data_16962

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

save_entry_information
   _Saveframe_category      entry_information

   _Entry_title            
;
1J and 2J coupling constants in human oxidized ERp18
;
   _BMRB_accession_number   16962
   _BMRB_flat_file_name     bmr16962.str
   _Entry_type              original
   _Submission_date         2010-05-27
   _Accession_date          2010-05-27
   _Entry_origination       author
   _NMR_STAR_version        2.1.1
   _Experimental_method     NMR
   _Details                 .

   loop_
      _Author_ordinal
      _Author_family_name
      _Author_given_name
      _Author_middle_initials
      _Author_family_title

      1 Schmidt Jurgen M. . 
      2 Lohr    Frank  .  . 

   stop_

   loop_
      _Saveframe_category_type
      _Saveframe_category_type_count

      coupling_constants 10 

   stop_

   loop_
      _Data_type
      _Data_type_count

      "coupling constants" 1268 

   stop_

   loop_
      _Revision_date
      _Revision_keyword
      _Revision_author
      _Revision_detail

      2011-01-19 original author . 

   stop_

   loop_
      _Related_BMRB_accession_number
      _Relationship

      15904 '1J coupling constants related to the Ca carbons in oxidized Flavodxin'         
      15905 '1J coupling constants related to the Ca carbons in Ribonuclease T1'            
      15906 '1J coupling constants related to the Ca carbons in Frataxin C-terminal domain' 
      15907 '1J coupling constants related to the Ca carbons in Ubiquitin'                  
      15908 '1J coupling constants related to the Ca carbons in Xylanase'                   
      15909 '1J coupling constants related to the Ca carbons in DFPase'                     
      15964 'chemical shift assignments oxidized ERp18'                                     
      16579 '2J coupling constants in oxidized Flavodoxin'                                  
      16580 '2J coupling constants in Ribonuclease T1'                                      
      16581 '2J coupling constants in Frataxin C-terminal domain'                           
      16582 '2J coupling constants in Ubiquitin'                                            
      16583 '2J coupling constants in Xylanase'                                             
      16584 '2J coupling constants in DFPase'                                               

   stop_

   _Original_release_date   2011-01-19

save_


#############################
#  Citation for this entry  #
#############################

save_entry_citation
   _Saveframe_category           entry_citation

   _Citation_full                .
   _Citation_title              'One-bond and two-bond j couplings help annotate protein secondary-structure motifs: J-coupling indexing applied to human endoplasmic reticulum protein ERp18.'
   _Citation_status              published
   _Citation_type                journal
   _CAS_abstract_code            .
   _MEDLINE_UI_code              .
   _PubMed_ID                    21117079

   loop_
      _Author_ordinal
      _Author_family_name
      _Author_given_name
      _Author_middle_initials
      _Author_family_title

      1 Schmidt    Jurgen   M. . 
      2 Zhou       Shen     .  . 
      3 Rowe       Michelle L. . 
      4 Howard     Mark     J. . 
      5 Williamson Richard  A. . 
      6 Lohr       Frank    .  . 

   stop_

   _Journal_abbreviation         Proteins
   _Journal_name_full           'Proteins: Structure, Function, and Bioinformatics'
   _Journal_volume               79
   _Journal_issue                2
   _Journal_CSD                  .
   _Book_chapter_title           .
   _Book_volume                  .
   _Book_series                  .
   _Book_ISBN                    .
   _Conference_state_province    .
   _Conference_abstract_number   .
   _Page_first                   428
   _Page_last                    443
   _Year                         2011
   _Details                      .

   loop_
      _Keyword

      'data mining'         
      'J-coupling index'    
      'one-bond coupling'   
      'secondary structure' 
       statistics           
      'two-bond coupling'   

   stop_

save_


#######################################
#  Cited references within the entry  #
#######################################

save_Ottiger_et_al_1998
   _Saveframe_category           citation

   _Citation_full                .
   _Citation_title              'Measurement of J and dipolar couplings from simplified two-dimensional NMR spectra'
   _Citation_status              published
   _Citation_type                journal
   _CAS_abstract_code            .
   _MEDLINE_UI_code              .
   _PubMed_ID                    9571116

   loop_
      _Author_ordinal
      _Author_family_name
      _Author_given_name
      _Author_middle_initials
      _Author_family_title

      1 Ottiger  M. . . 
      2 Delaglio F. . . 
      3 Bax      A. . . 

   stop_

   _Journal_abbreviation        'J. Magn. Reson.'
   _Journal_name_full            .
   _Journal_volume               131
   _Journal_issue                .
   _Journal_CSD                  .
   _Book_title                   .
   _Book_chapter_title           .
   _Book_volume                  .
   _Book_series                  .
   _Book_publisher               .
   _Book_publisher_city          .
   _Book_ISBN                    .
   _Conference_title             .
   _Conference_site              .
   _Conference_state_province    .
   _Conference_country           .
   _Conference_start_date        .
   _Conference_end_date          .
   _Conference_abstract_number   .
   _Thesis_institution           .
   _Thesis_institution_city      .
   _Thesis_institution_country   .
   _Page_first                   373
   _Page_last                    378
   _Year                         1998
   _Details                      .

save_


save_Permi_et_al_1999
   _Saveframe_category           citation

   _Citation_full                .
   _Citation_title              'Measurement of 1JNCO and 2JHNCO couplings from spin-state-selective two-dimensional correlation spectrum'
   _Citation_status              published
   _Citation_type                journal
   _CAS_abstract_code            .
   _MEDLINE_UI_code              .
   _PubMed_ID                    10479547

   loop_
      _Author_ordinal
      _Author_family_name
      _Author_given_name
      _Author_middle_initials
      _Author_family_title

      1 Permi       P. . . 
      2 Heikkinen   S. . . 
      3 Kilpelainen I. . . 
      4 Annila      A. . . 

   stop_

   _Journal_abbreviation        'J. Magn. Reson.'
   _Journal_name_full            .
   _Journal_volume               140
   _Journal_issue                .
   _Journal_CSD                  .
   _Book_title                   .
   _Book_chapter_title           .
   _Book_volume                  .
   _Book_series                  .
   _Book_publisher               .
   _Book_publisher_city          .
   _Book_ISBN                    .
   _Conference_title             .
   _Conference_site              .
   _Conference_state_province    .
   _Conference_country           .
   _Conference_start_date        .
   _Conference_end_date          .
   _Conference_abstract_number   .
   _Thesis_institution           .
   _Thesis_institution_city      .
   _Thesis_institution_country   .
   _Page_first                   32
   _Page_last                    40
   _Year                         1999
   _Details                      .

save_


save_Yang_et_al_1999
   _Saveframe_category           citation

   _Citation_full                .
   _Citation_title              'TROSY-based HNCO pulse sequence for the measurement of 1HN-15N, 15N-13CO, 1HN-13CO, 13CO-13Ca and 1HN-13Ca dipolar couplings in 15N, 13C, 2H-labeled proteins'
   _Citation_status              published
   _Citation_type                journal
   _CAS_abstract_code            .
   _MEDLINE_UI_code              .
   _PubMed_ID                    ?

   loop_
      _Author_ordinal
      _Author_family_name
      _Author_given_name
      _Author_middle_initials
      _Author_family_title

      1 Yang    D. .  . 
      2 Venters R. A. . 
      3 Mueller G. A. . 
      4 Choi    W. Y. . 
      5 Kay     L. E. . 

   stop_

   _Journal_abbreviation        'J. Biomol. NMR'
   _Journal_name_full            .
   _Journal_volume               14
   _Journal_issue                .
   _Journal_CSD                  .
   _Book_title                   .
   _Book_chapter_title           .
   _Book_volume                  .
   _Book_series                  .
   _Book_publisher               .
   _Book_publisher_city          .
   _Book_ISBN                    .
   _Conference_title             .
   _Conference_site              .
   _Conference_state_province    .
   _Conference_country           .
   _Conference_start_date        .
   _Conference_end_date          .
   _Conference_abstract_number   .
   _Thesis_institution           .
   _Thesis_institution_city      .
   _Thesis_institution_country   .
   _Page_first                   333
   _Page_last                    343
   _Year                         1999
   _Details                      .

save_


save_Cornilescu_et_al_2000
   _Saveframe_category           citation

   _Citation_full                .
   _Citation_title              'Large variations in one-bond 13Ca-13Cb J couplings in polypeptides correlate with backbone conformation'
   _Citation_status              published
   _Citation_type                journal
   _CAS_abstract_code            .
   _MEDLINE_UI_code              .
   _PubMed_ID                    ?

   loop_
      _Author_ordinal
      _Author_family_name
      _Author_given_name
      _Author_middle_initials
      _Author_family_title

      1 Cornilescu G. .  . 
      2 Bax        A. M. . 
      3 Case       D. A. . 

   stop_

   _Journal_abbreviation        'J. Am. Chem. Soc.'
   _Journal_name_full            .
   _Journal_volume               122
   _Journal_issue                .
   _Journal_CSD                  .
   _Book_title                   .
   _Book_chapter_title           .
   _Book_volume                  .
   _Book_series                  .
   _Book_publisher               .
   _Book_publisher_city          .
   _Book_ISBN                    .
   _Conference_title             .
   _Conference_site              .
   _Conference_state_province    .
   _Conference_country           .
   _Conference_start_date        .
   _Conference_end_date          .
   _Conference_abstract_number   .
   _Thesis_institution           .
   _Thesis_institution_city      .
   _Thesis_institution_country   .
   _Page_first                   2168
   _Page_last                    2171
   _Year                         2000
   _Details                      .

save_


save_Permi_&_Annila_2000
   _Saveframe_category           citation

   _Citation_full                .
   _Citation_title              'Transverse relaxation optimised spin-state selective NMR experiments for measurement of residual dipolar couplings'
   _Citation_status              published
   _Citation_type                journal
   _CAS_abstract_code            .
   _MEDLINE_UI_code              .
   _PubMed_ID                    10805128

   loop_
      _Author_ordinal
      _Author_family_name
      _Author_given_name
      _Author_middle_initials
      _Author_family_title

      1 Permi  P. . . 
      2 Annila A. . . 

   stop_

   _Journal_abbreviation        'J. Biomol. NMR'
   _Journal_name_full            .
   _Journal_volume               16
   _Journal_issue                .
   _Journal_CSD                  .
   _Book_title                   .
   _Book_chapter_title           .
   _Book_volume                  .
   _Book_series                  .
   _Book_publisher               .
   _Book_publisher_city          .
   _Book_ISBN                    .
   _Conference_title             .
   _Conference_site              .
   _Conference_state_province    .
   _Conference_country           .
   _Conference_start_date        .
   _Conference_end_date          .
   _Conference_abstract_number   .
   _Thesis_institution           .
   _Thesis_institution_city      .
   _Thesis_institution_country   .
   _Page_first                   221
   _Page_last                    227
   _Year                         2000
   _Details                      .

save_


save_Hu_et_al_2003
   _Saveframe_category           citation

   _Citation_full                .
   _Citation_title              'A high sensitivity 3D experiment for measuring Calpha-Halpha residual dipolar coupling constants'
   _Citation_status              published
   _Citation_type                journal
   _CAS_abstract_code            .
   _MEDLINE_UI_code              .
   _PubMed_ID                    ?

   loop_
      _Author_ordinal
      _Author_family_name
      _Author_given_name
      _Author_middle_initials
      _Author_family_title

      1 Hu    W. . . 
      2 Zhang Z. . . 
      3 Chen  Y. . . 

   stop_

   _Journal_abbreviation        'J. Magn. Reson.'
   _Journal_name_full            .
   _Journal_volume               165
   _Journal_issue                .
   _Journal_CSD                  .
   _Book_title                   .
   _Book_chapter_title           .
   _Book_volume                  .
   _Book_series                  .
   _Book_publisher               .
   _Book_publisher_city          .
   _Book_ISBN                    .
   _Conference_title             .
   _Conference_site              .
   _Conference_state_province    .
   _Conference_country           .
   _Conference_start_date        .
   _Conference_end_date          .
   _Conference_abstract_number   .
   _Thesis_institution           .
   _Thesis_institution_city      .
   _Thesis_institution_country   .
   _Page_first                   248
   _Page_last                    252
   _Year                         2003
   _Details                      .

save_


save_Ball_et_al_2006
   _Saveframe_category           citation

   _Citation_full                .
   _Citation_title              'Measurement of one-bond 13Ca-1Ha residual dipolar coupling constants in proteins by selective manipulation of CaHa spins'
   _Citation_status              published
   _Citation_type                journal
   _CAS_abstract_code            .
   _MEDLINE_UI_code              .
   _PubMed_ID                    16495100

   loop_
      _Author_ordinal
      _Author_family_name
      _Author_given_name
      _Author_middle_initials
      _Author_family_title

