization_linkage_ID
      _Spectral_dim.Sweep_width
      _Spectral_dim.Sweep_width_units
      _Spectral_dim.Encoding_code
      _Spectral_dim.Encoded_reduced_dimension_ID
      _Spectral_dim.Entry_ID
      _Spectral_dim.Spectral_peak_list_ID

      1 H 1 'all H's'                   .  8993.233 . . . 15089 3 
      2 C 1 'all N's'                   .  2278.423 . . . 15089 3 
      3 H 1 'amide H's side chain NH's' . 13522.650 . . . 15089 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

      4 $SPARKY . . 15089 3 

   stop_

save_