      1 Ball   G. .  . 
      2 Meenan N. .  . 
      3 Bromek K. .  . 
      4 Smith  B. O. . 
      5 Bella  J. .  . 
      6 Uhrin  D. .  . 

   stop_

   _Journal_abbreviation        'J. Magn. Reson.'
   _Journal_name_full            .
   _Journal_volume               180
   _Journal_issue                .
   _Journal_CSD                  .
   _Book_title                   .
   _Book_chapter_title           .
   _Book_volume                  .
   _Book_series                  .
   _Book_publisher               .
   _Book_publisher_city          .
   _Book_ISBN                    .
   _Conference_title             .
   _Conference_site              .
   _Conference_state_province    .
   _Conference_country           .
   _Conference_start_date        .
   _Conference_end_date          .
   _Conference_abstract_number   .
   _Thesis_institution           .
   _Thesis_institution_city      .
   _Thesis_institution_country   .
   _Page_first                   127
   _Page_last                    136
   _Year                         2006
   _Details                      .

save_


save_Nolis_et_al_2006
   _Saveframe_category           citation

   _Citation_full                .
   _Citation_title              'Optimum spin-state selection for all multiplicities in the acquisition dimension of the HSQC experiment'
   _Citation_status             'in preparation'
   _Citation_type                journal
   _CAS_abstract_code            .
   _MEDLINE_UI_code              .
   _PubMed_ID                    16448830

   loop_
      _Author_ordinal
      _Author_family_name
      _Author_given_name
      _Author_middle_initials
      _Author_family_title

      1 Nolis    P. .  . 
      2 Espinosa J. F. . 
      3 Parella  T. .  . 

   stop_

   _Journal_abbreviation        'J. Magn. Reson.'
   _Journal_name_full            .
   _Journal_volume               180
   _Journal_issue                .
   _Journal_CSD                  .
   _Book_title                   .
   _Book_chapter_title           .
   _Book_volume                  .
   _Book_series                  .
   _Book_publisher               .
   _Book_publisher_city          .
   _Book_ISBN                    .
   _Conference_title             .
   _Conference_site              .
   _Conference_state_province    .
   _Conference_country           .
   _Conference_start_date        .
   _Conference_end_date          .
   _Conference_abstract_number   .
   _Thesis_institution           .
   _Thesis_institution_city      .
   _Thesis_institution_country   .
   _Page_first                   39
   _Page_last                    50
   _Year                         2006
   _Details                      .

save_


##################################
#  Molecular system description  #
##################################

save_assembly
   _Saveframe_category         molecular_system

   _Mol_system_name            ERp18
   _Enzyme_commission_number   .

   loop_
      _Mol_system_component_name
      _Mol_label

      ERp1 $ERp18 

   stop_

   _System_molecular_weight    17774
   _System_physical_state      native
   _System_oligomer_state      ?
   _System_paramagnetic        no
   _System_thiol_state         .

   loop_
      _Biological_function

      oxidoreductase 

   stop_

   _Database_query_date        .
   _Details                    .

save_


    ########################
    #  Monomeric polymers  #
    ########################

save_ERp18
   _Saveframe_category                          monomeric_polymer

   _Mol_type                                    polymer
   _Mol_polymer_class                           protein
   _Name_common                                 ERp18
   _Molecular_mass                              17774
   _Mol_thiol_state                            'all disulfide bound'

   loop_
      _Biological_function

       oxidoreductase    
      'thioredoxin like' 

   stop_

   _Details                                     .

   	##############################
   	#  Polymer residue sequence  #
   	##############################
   
      _Residue_count                               157
   _Mol_residue_sequence                       
;
MHHHHHHMSDGHNGLGKGFG
DHIHWRTLEDGKKEAAASGL
PLMVIIHKSWCGACKALKPK
FAESTEISELSHNFVMVNLE
DEEEPKDEDFSPDGGYIPRI
LFLDPSGKVHPEIINENGNP
SYKYFYVSAEQVVQGMKEAQ
ERLTGDAFRKKHLEDEL
;

   loop_
      _Residue_seq_code
      _Residue_author_seq_code
      _Residue_label

        1  16 MET    2  17 HIS    3  18 HIS    4  19 HIS    5  20 HIS 
        6  21 HIS    7  22 HIS    8  23 MET    9  24 SER   10  25 ASP 
       11  26 GLY   12  27 HIS   13  28 ASN   14  29 GLY   15  30 LEU 
       16  31 GLY   17  32 LYS   18  33 GLY   19  34 PHE   20  35 GLY 
       21  36 ASP   22  37 HIS   23  38 ILE   24  39 HIS   25  40 TRP 
       26  41 ARG   27  42 THR   28  43 LEU   29  44 GLU   30  45 ASP 
       31  46 GLY   32  47 LYS   33  48 LYS   34  49 GLU   35  50 ALA 
       36  51 ALA   37  52 ALA   38  53 SER   39  54 GLY   40  55 LEU 
       41  56 PRO   42  57 LEU   43  58 MET   44  59 VAL   45  60 ILE 
       46  61 ILE   47  62 HIS   48  63 LYS   49  64 SER   50  65 TRP 
       51  66 CYS   52  67 GLY   53  68 ALA   54  69 CYS   55  70 LYS 
       56  71 ALA   57  72 LEU   58  73 LYS   59  74 PRO   60  75 LYS 
       61  76 PHE   62  77 ALA   63  78 GLU   64  79 SER   65  80 THR 
       66  81 GLU   67  82 ILE   68  83 SER   69  84 GLU   70  85 LEU 
       71  86 SER   72  87 HIS   73  88 ASN   74  89 PHE   75  90 VAL 
       76  91 MET   77  92 VAL   78  93 ASN   79  94 LEU   80  95 GLU 
       81  96 ASP   82  97 GLU   83  98 GLU   84  99 GLU   85 100 PRO 
       86 101 LYS   87 102 ASP   88 103 GLU   89 104 ASP   90 105 PHE 
       91 106 SER   92 107 PRO   93 108 ASP   94 109 GLY   95 110 GLY 
       96 111 TYR   97 112 ILE   98 113 PRO   99 114 ARG  100 115 ILE 
      101 116 LEU  102 117 PHE  103 118 LEU  104 119 ASP  105 120 PRO 
      106 121 SER  107 122 GLY  108 123 LYS  109 124 VAL  110 125 HIS 
      111 126 PRO  112 127 GLU  113 128 ILE  114 129 ILE  115 130 ASN 
      116 131 GLU  117 132 ASN  118 133 GLY  119 134 ASN  120 135 PRO 
      121 136 SER  122 137 TYR  123 138 LYS  124 139 TYR  125 140 PHE 
      126 141 TYR  127 142 VAL  128 143 SER  129 144 ALA  130 145 GLU 
      131 146 GLN  132 147 VAL  133 148 VAL  134 149 GLN  135 150 GLY 
      136 151 MET  137 152 LYS  138 153 GLU  139 154 ALA  140 155 GLN 
      141 156 GLU  142 157 ARG  143 158 LEU  144 159 THR  145 160 GLY 
      146 161 ASP  147 162 ALA  148 163 PHE  149 164 ARG  150 165 LYS 
      151 166 LYS  152 167 HIS  153 168 LEU  154 169 GLU  155 170 ASP 
      156 171 GLU  157 172 LEU 

   stop_

   _Sequence_homology_query_date                .
   _Sequence_homology_query_revised_last_date   2015-02-26

   loop_
      _Database_name
      _Database_accession_code
      _Database_entry_mol_name
      _Sequence_query_to_submitted_percentage
      _Sequence_subject_length
      _Sequence_identity
      _Sequence_positive
      _Sequence_homology_expectation_value

      BMRB        15964  ERp18                                                                                                                            100.00 157 100.00 100.00 1.83e-111 
      PDB  2K8V          "Solution Structure Of Oxidised Erp18"                                                                                            100.00 157 100.00 100.00 1.83e-111 
      DBJ  BAG52132      "unnamed protein product [Homo sapiens]"                                                                                           94.90 172 100.00 100.00 8.94e-105 
      GB   AAD20035      "Unknown [Homo sapiens]"                                                                                                           94.90 172 100.00 100.00 8.94e-105 
      GB   AAH01493      "Thioredoxin domain containing 12 (endoplasmic reticulum) [Homo sapiens]"                                                          94.90 172 100.00 100.00 8.94e-105 
      GB   AAH08913      "Thioredoxin domain containing 12 (endoplasmic reticulum) [Homo sapiens]"                                                          94.90 172  99.33  99.33 2.12e-103 
      GB   AAH08953      "Thioredoxin domain containing 12 (endoplasmic reticulum) [Homo sapiens]"                                                          94.90 172 100.00 100.00 8.94e-105 
      GB   AAN34781      "thioredoxin-like protein p19 [Homo sapiens]"                                                                                      94.90 172 100.00 100.00 8.94e-105 
      REF  NP_001253090  "thioredoxin domain containing 12 (endoplasmic reticulum) precursor [Macaca mulatta]"                                              94.90 172  99.33 100.00 1.45e-104 
      REF  NP_056997     "thioredoxin domain-containing protein 12 precursor [Homo sapiens]"                                                                94.90 172 100.00 100.00 8.94e-105 
      REF  XP_001110583  "PREDICTED: thioredoxin domain-containing protein 12 [Macaca mulatta]"                                                             94.90 208  98.66 100.00 1.30e-103 
      REF  XP_002915769  "PREDICTED: thioredoxin domain-containing protein 12 isoform X1 [Ailuropoda melanoleuca]"                                          94.90 172  97.32  99.33 2.56e-102 
      REF  XP_003364421  "PREDICTED: thioredoxin domain-containing protein 12-like isoform X1 [Equus caballus]"                                             94.90 172  97.99  99.33 8.78e-103 
      SP   O95881        "RecName: Full=Thioredoxin domain-containing protein 12; AltName: Full=Endoplasmic reticulum resident protein 18; Short=ER prote"  94.90 172 100.00 100.00 8.94e-105 

   stop_

save_


    ####################
    #  Natural source  #
    ####################

save_natural_source
   _Saveframe_category   natural_source


   loop_
      _Mol_label
      _Organism_name_common
      _NCBI_taxonomy_ID
      _Superkingdom
      _Kingdom
      _Genus
      _Species

      $ERp18 Human 9606 Eukaryota Metazoa Homo sapiens 

   stop_

save_


    #########################
    #  Experimental source  #
    #########################

save_experimental_source
   _Saveframe_category   experimental_source


   loop_
      _Mol_label
      _Production_method
      _Host_organism_name_common
      _Genus
      _Species
      _Strain
      _Vector_name
      _Details

      $ERp18 'recombinant technology' . Escherichia coli 'BL21(DE3) pLysS' pHIA128 'N-terminal His-tag' 

   stop_

save_


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

save_doubly_labeled
   _Saveframe_category   sample

   _Sample_type          solution
   _Details              .

   loop_
      _Mol_label
      _Concentration_value
      _Concentration_value_units
      _Isotopic_labeling

      $ERp18               0.7 mM '[U-95% 13C; U-95% 15N]' 
      'sodium phosphate'  20   mM 'natural abundance'      
      'sodium chloride'  100   mM 'natural abundance'      
       D2O                10   %  '[U-99% 2H]'             
       H2O                90   %  'natural abundance'      

   stop_

save_


save_singly_labeled
   _Saveframe_category   sample

   _Sample_type          solution
   _Details              .

   loop_
      _Mol_label
      _Concentration_value
      _Concentration_value_units
      _Isotopic_labeling

      $ERp18               1.0 mM '[U-95% 15N]'       
      'sodium phosphate'  20   mM 'natural abundance' 
      'sodium chloride'  100   mM 'natural abundance' 
       D2O                10   %  '[U-99% 2H]'        
       H2O                90   %  'natural abundance' 

   stop_

save_


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

save_TOPSPIN
   _Saveframe_category   software

   _Name                 TOPSPIN
   _Version              .

   loop_
      _Vendor
      _Address
      _Electronic_address

      'Bruker Biospin' . . 

   stop_

   loop_
      _Task

      collection 
      processing 

   stop_

   _Details              .

save_


save_jeval
   _Saveframe_category   software

   _Name                 jeval
   _Version              .

   loop_
      _Vendor
      _Address
      _Electronic_address

      'JM Schmidt' 'Dept. of Biosciences, University of Kent, Canterbury, Kent CT2 7NJ, United Kingdom' j.m.schmidt@kent.ac.uk 

   stop_

   loop_
      _Task

      'coupling constant extraction' 
      'data analysis'                
      'multiplet simulation'         

   stop_

   _Details             'Matlab-based suite of utilities for the display, selection, and simulation of 2D multiplet projections from multi-dimensional NMR spectra'

save_


#########################
#  Experimental detail  #
#########################

    ##################################
    #  NMR Spectrometer definitions  #
    ##################################

save_spectrometer_1
   _Saveframe_category   NMR_spectrometer

   _Manufacturer         Bruker
   _Model                DRX
   _Field_strength       500
   _Details             'room-temperature 1H{13C,15N}-triple-resonance three-axis PFG probe'

save_


save_spectrometer_2
   _Saveframe_category   NMR_spectrometer

   _Manufacturer         Bruker
   _Model                Avance
   _Field_strength       500
   _Details             'room-temperature 1H{13C,15N}-triple-resonance three-axis PFG probe'

save_


save_spectrometer_3
   _Saveframe_category   NMR_spectrometer

   _Manufacturer         Bruker
   _Model                DRX
   _Field_strength       600
   _Details             'cryogenically cooled 1H{13C,15N}-triple-resonance z-gradient probe'

save_


save_spectrometer_4
   _Saveframe_category   NMR_spectrometer

   _Manufacturer         Bruker
   _Model                Avance
   _Field_strength       700
   _Details             'cryogenically cooled 1H{13C,15N}-triple-resonance z-gradient probe'

save_


save_spectrometer_5
   _Saveframe_category   NMR_spectrometer

   _Manufacturer         Bruker
   _Model                Avance
   _Field_strength       800
   _Details             'cryogenically cooled 1H{13C,15N}-triple-resonance z-gradient probe'

save_


save_spectrometer_6
   _Saveframe_category   NMR_spectrometer

   _Manufacturer         Bruker
   _Model                Avance
   _Field_strength       900
   _Details             'cryogenically cooled 1H{13C,15N}-triple-resonance z-gradient probe'

save_


    #############################
    #  NMR applied experiments  #
    #############################

save_3D_Ca-coupled_[15N,1H]-TROSY-HNCO_1
   _Saveframe_category   NMR_applied_experiment

   _Experiment_name     '3D Ca-coupled [15N,1H]-TROSY-HNCO'
   _Sample_label        $doubly_labeled

save_


save_3D_[1Ha,13Ca]-multiple-quantum_HCAN_quantitative_J-correlation_2
   _Saveframe_category   NMR_applied_experiment

   _Experiment_name     '3D [1Ha,13Ca]-multiple-quantum HCAN quantitative J-correlation'
   _Sample_label        $doubly_labeled

save_


save_3D_Cb-coupled_[15N,1H]-TROSY-HN(CO)CA_3
   _Saveframe_category   NMR_applied_experiment

   _Experiment_name     '3D Cb-coupled [15N,1H]-TROSY-HN(CO)CA'
   _Sample_label        $doubly_labeled

save_


save_3D_Ca-coupled_H(CACO)NH_4
   _Saveframe_category   NMR_applied_experiment

   _Experiment_name     '3D Ca-coupled H(CACO)NH'
   _Sample_label        $doubly_labeled

save_


save_3D_Ha-coupled_[15N,1H]-TROSY-H(N)COCA_5
   _Saveframe_category   NMR_applied_experiment

   _Experiment_name     '3D Ha-coupled [15N,1H]-TROSY-H(N)COCA'
   _Sample_label        $doubly_labeled

save_


save_3D_Ha-coupled_[15N,1H]-TROSY-HN(CO)CA_6
   _Saveframe_category   NMR_applied_experiment

   _Experiment_name     '3D Ha-coupled [15N,1H]-TROSY-HN(CO)CA'
   _Sample_label        $doubly_labeled

save_


save_2D_ct-[13C,1H]-IPAP-HSQC_7
   _Saveframe_category   NMR_applied_experiment

   _Experiment_name     '2D ct-[13C,1H]-IPAP-HSQC'
   _Sample_label        $doubly_labeled

save_


save_2D_IPAP-type_HN(CO-a/b-NCa-J)-TROSY_8
   _Saveframe_category   NMR_applied_experiment

   _Experiment_name     '2D IPAP-type HN(CO-a/b-NCa-J)-TROSY'
   _Sample_label        $doubly_labeled

save_


save_2D_IPAP-type_HN(a/b-NCO-J)-TROSY_9
   _Saveframe_category   NMR_applied_experiment

   _Experiment_name     '2D IPAP-type HN(a/b-NCO-J)-TROSY'
   _Sample_label        $doubly_labeled

save_


save_2D_[15N,1H]-IPAP-HSQC_10
   _Saveframe_category   NMR_applied_experiment

   _Experiment_name     '2D [15N,1H]-IPAP-HSQC'
   _Sample_label        $singly_labeled

save_


save_3D_Ca-coupled_15N_1H-TROSY-HNCO
   _Saveframe_category                     NMR_applied_experiment

   _Experiment_name                       '3D Ca-coupled [15N,1H]-TROSY-HNCO'
   _BMRB_pulse_sequence_accession_number   .
   _Details                               
;
1JCACO measurement;  
Yang et al., 1999
;

save_


save_3D_Cb-coupled_15N_1H-TROSY-HN_CO_CA
   _Saveframe_category                     NMR_applied_experiment

   _Experiment_name                       '3D Cb-coupled [15N,1H]-TROSY-HN(CO)CA'
   _BMRB_pulse_sequence_accession_number   .
   _Details                               
;
1JCACB measurement;  
Cornilescu et al., 2000
;

save_


save_3D_1Ha_13Ca-multiple-quantum_HCAN_quantitative_J-correlation
   _Saveframe_category                     NMR_applied_experiment

   _Experiment_name                       '3D [1Ha,13Ca]-multiple-quantum HCAN quantitative J-correlation'
   _BMRB_pulse_sequence_accession_number   .
   _Details                               
;
1JCAN measurement in proline;   
F. Lohr, unpublished
;

save_


save_3D_Ca-coupled_H_CACO_NH
   _Saveframe_category                     NMR_applied_experiment

   _Experiment_name                        3D_Ca-coupled_H(CACO)NH
   _BMRB_pulse_sequence_accession_number   .
   _Details                               
;
1JCAHA measurement;  
Hu et al., 2003;  
Ball et al., 2006
;

save_


save_3D_Ha-coupled_15N_1H-TROSY-H_N_COCA
   _Saveframe_category                     NMR_applied_experiment

   _Experiment_name                        3D_Ha-coupled_[15N,1H]-TROSY-H(N)COCA
   _BMRB_pulse_sequence_accession_number   .
   _Details                               
;
2JHACO measurement;  
F. Lohr, unpublished
;

save_


save_3D_Ha-coupled_ct-15N_1H-TROSY-HN_CO_CA
   _Saveframe_category                     NMR_applied_experiment

   _Experiment_name                        3D_Ha-coupled_ct-[15N,1H]-TROSY-HN(CO)CA
   _BMRB_pulse_sequence_accession_number   .
   _Details                               
;
1JCAHA measurement;  
14-ms 13Ca evolution
;

save_


save_2D_ct-13C_1H-IPAP-HSQC
   _Saveframe_category                     NMR_applied_experiment

   _Experiment_name                        2D_ct-[13C,1H]-IPAP-HSQC
   _BMRB_pulse_sequence_accession_number   .
   _Details                               
;
1JCaHa measurement;  
Nolis et al., 2006
;

save_


save_2D_IPAP-type_HN_CO-a_b-NCa-J-TROSY
   _Saveframe_category                     NMR_applied_experiment

   _Experiment_name                        2D_IPAP-type_HN(CO-a/b-NCa-J)-TROSY
   _BMRB_pulse_sequence_accession_number   .
   _Details                               
;
1JNCa and 2JCaN and 2JHNCa measurement;  
128-ms 15N acquisition time;  
Permi & Annila, 2000
;

save_


save_2D_IPAP-type_HN_a_b-NCO-J-TROSY
   _Saveframe_category                     NMR_applied_experiment

   _Experiment_name                        2D_IPAP-type_HN(a/b-NCO-J)-TROSY
   _BMRB_pulse_sequence_accession_number   .
   _Details                               
;
1JCON and 2JCOHN measurement;  
120-ms 15N acquisition time;  
Permi et al., 1999
;

save_


save_2D_15N_1H-IPAP-HSQC
   _Saveframe_category                     NMR_applied_experiment

   _Experiment_name                        2D_[15N,1H]-IPAP-HSQC
   _BMRB_pulse_sequence_accession_number   .
   _Details                               
;
1JNHN measurement;   
Ottiger et al., 1998
;

save_


#######################
#  Sample conditions  #
#######################

save_sample_conditions_1
   _Saveframe_category   sample_conditions

   _Details              .

   loop_
      _Variable_type
      _Variable_value
      _Variable_value_error
      _Variable_value_units

      pH            6.5 . pH  
      pressure      1   . atm 
      temperature 303   . K   

   stop_

save_


    ########################
    #  Coupling constants  #
    ########################

save_1JCaCO
   _Saveframe_category          coupling_constants

   _Details                     .

   loop_
      _Experiment_label

      '3D Ca-coupled [15N,1H]-TROSY-HNCO' 

   stop_

   _Sample_conditions_label    $sample_conditions_1
   _Spectrometer_frequency_1H   500
   _Mol_system_component_name   ERp1
   _Text_data_format            .
   _Text_data                   .

   loop_
      _Coupling_constant_ID
      _Coupling_constant_code
      _Atom_one_residue_seq_code
      _Atom_one_residue_label
      _Atom_one_name
      _Atom_two_residue_seq_code
      _Atom_two_residue_label
      _Atom_two_name
      _Coupling_constant_value
      _Coupling_constant_min_value
      _Coupling_constant_max_value
      _Coupling_constant_value_error

        1 1JCACO   7 HIS CA   7 HIS C 53.19 . . 0.50 
        2 1JCACO   8 MET CA   8 MET C 51.08 . . 0.50 
        3 1JCACO   9 SER CA   9 SER C 52.71 . . 0.50 
        4 1JCACO  10 ASP CA  10 ASP C 52.10 . . 0.50 
        5 1JCACO  12 HIS CA  12 HIS C 50.85 . . 0.50 
        6 1JCACO  13 ASN CA  13 ASN C 52.68 . . 0.50 
        7 1JCACO  14 GLY CA  14 GLY C 52.44 . . 0.50 
        8 1JCACO  15 LEU CA  15 LEU C 53.26 . . 0.50 
        9 1JCACO  16 GLY CA  16 GLY C 51.26 . . 0.50 
       10 1JCACO  17 LYS CA  17 LYS C 53.84 . . 0.50 
       11 1JCACO  18 GLY CA  18 GLY C 51.30 . . 0.50 
       12 1JCACO  19 PHE CA  19 PHE C 52.33 . . 0.50 
       13 1JCACO  20 GLY CA  20 GLY C 54.74 . . 0.50 
       14 1JCACO  21 ASP CA  21 ASP C 52.72 . . 0.50 
       15 1JCACO  22 HIS CA  22 HIS C 52.20 . . 0.50 
       16 1JCACO  23 ILE CA  23 ILE C 52.37 . . 0.50 
       17 1JCACO  24 HIS CA  24 HIS C 52.15 . . 0.50 
       18 1JCACO  25 TRP CA  25 TRP C 51.82 . . 0.50 
       19 1JCACO  26 ARG CA  26 ARG C 51.81 . . 0.50 
       20 1JCACO  27 THR CA  27 THR C 49.74 . . 0.50 
       21 1JCACO  28 LEU CA  28 LEU C 52.52 . . 0.50 
       22 1JCACO  29 GLU CA  29 GLU C 52.70 . . 0.50 
       23 1JCACO  30 ASP CA  30 ASP C 52.89 . . 0.50 
       24 1JCACO  31 GLY CA  31 GLY C 51.61 . . 0.50 
       25 1JCACO  32 LYS CA  32 LYS C 52.61 . . 0.50 
       26 1JCACO  33 LYS CA  33 LYS C 52.29 . . 0.50 
       27 1JCACO  34 GLU CA  34 GLU C 51.52 . . 0.50 
       28 1JCACO  35 ALA CA  35 ALA C 53.88 . . 0.50 
       29 1JCACO  36 ALA CA  36 ALA C 52.65 . . 0.50 
       30 1JCACO  37 ALA CA  37 ALA C 52.42 . . 0.50 
       31 1JCACO  38 SER CA  38 SER C 52.86 . . 0.50 
       32 1JCACO  39 GLY CA  39 GLY C 51.57 . . 0.50 
       33 1JCACO  41 PRO CA  41 PRO C 52.19 . . 0.50 
       34 1JCACO  42 LEU CA  42 LEU C 50.77 . . 0.50 
       35 1JCACO  43 MET CA  43 MET C 52.52 . . 0.50 
       36 1JCACO  44 VAL CA  44 VAL C 52.51 . . 0.50 
       37 1JCACO  45 ILE CA  45 ILE C 51.54 . . 0.50 
       38 1JCACO  46 ILE CA  46 ILE C 52.10 . . 0.50 
       39 1JCACO  47 HIS CA  47 HIS C 53.15 . . 0.50 
       40 1JCACO  48 LYS CA  48 LYS C 49.15 . . 0.50 
       41 1JCACO  49 SER CA  49 SER C 51.02 . . 0.50 
       42 1JCACO  53 ALA CA  53 ALA C 51.86 . . 0.50 
       43 1JCACO  54 CYS CA  54 CYS C 51.32 . . 0.50 
       44 1JCACO  55 LYS CA  55 LYS C 51.96 . . 0.50 
       45 1JCACO  56 ALA CA  56 ALA C 52.04 . . 0.50 
       46 1JCACO  57 LEU CA  57 LEU C 52.29 . . 0.50 
       47 1JCACO  59 PRO CA  59 PRO C 53.50 . . 0.50 
       48 1JCACO  60 LYS CA  60 LYS C 53.24 . . 0.50 
       49 1JCACO  61 PHE CA  61 PHE C 52.89 . . 0.50 
       50 1JCACO  62 ALA CA  62 ALA C 52.62 . . 0.50 
       51 1JCACO  63 GLU CA  63 GLU C 52.31 . . 0.50 
       52 1JCACO  64 SER CA  64 SER C 51.62 . . 0.50 
       53 1JCACO  65 THR CA  65 THR C 52.55 . . 0.50 
       54 1JCACO  66 GLU CA  66 GLU C 52.98 . . 0.50 
       55 1JCACO  67 ILE CA  67 ILE C 52.50 . . 0.50 
       56 1JCACO  68 SER CA  68 SER C 50.91 . . 0.50 
       57 1JCACO  69 GLU CA  69 GLU C 52.05 . . 0.50 
       58 1JCACO  70 LEU CA  70 LEU C 53.22 . . 0.50 
       59 1JCACO  71 SER CA  71 SER C 51.02 . . 0.50 
       60 1JCACO  72 HIS CA  72 HIS C 53.57 . . 0.50 
       61 1JCACO  73 ASN CA  73 ASN C 52.85 . . 0.50 
       62 1JCACO  74 PHE CA  74 PHE C 51.55 . . 0.50 
       63 1JCACO  75 VAL CA  75 VAL C 52.40 . . 0.50 
       64 1JCACO  76 MET CA  76 MET C 54.35 . . 0.50 
       65 1JCACO  77 VAL CA  77 VAL C 53.38 . . 0.50 
       66 1JCACO  78 ASN CA  78 ASN C 51.93 . . 0.50 
       67 1JCACO  79 LEU CA  79 LEU C 53.44 . . 0.50 
       68 1JCACO  80 GLU CA  80 GLU C 50.33 . . 0.50 
       69 1JCACO  81 ASP CA  81 ASP C 51.17 . . 0.50 
       70 1JCACO  82 GLU CA  82 GLU C 51.20 . . 0.50 
       71 1JCACO  83 GLU CA  83 GLU C 52.22 . . 0.50 
       72 1JCACO  85 PRO CA  85 PRO C 54.33 . . 0.50 
       73 1JCACO  86 LYS CA  86 LYS C 51.88 . . 0.50 
       74 1JCACO  87 ASP CA  87 ASP C 54.52 . . 0.50 
       75 1JCACO  88 GLU CA  88 GLU C 52.22 . . 0.50 
       76 1JCACO  89 ASP CA  89 ASP C 50.26 . . 0.50 
       77 1JCACO  90 PHE CA  90 PHE C 51.81 . . 0.50 
       78 1JCACO  92 PRO CA  92 PRO C 52.28 . . 0.50 
       79 1JCACO  93 ASP CA  93 ASP C 53.27 . . 0.50 
       80 1JCACO  94 GLY CA  94 GLY C 50.27 . . 0.50 
       81 1JCACO  95 GLY CA  95 GLY C 52.88 . . 0.50 
       82 1JCACO  96 TYR CA  96 TYR C 52.47 . . 0.50 
       83 1JCACO  98 PRO CA  98 PRO C 52.60 . . 0.50 
       84 1JCACO  99 ARG CA  99 ARG C 52.45 . . 0.50 
       85 1JCACO 100 ILE CA 100 ILE C 54.99 . . 0.50 
       86 1JCACO 101 LEU CA 101 LEU C 54.47 . . 0.50 
       87 1JCACO 102 PHE CA 102 PHE C 54.95 . . 0.50 
       88 1JCACO 103 LEU CA 103 LEU C 51.36 . . 0.50 
       89 1JCACO 105 PRO CA 105 PRO C 55.07 . . 0.50 
       90 1JCACO 106 SER CA 106 SER C 51.59 . . 0.50 
       91 1JCACO 107 GLY CA 107 GLY C 52.60 . . 0.50 
       92 1JCACO 108 LYS CA 108 LYS C 52.31 . . 0.50 
       93 1JCACO 109 VAL CA 109 VAL C 53.63 . . 0.50 
       94 1JCACO 111 PRO CA 111 PRO C 50.55 . . 0.50 
       95 1JCACO 112 GLU CA 112 GLU C 50.92 . . 0.50 
       96 1JCACO 113 ILE CA 113 ILE C 51.89 . . 0.50 
       97 1JCACO 114 ILE CA 114 ILE C 51.73 . . 0.50 
       98 1JCACO 115 ASN CA 115 ASN C 52.04 . . 0.50 
       99 1JCACO 116 GLU CA 116 GLU C 52.81 . . 0.50 
      100 1JCACO 117 ASN CA 117 ASN C 53.09 . . 0.50 
      101 1JCACO 118 GLY CA 118 GLY C 51.87 . . 0.50 
      102 1JCACO 120 PRO CA 120 PRO C 53.85 . . 0.50 
      103 1JCACO 121 SER CA 121 SER C 50.98 . . 0.50 
      104 1JCACO 122 TYR CA 122 TYR C 51.01 . . 0.50 
      105 1JCACO 123 LYS CA 123 LYS C 52.37 . . 0.50 
      106 1JCACO 124 TYR CA 124 TYR C 52.55 . . 0.50 
      107 1JCACO 125 PHE CA 125 PHE C 54.19 . . 0.50 
      108 1JCACO 126 TYR CA 126 TYR C 50.70 . . 0.50 
      109 1JCACO 127 VAL CA 127 VAL C 53.23 . . 0.50 
      110 1JCACO 128 SER CA 128 SER C 53.67 . . 0.50 
      111 1JCACO 129 ALA CA 129 ALA C 52.56 . . 0.50 
      112 1JCACO 130 GLU CA 130 GLU C 53.01 . . 0.50 
      113 1JCACO 131 GLN CA 131 GLN C 51.73 . . 0.50 
      114 1JCACO 132 VAL CA 132 VAL C 52.14 . . 0.50 
      115 1JCACO 133 VAL CA 133 VAL C 53.13 . . 0.50 
      116 1JCACO 134 GLN CA 134 GLN C 51.71 . . 0.50 
      117 1JCACO 135 GLY CA 135 GLY C 52.10 . . 0.50 
      118 1JCACO 136 MET CA 136 MET C 52.17 . . 0.50 
      119 1JCACO 137 LYS CA 137 LYS C 52.35 . . 0.50 
      120 1JCACO 138 GLU CA 138 GLU C 51.86 . . 0.50 
      121 1JCACO 139 ALA CA 139 ALA C 52.97 . . 0.50 
      122 1JCACO 140 GLN CA 140 GLN C 51.93 . . 0.50 
      123 1JCACO 141 GLU CA 141 GLU C 52.32 . . 0.50 
      124 1JCACO 142 ARG CA 142 ARG C 53.37 . . 0.50 
      125 1JCACO 143 LEU CA 143 LEU C 53.49 . . 0.50 
      126 1JCACO 144 THR CA 144 THR C 52.01 . . 0.50 
      127 1JCACO 145 GLY CA 145 GLY C 52.16 . . 0.50 
      128 1JCACO 146 ASP CA 146 ASP C 53.12 . . 0.50 
      129 1JCACO 147 ALA CA 147 ALA C 52.64 . . 0.50 
      130 1JCACO 148 PHE CA 148 PHE C 53.00 . . 0.50 
      131 1JCACO 149 ARG CA 149 ARG C 51.02 . . 0.50 
      132 1JCACO 150 LYS CA 150 LYS C 52.34 . . 0.50 
      133 1JCACO 151 LYS CA 151 LYS C 51.67 . . 0.50 
      134 1JCACO 152 HIS CA 152 HIS C 52.33 . . 0.50 
      135 1JCACO 153 LEU CA 153 LEU C 52.37 . . 0.50 
      136 1JCACO 154 GLU CA 154 GLU C 52.30 . . 0.50 
      137 1JCACO 155 ASP CA 155 ASP C 52.21 . . 0.50 
      138 1JCACO 156 GLU CA 156 GLU C 52.32 . . 0.50 

   stop_

save_


save_1JCaN_
   _Saveframe_category          coupling_constants

   _Details                    'MQ-HCAN experiment for proline residues, IPAP-TROSY experiment for all other'

   loop_
      _Experiment_label

      '3D [1Ha,13Ca]-multiple-quantum HCAN quantitative J-correlation' 
      '2D IPAP-type HN(CO-a/b-NCa-J)-TROSY'                            

   stop_

   _Sample_conditions_label    $sample_conditions_1
   _Spectrometer_frequency_1H   .
   _Mol_system_component_name   ERp1
   _Text_data_format            .
   _Text_data                   .

   loop_
      _Coupling_constant_ID
      _Coupling_constant_code
      _Atom_one_residue_seq_code
      _Atom_one_residue_label
      _Atom_one_name
      _Atom_two_residue_seq_code
      _Atom_two_residue_label
      _Atom_two_name
      _Coupling_constant_value
      _Coupling_constant_min_value
      _Coupling_constant_max_value
      _Coupling_constant_value_error

        1 1JCAN_   8 MET CA   8 MET N -10.37 . . 0.50 
        2 1JCAN_   9 SER CA   9 SER N -10.87 . . 0.50 
        3 1JCAN_  10 ASP CA  10 ASP N -10.22 . . 0.50 
        4 1JCAN_  11 GLY CA  11 GLY N -11.19 . . 0.50 
        5 1JCAN_  13 ASN CA  13 ASN N  -8.99 . . 0.50 
        6 1JCAN_  14 GLY CA  14 GLY N -11.53 . . 0.50 
        7 1JCAN_  15 LEU CA  15 LEU N  -9.46 . . 0.50 
        8 1JCAN_  16 GLY CA  16 GLY N -10.04 . . 0.50 
        9 1JCAN_  17 LYS CA  17 LYS N  -9.53 . . 0.50 
       10 1JCAN_  18 GLY CA  18 GLY N -10.69 . . 0.50 
       11 1JCAN_  19 PHE CA  19 PHE N  -9.47 . . 0.50 
       12 1JCAN_  20 GLY CA  20 GLY N -11.71 . . 0.50 
       13 1JCAN_  21 ASP CA  21 ASP N -12.24 . . 0.50 
       14 1JCAN_  22 HIS CA  22 HIS N  -8.44 . . 0.50 
       15 1JCAN_  23 ILE CA  23 ILE N -10.53 . . 0.50 
       16 1JCAN_  24 HIS CA  24 HIS N -10.15 . . 0.50 
       17 1JCAN_  25 TRP CA  25 TRP N -11.56 . . 0.50 
       18 1JCAN_  26 ARG CA  26 ARG N -10.94 . . 0.50 
       19 1JCAN_  27 THR CA  27 THR N -11.29 . . 0.50 
       20 1JCAN_  28 LEU CA  28 LEU N  -8.96 . . 0.50 
       21 1JCAN_  29 GLU CA  29 GLU N  -8.84 . . 0.50 
       22 1JCAN_  30 ASP CA  30 ASP N  -9.13 . . 0.50 
       23 1JCAN_  31 GLY CA  31 GLY N  -9.82 . . 0.50 
       24 1JCAN_  32 LYS CA  32 LYS N  -9.92 . . 0.50 
       25 1JCAN_  33 LYS CA  33 LYS N  -8.94 . . 0.50 
       26 1JCAN_  34 GLU CA  34 GLU N  -9.27 . . 0.50 
       27 1JCAN_  35 ALA CA  35 ALA N  -9.14 . . 0.50 
       28 1JCAN_  36 ALA CA  36 ALA N  -9.75 . . 0.50 
       29 1JCAN_  37 ALA CA  37 ALA N  -9.86 . . 0.50 
       30 1JCAN_  38 SER CA  38 SER N -10.17 . . 0.50 
       31 1JCAN_  39 GLY CA  39 GLY N  -9.97 . . 0.50 
       32 1JCAN_  40 LEU CA  40 LEU N -10.48 . . 0.50 
       33 1JCAN_  42 LEU CA  42 LEU N  -9.94 . . 0.50 
       34 1JCAN_  43 MET CA  43 MET N  -9.69 . . 0.50 
       35 1JCAN_  44 VAL CA  44 VAL N -10.01 . . 0.50 
       36 1JCAN_  45 ILE CA  45 ILE N  -9.41 . . 0.50 
       37 1JCAN_  46 ILE CA  46 ILE N  -9.67 . . 0.50 
       38 1JCAN_  47 HIS CA  47 HIS N -13.10 . . 0.50 
       39 1JCAN_  48 LYS CA  48 LYS N -11.30 . . 0.50 
       40 1JCAN_  49 SER CA  49 SER N  -8.74 . . 0.50 
       41 1JCAN_  50 TRP CA  50 TRP N -11.02 . . 0.50 
       42 1JCAN_  54 CYS CA  54 CYS N  -9.75 . . 0.50 
       43 1JCAN_  55 LYS CA  55 LYS N  -9.53 . . 0.50 
       44 1JCAN_  56 ALA CA  56 ALA N  -9.57 . . 0.50 
       45 1JCAN_  57 LEU CA  57 LEU N  -9.11 . . 0.50 
       46 1JCAN_  58 LYS CA  58 LYS N  -9.09 . . 0.50 
       47 1JCAN_  59 PRO CA  59 PRO N  -9.05 . . 0.50 
       48 1JCAN_  60 LYS CA  60 LYS N  -9.28 . . 0.50 
       49 1JCAN_  61 PHE CA  61 PHE N  -9.35 . . 0.50 
       50 1JCAN_  62 ALA CA  62 ALA N  -9.48 . . 0.50 
       51 1JCAN_  63 GLU CA  63 GLU N  -9.04 . . 0.50 
       52 1JCAN_  64 SER CA  64 SER N -10.74 . . 0.50 
       53 1JCAN_  66 GLU CA  66 GLU N  -8.57 . . 0.50 
       54 1JCAN_  67 ILE CA  67 ILE N  -8.54 . . 0.50 
       55 1JCAN_  68 SER CA  68 SER N  -9.58 . . 0.50 
       56 1JCAN_  70 LEU CA  70 LEU N -10.51 . . 0.50 
       57 1JCAN_  71 SER CA  71 SER N  -8.70 . . 0.50 
       58 1JCAN_  72 HIS CA  72 HIS N -10.19 . . 0.50 
       59 1JCAN_  73 ASN CA  73 ASN N  -9.31 . . 0.50 
       60 1JCAN_  74 PHE CA  74 PHE N -12.17 . . 0.50 
       61 1JCAN_  75 VAL CA  75 VAL N  -9.89 . . 0.50 
       62 1JCAN_  76 MET CA  76 MET N  -9.74 . . 0.50 
       63 1JCAN_  77 VAL CA  77 VAL N -10.73 . . 0.50 
       64 1JCAN_  78 ASN CA  78 ASN N -10.43 . . 0.50 
       65 1JCAN_  79 LEU CA  79 LEU N  -8.70 . . 0.50 
       66 1JCAN_  80 GLU CA  80 GLU N -10.24 . . 0.50 
       67 1JCAN_  81 ASP CA  81 ASP N -10.39 . . 0.50 
       68 1JCAN_  82 GLU CA  82 GLU N  -9.38 . . 0.50 
       69 1JCAN_  83 GLU CA  83 GLU N  -8.87 . . 0.50 
       70 1JCAN_  84 GLU CA  84 GLU N -10.40 . . 0.50 
       71 1JCAN_  85 PRO CA  85 PRO N -11.27 . . 0.50 
       72 1JCAN_  86 LYS CA  86 LYS N  -9.69 . . 0.50 
       73 1JCAN_  87 ASP CA  87 ASP N -10.04 . . 0.50 
       74 1JCAN_  89 ASP CA  89 ASP N  -8.86 . . 0.50 
       75 1JCAN_  90 PHE CA  90 PHE N  -9.44 . . 0.50 
       76 1JCAN_  91 SER CA  91 SER N  -9.85 . . 0.50 
       77 1JCAN_  92 PRO CA  92 PRO N  -9.04 . . 0.50 
       78 1JCAN_  93 ASP CA  93 ASP N  -9.65 . . 0.50 
       79 1JCAN_  94 GLY CA  94 GLY N -13.14 . . 0.50 
       80 1JCAN_  95 GLY CA  95 GLY N -10.34 . . 0.50 
       81 1JCAN_  96 TYR CA  96 TYR N -12.49 . . 0.50 
       82 1JCAN_ 100 ILE CA 100 ILE N  -9.44 . . 0.50 
       83 1JCAN_ 101 LEU CA 101 LEU N -10.29 . . 0.50 
       84 1JCAN_ 102 PHE CA 102 PHE N -11.23 . . 0.50 
       85 1JCAN_ 103 LEU CA 103 LEU N  -9.90 . . 0.50 
       86 1JCAN_ 104 ASP CA 104 ASP N -10.99 . . 0.50 
       87 1JCAN_ 105 PRO CA 105 PRO N  -9.04 . . 0.50 
       88 1JCAN_ 106 SER CA 106 SER N  -9.70 . . 0.50 
       89 1JCAN_ 107 GLY CA 107 GLY N -10.20 . . 0.50 
       90 1JCAN_ 108 LYS CA 108 LYS N -10.89 . . 0.50 
       91 1JCAN_ 109 VAL CA 109 VAL N -11.77 . . 0.50 
       92 1JCAN_ 110 HIS CA 110 HIS N -10.30 . . 0.50 
       93 1JCAN_ 111 PRO CA 111 PRO N  -9.73 . . 0.50 
       94 1JCAN_ 112 GLU CA 112 GLU N  -8.58 . . 0.50 
       95 1JCAN_ 113 ILE CA 113 ILE N  -8.63 . . 0.50 
       96 1JCAN_ 114 ILE CA 114 ILE N -10.16 . . 0.50 
       97 1JCAN_ 115 ASN CA 115 ASN N  -9.51 . . 0.50 
       98 1JCAN_ 116 GLU CA 116 GLU N  -8.76 . . 0.50 
       99 1JCAN_ 117 ASN CA 117 ASN N  -9.28 . . 0.50 
      100 1JCAN_ 118 GLY CA 118 GLY N -12.28 . . 0.50 
      101 1JCAN_ 119 ASN CA 119 ASN N -10.29 . . 0.50 
      102 1JCAN_ 120 PRO CA 120 PRO N  -9.00 . . 0.50 
      103 1JCAN_ 122 TYR CA 122 TYR N  -9.47 . . 0.50 
      104 1JCAN_ 123 LYS CA 123 LYS N  -8.80 . . 0.50 
      105 1JCAN_ 124 TYR CA 124 TYR N -10.35 . . 0.50 
      106 1JCAN_ 125 PHE CA 125 PHE N -10.40 . . 0.50 
      107 1JCAN_ 126 TYR CA 126 TYR N -10.72 . . 0.50 
      108 1JCAN_ 127 VAL CA 127 VAL N  -8.24 . . 0.50 
      109 1JCAN_ 128 SER CA 128 SER N -12.51 . . 0.50 
      110 1JCAN_ 129 ALA CA 129 ALA N  -9.15 . . 0.50 
      111 1JCAN_ 130 GLU CA 130 GLU N  -9.38 . . 0.50 
      112 1JCAN_ 131 GLN CA 131 GLN N  -9.12 . . 0.50 
      113 1JCAN_ 132 VAL CA 132 VAL N  -9.13 . . 0.50 
      114 1JCAN_ 133 VAL CA 133 VAL N  -9.40 . . 0.50 
      115 1JCAN_ 134 GLN CA 134 GLN N  -9.14 . . 0.50 
      116 1JCAN_ 135 GLY CA 135 GLY N  -9.99 . . 0.50 
      117 1JCAN_ 136 MET CA 136 MET N  -9.35 . . 0.50 
      118 1JCAN_ 137 LYS CA 137 LYS N  -9.73 . . 0.50 
      119 1JCAN_ 138 GLU CA 138 GLU N  -8.62 . . 0.50 
      120 1JCAN_ 139 ALA CA 139 ALA N  -9.40 . . 0.50 
      121 1JCAN_ 140 GLN CA 140 GLN N  -9.11 . . 0.50 
      122 1JCAN_ 141 GLU CA 141 GLU N  -8.83 . . 0.50 
      123 1JCAN_ 142 ARG CA 142 ARG N  -9.18 . . 0.50 
      124 1JCAN_ 144 THR CA 144 THR N -11.04 . . 0.50 
      125 1JCAN_ 145 GLY CA 145 GLY N -11.57 . . 0.50 
      126 1JCAN_ 146 ASP CA 146 ASP N  -9.80 . . 0.50 
      127 1JCAN_ 147 ALA CA 147 ALA N  -9.80 . . 0.50 
      128 1JCAN_ 148 PHE CA 148 PHE N -10.03 . . 0.50 
      129 1JCAN_ 149 ARG CA 149 ARG N  -9.71 . . 0.50 
      130 1JCAN_ 150 LYS CA 150 LYS N -10.12 . . 0.50 
      131 1JCAN_ 151 LYS CA 151 LYS N -10.31 . . 0.50 
      132 1JCAN_ 152 HIS CA 152 HIS N -10.39 . . 0.50 
      133 1JCAN_ 153 LEU CA 153 LEU N  -9.30 . . 0.50 
      134 1JCAN_ 154 GLU CA 154 GLU N  -9.53 . . 0.50 
      135 1JCAN_ 155 ASP CA 155 ASP N  -9.94 . . 0.50 
      136 1JCAN_ 156 GLU CA 156 GLU N  -9.64 . . 0.50 
      137 1JCAN_ 157 LEU CA 157 LEU N  -9.19 . . 0.50 

   stop_

save_


save_1JCaHa
   _Saveframe_category          coupling_constants

   _Details                     .

   loop_
      _Experiment_label

      '3D Ca-coupled H(CACO)NH'               
      '3D Ha-coupled [15N,1H]-TROSY-HN(CO)CA' 
      '2D ct-[13C,1H]-IPAP-HSQC'              

   stop_

   _Sample_conditions_label    $sample_conditions_1
   _Spectrometer_frequency_1H   .
   _Mol_system_component_name   ERp1
   _Text_data_format            .
   _Text_data                   .

   loop_
      _Coupling_constant_ID
      _Coupling_constant_code
      _Atom_one_residue_seq_code
      _Atom_one_residue_label
      _Atom_one_name
      _Atom_two_residue_seq_code
      _Atom_two_residue_label
      _Atom_two_name
      _Coupling_constant_value
      _Coupling_constant_min_value
      _Coupling_constant_max_value
      _Coupling_constant_value_error

        1 1JCAHA   9 SER CA   9 SER HA 142.13 . . 0.50 
        2 1JCAHA  10 ASP CA  10 ASP HA 142.40 . . 0.50 
        3 1JCAHA  13 ASN CA  13 ASN HA 143.12 . . 0.50 
        4 1JCAHA  15 LEU CA  15 LEU HA 141.47 . . 0.50 
        5 1JCAHA  17 LYS CA  17 LYS HA 137.43 . . 0.50 
        6 1JCAHA  19 PHE CA  19 PHE HA 140.73 . . 0.50 
        7 1JCAHA  21 ASP CA  21 ASP HA 138.13 . . 0.50 
        8 1JCAHA  22 HIS CA  22 HIS HA 145.38 . . 0.50 
        9 1JCAHA  23 ILE CA  23 ILE HA 140.04 . . 0.50 
       10 1JCAHA  24 HIS CA  24 HIS HA 140.14 . . 0.50 
       11 1JCAHA  25 TRP CA  25 TRP HA 145.58 . . 0.50 
       12 1JCAHA  26 ARG CA  26 ARG HA 139.00 . . 0.50 
       13 1JCAHA  27 THR CA  27 THR HA 141.54 . . 0.50 
       14 1JCAHA  28 LEU CA  28 LEU HA 145.07 . . 0.50 
       15 1JCAHA  29 GLU CA  29 GLU HA 143.23 . . 0.50 
       16 1JCAHA  30 ASP CA  30 ASP HA 149.45 . . 0.50 
       17 1JCAHA  32 LYS CA  32 LYS HA 147.86 . . 0.50 
       18 1JCAHA  33 LYS CA  33 LYS HA 149.34 . . 0.50 
       19 1JCAHA  34 GLU CA  34 GLU HA 147.48 . . 0.50 
       20 1JCAHA  35 ALA CA  35 ALA HA 149.07 . . 0.50 
       21 1JCAHA  36 ALA CA  36 ALA HA 148.92 . . 0.50 
       22 1JCAHA  37 ALA CA  37 ALA HA 147.32 . . 0.50 
       23 1JCAHA  38 SER CA  38 SER HA 144.92 . . 0.50 
       24 1JCAHA  40 LEU CA  40 LEU HA 140.78 . . 0.50 
       25 1JCAHA  41 PRO CA  41 PRO HA 144.19 . . 0.50 
       26 1JCAHA  42 LEU CA  42 LEU HA 138.47 . . 0.50 
       27 1JCAHA  43 MET CA  43 MET HA 143.43 . . 0.50 
       28 1JCAHA  44 VAL CA  44 VAL HA 138.39 . . 0.50 
       29 1JCAHA  45 ILE CA  45 ILE HA 138.40 . . 0.50 
       30 1JCAHA  46 ILE CA  46 ILE HA 142.79 . . 0.50 
       31 1JCAHA  47 HIS CA  47 HIS HA 142.32 . . 0.50 
       32 1JCAHA  48 LYS CA  48 LYS HA 141.73 . . 0.50 
       33 1JCAHA  49 SER CA  49 SER HA 141.99 . . 0.50 
       34 1JCAHA  50 TRP CA  50 TRP HA 146.40 . . 0.50 
       35 1JCAHA  53 ALA CA  53 ALA HA 150.40 . . 0.50 
       36 1JCAHA  54 CYS CA  54 CYS HA 151.54 . . 0.50 
       37 1JCAHA  55 LYS CA  55 LYS HA 145.86 . . 0.50 
       38 1JCAHA  56 ALA CA  56 ALA HA 148.67 . . 0.50 
       39 1JCAHA  57 LEU CA  57 LEU HA 148.32 . . 0.50 
       40 1JCAHA  58 LYS CA  58 LYS HA 142.52 . . 0.50 
       41 1JCAHA  59 PRO CA  59 PRO HA 150.10 . . 0.50 
       42 1JCAHA  60 LYS CA  60 LYS HA 147.67 . . 0.50 
       43 1JCAHA  61 PHE CA  61 PHE HA 151.31 . . 0.50 
       44 1JCAHA  62 ALA CA  62 ALA HA 147.74 . . 0.50 
       45 1JCAHA  63 GLU CA  63 GLU HA 141.72 . . 0.50 
       46 1JCAHA  64 SER CA  64 SER HA 137.13 . . 0.50 
       47 1JCAHA  65 THR CA  65 THR HA 144.61 . . 0.50 
       48 1JCAHA  66 GLU CA  66 GLU HA 150.94 . . 0.50 
       49 1JCAHA  67 ILE CA  67 ILE HA 146.41 . . 0.50 
       50 1JCAHA  68 SER CA  68 SER HA 145.26 . . 0.50 
       51 1JCAHA  69 GLU CA  69 GLU HA 147.25 . . 0.50 
       52 1JCAHA  70 LEU CA  70 LEU HA 145.03 . . 0.50 
       53 1JCAHA  71 SER CA  71 SER HA 147.83 . . 0.50 
       54 1JCAHA  72 HIS CA  72 HIS HA 145.01 . . 0.50 
       55 1JCAHA  73 ASN CA  73 ASN HA 144.86 . . 0.50 
       56 1JCAHA  74 PHE CA  74 PHE HA 144.87 . . 0.50 
       57 1JCAHA  75 VAL CA  75 VAL HA 135.01 . . 0.50 
       58 1JCAHA  76 MET CA  76 MET HA 134.80 . . 0.50 
       59 1JCAHA  77 VAL CA  77 VAL HA 143.42 . . 0.50 
       60 1JCAHA  78 ASN CA  78 ASN HA 138.76 . . 0.50 
       61 1JCAHA  79 LEU CA  79 LEU HA 142.61 . . 0.50 
       62 1JCAHA  80 GLU CA  80 GLU HA 136.84 . . 0.50 
       63 1JCAHA  81 ASP CA  81 ASP HA 142.68 . . 0.50 
       64 1JCAHA  82 GLU CA  82 GLU HA 140.90 . . 0.50 
       65 1JCAHA  83 GLU CA  83 GLU HA 146.69 . . 0.50 
       66 1JCAHA  84 GLU CA  84 GLU HA 140.21 . . 0.50 
       67 1JCAHA  85 PRO CA  85 PRO HA 147.40 . . 0.50 
       68 1JCAHA  86 LYS CA  86 LYS HA 141.28 . . 0.50 
       69 1JCAHA  87 ASP CA  87 ASP HA 146.57 . . 0.50 
       70 1JCAHA  88 GLU CA  88 GLU HA 144.22 . . 0.50 
       71 1JCAHA  89 ASP CA  89 ASP HA 150.71 . . 0.50 
       72 1JCAHA  90 PHE CA  90 PHE HA 138.91 . . 0.50 
       73 1JCAHA  91 SER CA  91 SER HA 139.08 . . 0.50 
       74 1JCAHA  92 PRO CA  92 PRO HA 153.74 . . 0.50 
       75 1JCAHA  93 ASP CA  93 ASP HA 133.38 . . 0.50 
       76 1JCAHA  96 TYR CA  96 TYR HA 144.84 . . 0.50 
       77 1JCAHA  97 ILE CA  97 ILE HA 132.89 . . 0.50 
       78 1JCAHA  98 PRO CA  98 PRO HA 142.57 . . 0.50 
       79 1JCAHA  99 ARG CA  99 ARG HA 142.67 . . 0.50 
       80 1JCAHA 100 ILE CA 100 ILE HA 142.64 . . 0.50 
       81 1JCAHA 101 LEU CA 101 LEU HA 139.72 . . 0.50 
       82 1JCAHA 102 PHE CA 102 PHE HA 143.26 . . 0.50 
       83 1JCAHA 103 LEU CA 103 LEU HA 143.11 . . 0.50 
       84 1JCAHA 104 ASP CA 104 ASP HA 126.82 . . 0.50 
       85 1JCAHA 105 PRO CA 105 PRO HA 148.73 . . 0.50 
       86 1JCAHA 106 SER CA 106 SER HA 142.19 . . 0.50 
       87 1JCAHA 108 LYS CA 108 LYS HA 142.10 . . 0.50 
       88 1JCAHA 109 VAL CA 109 VAL HA 138.60 . . 0.50 
       89 1JCAHA 110 HIS CA 110 HIS HA 139.58 . . 0.50 
       90 1JCAHA 111 PRO CA 111 PRO HA 148.01 . . 0.50 
       91 1JCAHA 112 GLU CA 112 GLU HA 142.68 . . 0.50 
       92 1JCAHA 113 ILE CA 113 ILE HA 136.70 . . 0.50 
       93 1JCAHA 114 ILE CA 114 ILE HA 142.95 . . 0.50 
       94 1JCAHA 115 ASN CA 115 ASN HA 151.20 . . 0.50 
       95 1JCAHA 116 GLU CA 116 GLU HA 146.53 . . 0.50 
       96 1JCAHA 117 ASN CA 117 ASN HA 139.47 . . 0.50 
       97 1JCAHA 119 ASN CA 119 ASN HA 142.32 . . 0.50 
       98 1JCAHA 120 PRO CA 120 PRO HA 151.66 . . 0.50 
       99 1JCAHA 121 SER CA 121 SER HA 147.26 . . 0.50 
      100 1JCAHA 122 TYR CA 122 TYR HA 141.70 . . 0.50 
      101 1JCAHA 123 LYS CA 123 LYS HA 145.56 . . 0.50 
      102 1JCAHA 124 TYR CA 124 TYR HA 138.35 . . 0.50 
      103 1JCAHA 125 PHE CA 125 PHE HA 141.73 . . 0.50 
      104 1JCAHA 126 TYR CA 126 TYR HA 142.62 . . 0.50 
      105 1JCAHA 127 VAL CA 127 VAL HA 140.78 . . 0.50 
      106 1JCAHA 128 SER CA 128 SER HA 140.88 . . 0.50 
      107 1JCAHA 129 ALA CA 129 ALA HA 141.42 . . 0.50 
      108 1JCAHA 130 GLU CA 130 GLU HA 147.62 . . 0.50 
      109 1JCAHA 131 GLN CA 131 GLN HA 143.64 . . 0.50 
      110 1JCAHA 132 VAL CA 132 VAL HA 144.81 . . 0.50 
      111 1JCAHA 133 VAL CA 133 VAL HA 147.45 . . 0.50 
      112 1JCAHA 134 GLN CA 134 GLN HA 148.35 . . 0.50 
      113 1JCAHA 136 MET CA 136 MET HA 144.25 . . 0.50 
      114 1JCAHA 137 LYS CA 137 LYS HA 144.31 . . 0.50 
      115 1JCAHA 138 GLU CA 138 GLU HA 148.45 . . 0.50 
      116 1JCAHA 139 ALA CA 139 ALA HA 142.32 . . 0.50 
      117 1JCAHA 140 GLN CA 140 GLN HA 146.58 . . 0.50 
      118 1JCAHA 141 GLU CA 141 GLU HA 148.08 . . 0.50 
      119 1JCAHA 142 ARG CA 142 ARG HA 147.33 . . 0.50 
      120 1JCAHA 143 LEU CA 143 LEU HA 141.91 . . 0.50 
      121 1JCAHA 144 THR CA 144 THR HA 140.99 . . 0.50 
      122 1JCAHA 146 ASP CA 146 ASP HA 143.53 . . 0.50 
      123 1JCAHA 147 ALA CA 147 ALA HA 146.64 . . 0.50 
      124 1JCAHA 148 PHE CA 148 PHE HA 144.47 . . 0.50 
      125 1JCAHA 149 ARG CA 149 ARG HA 142.89 . . 0.50 
      126 1JCAHA 150 LYS CA 150 LYS HA 142.81 . . 0.50 
      127 1JCAHA 151 LYS CA 151 LYS HA 141.81 . . 0.50 
      128 1JCAHA 152 HIS CA 152 HIS HA 144.29 . . 0.50 
      129 1JCAHA 153 LEU CA 153 LEU HA 142.33 . . 0.50 
      130 1JCAHA 154 GLU CA 154 GLU HA 143.81 . . 0.50 
      131 1JCAHA 155 ASP CA 155 ASP HA 143.67 . . 0.50 
      132 1JCAHA 156 GLU CA 156 GLU HA 141.43 . . 0.50 
      133 1JCAHA 157 LEU CA 157 LEU HA 141.53 . . 0.50 

   stop_

save_


save_1JCaCb
   _Saveframe_category          coupling_constants

   _Details                    'recorded at 800 and 900 MHz with Ca evolution times of 46 and 44 ms, resp.'

   loop_
      _Experiment_label

      '3D Cb-coupled [15N,1H]-TROSY-HN(CO)CA' 

   stop_

   _Sample_conditions_label    $sample_conditions_1
   _Spectrometer_frequency_1H   .
   _Mol_system_component_name   ERp1
   _Text_data_format            .
   _Text_data                   .

   loop_
      _Coupling_constant_ID
      _Coupling_constant_code
      _Atom_one_residue_seq_code
      _Atom_one_residue_label
      _Atom_one_name
      _Atom_two_residue_seq_code
      _Atom_two_residue_label
      _Atom_two_name
      _Coupling_constant_value
      _Coupling_constant_min_value
      _Coupling_constant_max_value
      _Coupling_constant_value_error

        1 1JCACB   8 MET CA   8 MET CB 32.30 . . 0.50 
        2 1JCACB   9 SER CA   9 SER CB 36.55 . . 0.50 
        3 1JCACB  10 ASP CA  10 ASP CB 33.94 . . 0.50 
        4 1JCACB  13 ASN CA  13 ASN CB 34.99 . . 0.50 
        5 1JCACB  15 LEU CA  15 LEU CB 35.09 . . 0.50 
        6 1JCACB  17 LYS CA  17 LYS CB 33.12 . . 0.50 
        7 1JCACB  19 PHE CA  19 PHE CB 34.05 . . 0.50 
        8 1JCACB  21 ASP CA  21 ASP CB 35.09 . . 0.50 
        9 1JCACB  22 HIS CA  22 HIS CB 31.74 . . 0.50 
       10 1JCACB  23 ILE CA  23 ILE CB 34.33 . . 0.50 
       11 1JCACB  24 HIS CA  24 HIS CB 37.01 . . 0.50 
       12 1JCACB  25 TRP CA  25 TRP CB 31.31 . . 0.50 
       13 1JCACB  26 ARG CA  26 ARG CB 32.00 . . 0.50 
       14 1JCACB  28 LEU CA  28 LEU CB 33.41 . . 0.50 
       15 1JCACB  29 GLU CA  29 GLU CB 31.12 . . 0.50 
       16 1JCACB  30 ASP CA  30 ASP CB 31.62 . . 0.50 
       17 1JCACB  32 LYS CA  32 LYS CB 31.86 . . 0.50 
       18 1JCACB  33 LYS CA  33 LYS CB 31.99 . . 0.50 
       19 1JCACB  34 GLU CA  34 GLU CB 29.15 . . 0.50 
       20 1JCACB  35 ALA CA  35 ALA CB 31.97 . . 0.50 
       21 1JCACB  36 ALA CA  36 ALA CB 32.71 . . 0.50 
       22 1JCACB  37 ALA CA  37 ALA CB 33.08 . . 0.50 
       23 1JCACB  38 SER CA  38 SER CB 35.97 . . 0.50 
       24 1JCACB  41 PRO CA  41 PRO CB 30.11 . . 0.50 
       25 1JCACB  42 LEU CA  42 LEU CB 34.99 . . 0.50 
       26 1JCACB  43 MET CA  43 MET CB 31.74 . . 0.50 
       27 1JCACB  44 VAL CA  44 VAL CB 34.02 . . 0.50 
       28 1JCACB  45 ILE CA  45 ILE CB 34.32 . . 0.50 
       29 1JCACB  47 HIS CA  47 HIS CB 31.27 . . 0.50 
       30 1JCACB  48 LYS CA  48 LYS CB 30.31 . . 0.50 
       31 1JCACB  49 SER CA  49 SER CB 34.92 . . 0.50 
       32 1JCACB  53 ALA CA  53 ALA CB 32.76 . . 0.50 
       33 1JCACB  54 CYS CA  54 CYS CB 34.74 . . 0.50 
       34 1JCACB  55 LYS CA  55 LYS CB 34.13 . . 0.50 
       35 1JCACB  56 ALA CA  56 ALA CB 33.29 . . 0.50 
       36 1JCACB  57 LEU CA  57 LEU CB 33.46 . . 0.50 
       37 1JCACB  59 PRO CA  59 PRO CB 30.52 . . 0.50 
       38 1JCACB  60 LYS CA  60 LYS CB 33.33 . . 0.50 
       39 1JCACB  61 PHE CA  61 PHE CB 32.74 . . 0.50 
       40 1JCACB  62 ALA CA  62 ALA CB 33.46 . . 0.50 
       41 1JCACB  63 GLU CA  63 GLU CB 31.44 . . 0.50 
       42 1JCACB  65 THR CA  65 THR CB 33.62 . . 0.50 
       43 1JCACB  66 GLU CA  66 GLU CB 32.38 . . 0.50 
       44 1JCACB  67 ILE CA  67 ILE CB 32.59 . . 0.50 
       45 1JCACB  68 SER CA  68 SER CB 37.41 . . 0.50 
       46 1JCACB  69 GLU CA  69 GLU CB 30.24 . . 0.50 
       47 1JCACB  70 LEU CA  70 LEU CB 33.23 . . 0.50 
       48 1JCACB  71 SER CA  71 SER CB 40.42 . . 0.50 
       49 1JCACB  72 HIS CA  72 HIS CB 33.34 . . 0.50 
       50 1JCACB  73 ASN CA  73 ASN CB 35.19 . . 0.50 
       51 1JCACB  74 PHE CA  74 PHE CB 30.19 . . 0.50 
       52 1JCACB  75 VAL CA  75 VAL CB 34.64 . . 0.50 
       53 1JCACB  76 MET CA  76 MET CB 31.21 . . 0.50 
       54 1JCACB  77 VAL CA  77 VAL CB 33.05 . . 0.50 
       55 1JCACB  78 ASN CA  78 ASN CB 33.78 . . 0.50 
       56 1JCACB  79 LEU CA  79 LEU CB 34.52 . . 0.50 
       57 1JCACB  80 GLU CA  80 GLU CB 31.96 . . 0.50 
       58 1JCACB  81 ASP CA  81 ASP CB 36.75 . . 0.50 
       59 1JCACB  82 GLU CA  82 GLU CB 33.66 . . 0.50 
       60 1JCACB  83 GLU CA  83 GLU CB 30.87 . . 0.50 
       61 1JCACB  85 PRO CA  85 PRO CB 31.78 . . 0.50 
       62 1JCACB  86 LYS CA  86 LYS CB 34.23 . . 0.50 
       63 1JCACB  88 GLU CA  88 GLU CB 31.21 . . 0.50 
       64 1JCACB  89 ASP CA  89 ASP CB 36.12 . . 0.50 
       65 1JCACB  90 PHE CA  90 PHE CB 35.08 . . 0.50 
       66 1JCACB  92 PRO CA  92 PRO CB 28.95 . . 0.50 
       67 1JCACB  93 ASP CA  93 ASP CB 37.94 . . 0.50 
       68 1JCACB  96 TYR CA  96 TYR CB 32.28 . . 0.50 
       69 1JCACB  98 PRO CA  98 PRO CB 28.76 . . 0.50 
       70 1JCACB  99 ARG CA  99 ARG CB 34.92 . . 0.50 
       71 1JCACB 100 ILE CA 100 ILE CB 35.52 . . 0.50 
       72 1JCACB 101 LEU CA 101 LEU CB 34.03 . . 0.50 
       73 1JCACB 102 PHE CA 102 PHE CB 31.24 . . 0.50 
       74 1JCACB 103 LEU CA 103 LEU CB 34.67 . . 0.50 
       75 1JCACB 105 PRO CA 105 PRO CB 29.79 . . 0.50 
       76 1JCACB 106 SER CA 106 SER CB 37.06 . . 0.50 
       77 1JCACB 108 LYS CA 108 LYS CB 33.15 . . 0.50 
       78 1JCACB 109 VAL CA 109 VAL CB 31.86 . . 0.50 
       79 1JCACB 111 PRO CA 111 PRO CB 28.06 . . 0.50 
       80 1JCACB 112 GLU CA 112 GLU CB 32.68 . . 0.50 
       81 1JCACB 113 ILE CA 113 ILE CB 35.64 . . 0.50 
       82 1JCACB 114 ILE CA 114 ILE CB 32.18 . . 0.50 
       83 1JCACB 115 ASN CA 115 ASN CB 39.02 . . 0.50 
       84 1JCACB 116 GLU CA 116 GLU CB 31.05 . . 0.50 
       85 1JCACB 117 ASN CA 117 ASN CB 35.06 . . 0.50 
       86 1JCACB 120 PRO CA 120 PRO CB 29.36 . . 0.50 
       87 1JCACB 121 SER CA 121 SER CB 36.58 . . 0.50 
       88 1JCACB 122 TYR CA 122 TYR CB 36.93 . . 0.50 
       89 1JCACB 123 LYS CA 123 LYS CB 32.04 . . 0.50 
       90 1JCACB 124 TYR CA 124 TYR CB 33.83 . . 0.50 
       91 1JCACB 125 PHE CA 125 PHE CB 33.81 . . 0.50 
       92 1JCACB 126 TYR CA 126 TYR CB 32.47 . . 0.50 
       93 1JCACB 127 VAL CA 127 VAL CB 32.70 . . 0.50 
       94 1JCACB 128 SER CA 128 SER CB 35.70 . . 0.50 
       95 1JCACB 129 ALA CA 129 ALA CB 32.22 . . 0.50 
       96 1JCACB 130 GLU CA 130 GLU CB 30.90 . . 0.50 
       97 1JCACB 131 GLN CA 131 GLN CB 30.84 . . 0.50 
       98 1JCACB 132 VAL CA 132 VAL CB 31.28 . . 0.50 
       99 1JCACB 133 VAL CA 133 VAL CB 31.95 . . 0.50 
      100 1JCACB 134 GLN CA 134 GLN CB 30.25 . . 0.50 
      101 1JCACB 136 MET CA 136 MET CB 29.53 . . 0.50 
      102 1JCACB 137 LYS CA 137 LYS CB 32.11 . . 0.50 
      103 1JCACB 138 GLU CA 138 GLU CB 31.55 . . 0.50 
      104 1JCACB 139 ALA CA 139 ALA CB 33.25 . . 0.50 
      105 1JCACB 140 GLN CA 140 GLN CB 30.42 . . 0.50 
      106 1JCACB 141 GLU CA 141 GLU CB 31.65 . . 0.50 
      107 1JCACB 142 ARG CA 142 ARG CB 31.36 . . 0.50 
      108 1JCACB 143 LEU CA 143 LEU CB 34.91 . . 0.50 
      109 1JCACB 144 THR CA 144 THR CB 34.10 . . 0.50 
      110 1JCACB 146 ASP CA 146 ASP CB 33.21 . . 0.50 
      111 1JCACB 147 ALA CA 147 ALA CB 33.36 . . 0.50 
      112 1JCACB 148 PHE CA 148 PHE CB 32.46 . . 0.50 
      113 1JCACB 149 ARG CA 149 ARG CB 31.82 . . 0.50 
      114 1JCACB 150 LYS CA 150 LYS CB 32.45 . . 0.50 
      115 1JCACB 151 LYS CA 151 LYS CB 33.36 . . 0.50 
      116 1JCACB 152 HIS CA 152 HIS CB 34.14 . . 0.50 
      117 1JCACB 153 LEU CA 153 LEU CB 33.48 . . 0.50 
      118 1JCACB 154 GLU CA 154 GLU CB 31.38 . . 0.50 
      119 1JCACB 155 ASP CA 155 ASP CB 33.46 . . 0.50 
      120 1JCACB 156 GLU CA 156 GLU CB 32.04 . . 0.50 

   stop_

save_


save_1JCON_
   _Saveframe_category          coupling_constants

   _Details                     .

   loop_
      _Experiment_label

      '2D IPAP-type HN(a/b-NCO-J)-TROSY' 

   stop_

   _Sample_conditions_label    $sample_conditions_1
   _Spectrometer_frequency_1H   .
   _Mol_system_component_name   ERp1
   _Text_data_format            .
   _Text_data                   .

   loop_
      _Coupling_constant_ID
      _Coupling_constant_code
      _Atom_one_residue_seq_code
      _Atom_one_residue_label
      _Atom_one_name
      _Atom_two_residue_seq_code
      _Atom_two_residue_label
      _Atom_two_name
      _Coupling_constant_value
      _Coupling_constant_min_value
      _Coupling_constant_max_value
      _Coupling_constant_value_error

        1 1JC_N_   7 HIS C   8 MET N -14.71 . . 0.50 
        2 1JC_N_   8 MET C   9 SER N -13.97 . . 0.50 
        3 1JC_N_   9 SER C  10 ASP N -13.63 . . 0.50 
        4 1JC_N_  10 ASP C  11 GLY N -14.88 . . 0.50 
        5 1JC_N_  11 GLY C  12 HIS N -14.52 . . 0.50 
        6 1JC_N_  13 ASN C  14 GLY N -15.11 . . 0.50 
        7 1JC_N_  15 LEU C  16 GLY N -14.19 . . 0.50 
        8 1JC_N_  16 GLY C  17 LYS N -14.52 . . 0.50 
        9 1JC_N_  17 LYS C  18 GLY N -15.41 . . 0.50 
       10 1JC_N_  18 GLY C  19 PHE N -14.88 . . 0.50 
       11 1JC_N_  19 PHE C  20 GLY N -14.80 . . 0.50 
       12 1JC_N_  20 GLY C  21 ASP N -13.30 . . 0.50 
       13 1JC_N_  21 ASP C  22 HIS N -14.37 . . 0.50 
       14 1JC_N_  22 HIS C  23 ILE N -16.54 . . 0.50 
       15 1JC_N_  23 ILE C  24 HIS N -12.65 . . 0.50 
       16 1JC_N_  24 HIS C  25 TRP N -14.52 . . 0.50 
       17 1JC_N_  25 TRP C  26 ARG N -14.95 . . 0.50 
       18 1JC_N_  26 ARG C  27 THR N -14.22 . . 0.50 
       19 1JC_N_  27 THR C  28 LEU N -13.60 . . 0.50 
       20 1JC_N_  28 LEU C  29 GLU N -12.83 . . 0.50 
       21 1JC_N_  29 GLU C  30 ASP N -13.45 . . 0.50 
       22 1JC_N_  30 ASP C  31 GLY N -14.79 . . 0.50 
       23 1JC_N_  31 GLY C  32 LYS N -14.57 . . 0.50 
       24 1JC_N_  32 LYS C  33 LYS N -14.59 . . 0.50 
       25 1JC_N_  34 GLU C  35 ALA N -13.86 . . 0.50 
       26 1JC_N_  35 ALA C  36 ALA N -14.70 . . 0.50 
       27 1JC_N_  36 ALA C  37 ALA N -14.80 . . 0.50 
       28 1JC_N_  37 ALA C  38 SER N -14.73 . . 0.50 
       29 1JC_N_  38 SER C  39 GLY N -16.01 . . 0.50 
       30 1JC_N_  39 GLY C  40 LEU N -15.92 . . 0.50 
       31 1JC_N_  41 PRO C  42 LEU N -13.45 . . 0.50 
       32 1JC_N_  42 LEU C  43 MET N -13.04 . . 0.50 
       33 1JC_N_  43 MET C  44 VAL N -13.69 . . 0.50 
       34 1JC_N_  44 VAL C  45 ILE N -13.55 . . 0.50 
       35 1JC_N_  45 ILE C  46 ILE N -13.71 . . 0.50 
       36 1JC_N_  46 ILE C  47 HIS N -13.74 . . 0.50 
       37 1JC_N_  47 HIS C  48 LYS N -15.17 . . 0.50 
       38 1JC_N_  48 LYS C  49 SER N -13.51 . . 0.50 
       39 1JC_N_  49 SER C  50 TRP N -14.73 . . 0.50 
       40 1JC_N_  53 ALA C  54 CYS N -14.63 . . 0.50 
       41 1JC_N_  54 CYS C  55 LYS N -15.01 . . 0.50 
       42 1JC_N_  55 LYS C  56 ALA N -14.25 . . 0.50 
       43 1JC_N_  56 ALA C  57 LEU N -14.79 . . 0.50 
       44 1JC_N_  57 LEU C  58 LYS N -13.43 . . 0.50 
       45 1JC_N_  59 PRO C  60 LYS N -13.24 . . 0.50 
       46 1JC_N_  60 LYS C  61 PHE N -14.38 . . 0.50 
       47 1JC_N_  61 PHE C  62 ALA N -14.03 . . 0.50 
       48 1JC_N_  62 ALA C  63 GLU N -14.21 . . 0.50 
       49 1JC_N_  63 GLU C  64 SER N -14.83 . . 0.50 
       50 1JC_N_  65 THR C  66 GLU N -14.35 . . 0.50 
       51 1JC_N_  66 GLU C  67 ILE N -13.51 . . 0.50 
       52 1JC_N_  67 ILE C  68 SER N -13.64 . . 0.50 
       53 1JC_N_  68 SER C  69 GLU N -15.44 . . 0.50 
       54 1JC_N_  69 GLU C  70 LEU N -13.99 . . 0.50 
       55 1JC_N_  70 LEU C  71 SER N -12.82 . . 0.50 
       56 1JC_N_  71 SER C  72 HIS N -14.64 . . 0.50 
       57 1JC_N_  72 HIS C  73 ASN N -15.51 . . 0.50 
       58 1JC_N_  73 ASN C  74 PHE N -16.40 . . 0.50 
       59 1JC_N_  74 PHE C  75 VAL N -13.90 . . 0.50 
       60 1JC_N_  75 VAL C  76 MET N -13.31 . . 0.50 
       61 1JC_N_  76 MET C  77 VAL N -13.75 . . 0.50 
       62 1JC_N_  77 VAL C  78 ASN N -13.48 . . 0.50 
       63 1JC_N_  78 ASN C  79 LEU N -13.91 . . 0.50 
       64 1JC_N_  79 LEU C  80 GLU N -12.98 . . 0.50 
       65 1JC_N_  80 GLU C  81 ASP N -12.42 . . 0.50 
       66 1JC_N_  81 ASP C  82 GLU N -14.44 . . 0.50 
       67 1JC_N_  82 GLU C  83 GLU N -14.05 . . 0.50 
       68 1JC_N_  83 GLU C  84 GLU N -14.49 . . 0.50 
       69 1JC_N_  85 PRO C  86 LYS N -13.36 . . 0.50 
       70 1JC_N_  86 LYS C  87 ASP N -14.69 . . 0.50 
       71 1JC_N_  87 ASP C  88 GLU N -15.39 . . 0.50 
       72 1JC_N_  88 GLU C  89 ASP N -13.72 . . 0.50 
       73 1JC_N_  89 ASP C  90 PHE N -13.40 . . 0.50 
       74 1JC_N_  90 PHE C  91 SER N -15.55 . . 0.50 
       75 1JC_N_  92 PRO C  93 ASP N -14.15 . . 0.50 
       76 1JC_N_  93 ASP C  94 GLY N -15.63 . . 0.50 
       77 1JC_N_  94 GLY C  95 GLY N -14.81 . . 0.50 
       78 1JC_N_  95 GLY C  96 TYR N -15.74 . . 0.50 
       79 1JC_N_  96 TYR C  97 ILE N -13.27 . . 0.50 
       80 1JC_N_  98 PRO C  99 ARG N -13.47 . . 0.50 
       81 1JC_N_  99 ARG C 100 ILE N -14.29 . . 0.50 
       82 1JC_N_ 100 ILE C 101 LEU N -13.96 . . 0.50 
       83 1JC_N_ 101 LEU C 102 PHE N -13.69 . . 0.50 
       84 1JC_N_ 102 PHE C 103 LEU N -14.68 . . 0.50 
       85 1JC_N_ 103 LEU C 104 ASP N -12.04 . . 0.50 
       86 1JC_N_ 105 PRO C 106 SER N -13.61 . . 0.50 
       87 1JC_N_ 106 SER C 107 GLY N -16.08 . . 0.50 
       88 1JC_N_ 107 GLY C 108 LYS N -15.82 . . 0.50 
       89 1JC_N_ 108 LYS C 109 VAL N -14.10 . . 0.50 
       90 1JC_N_ 109 VAL C 110 HIS N -14.30 . . 0.50 
       91 1JC_N_ 111 PRO C 112 GLU N -15.06 . . 0.50 
       92 1JC_N_ 112 GLU C 113 ILE N -14.58 . . 0.50 
       93 1JC_N_ 113 ILE C 114 ILE N -14.56 . . 0.50 
       94 1JC_N_ 114 ILE C 115 ASN N -13.86 . . 0.50 
       95 1JC_N_ 115 ASN C 116 GLU N -12.87 . . 0.50 
       96 1JC_N_ 116 GLU C 117 ASN N -14.04 . . 0.50 
       97 1JC_N_ 117 ASN C 118 GLY N -16.48 . . 0.50 
       98 1JC_N_ 118 GLY C 119 ASN N -14.50 . . 0.50 
       99 1JC_N_ 121 SER C 122 TYR N -15.58 . . 0.50 
      100 1JC_N_ 122 TYR C 123 LYS N -14.40 . . 0.50 
      101 1JC_N_ 123 LYS C 124 TYR N -14.56 . . 0.50 
      102 1JC_N_ 124 TYR C 125 PHE N -15.00 . . 0.50 
      103 1JC_N_ 125 PHE C 126 TYR N -15.04 . . 0.50 
      104 1JC_N_ 126 TYR C 127 VAL N -15.38 . . 0.50 
      105 1JC_N_ 127 VAL C 128 SER N -15.63 . . 0.50 
      106 1JC_N_ 128 SER C 129 ALA N -14.07 . . 0.50 
      107 1JC_N_ 129 ALA C 130 GLU N -14.33 . . 0.50 
      108 1JC_N_ 130 GLU C 131 GLN N -13.54 . . 0.50 
      109 1JC_N_ 131 GLN C 132 VAL N -13.95 . . 0.50 
      110 1JC_N_ 132 VAL C 133 VAL N -14.52 . . 0.50 
      111 1JC_N_ 133 VAL C 134 GLN N -14.18 . . 0.50 
      112 1JC_N_ 134 GLN C 135 GLY N -14.58 . . 0.50 
      113 1JC_N_ 136 MET C 137 LYS N -13.81 . . 0.50 
      114 1JC_N_ 137 LYS C 138 GLU N -14.71 . . 0.50 
      115 1JC_N_ 138 GLU C 139 ALA N -14.91 . . 0.50 
      116 1JC_N_ 139 ALA C 140 GLN N -14.28 . . 0.50 
      117 1JC_N_ 140 GLN C 141 GLU N -14.43 . . 0.50 
      118 1JC_N_ 141 GLU C 142 ARG N -13.50 . . 0.50 
      119 1JC_N_ 142 ARG C 143 LEU N -13.85 . . 0.50 
      120 1JC_N_ 143 LEU C 144 THR N -14.28 . . 0.50 
      121 1JC_N_ 144 THR C 145 GLY N -15.14 . . 0.50 
      122 1JC_N_ 145 GLY C 146 ASP N -14.51 . . 0.50 
      123 1JC_N_ 146 ASP C 147 ALA N -14.10 . . 0.50 
      124 1JC_N_ 147 ALA C 148 PHE N -15.04 . . 0.50 
      125 1JC_N_ 148 PHE C 149 ARG N -15.13 . . 0.50 
      126 1JC_N_ 149 ARG C 150 LYS N -14.47 . . 0.50 
      127 1JC_N_ 150 LYS C 151 LYS N -14.60 . . 0.50 
      128 1JC_N_ 151 LYS C 152 HIS N -14.12 . . 0.50 
      129 1JC_N_ 152 HIS C 153 LEU N -15.04 . . 0.50 
      130 1JC_N_ 153 LEU C 154 GLU N -13.90 . . 0.50 
      131 1JC_N_ 154 GLU C 155 ASP N -14.37 . . 0.50 
      132 1JC_N_ 155 ASP C 156 GLU N -14.84 . . 0.50 
      133 1JC_N_ 156 GLU C 157 LEU N -15.52 . . 0.50 

   stop_

save_


save_2JCaN_
   _Saveframe_category          coupling_constants

   _Details                     .

   loop_
      _Experiment_label

      '2D IPAP-type HN(CO-a/b-NCa-J)-TROSY' 

   stop_

   _Sample_conditions_label    $sample_conditions_1
   _Spectrometer_frequency_1H   .
   _Mol_system_component_name   ERp1
   _Text_data_format            .
   _Text_data                   .

   loop_
      _Coupling_constant_ID
      _Coupling_constant_code
      _Atom_one_residue_seq_code
      _Atom_one_residue_label
      _Atom_one_name
      _Atom_two_residue_seq_code
      _Atom_two_residue_label
      _Atom_two_name
      _Coupling_constant_value
      _Coupling_constant_min_value
      _Coupling_constant_max_value
      _Coupling_constant_value_error

        1 2JCAN_   7 HIS CA   8 MET N  -7.58 . . 0.50 
        2 2JCAN_   8 MET CA   9 SER N  -8.34 . . 0.50 
        3 2JCAN_   9 SER CA  10 ASP N  -6.99 . . 0.50 
        4 2JCAN_  10 ASP CA  11 GLY N  -7.19 . . 0.50 
        5 2JCAN_  12 HIS CA  13 ASN N  -6.17 . . 0.50 
        6 2JCAN_  13 ASN CA  14 GLY N  -7.84 . . 0.50 
        7 2JCAN_  14 GLY CA  15 LEU N  -6.90 . . 0.50 
        8 2JCAN_  15 LEU CA  16 GLY N  -6.31 . . 0.50 
        9 2JCAN_  16 GLY CA  17 LYS N  -6.30 . . 0.50 
       10 2JCAN_  17 LYS CA  18 GLY N  -6.52 . . 0.50 
       11 2JCAN_  18 GLY CA  19 PHE N  -6.16 . . 0.50 
       12 2JCAN_  19 PHE CA  20 GLY N  -7.24 . . 0.50 
       13 2JCAN_  20 GLY CA  21 ASP N  -9.41 . . 0.50 
       14 2JCAN_  21 ASP CA  22 HIS N  -6.46 . . 0.50 
       15 2JCAN_  22 HIS CA  23 ILE N  -5.42 . . 0.50 
       16 2JCAN_  23 ILE CA  24 HIS N  -8.94 . . 0.50 
       17 2JCAN_  24 HIS CA  25 TRP N  -7.83 . . 0.50 
       18 2JCAN_  25 TRP CA  26 ARG N  -8.74 . . 0.50 
       19 2JCAN_  26 ARG CA  27 THR N  -8.21 . . 0.50 
       20 2JCAN_  27 THR CA  28 LEU N  -7.59 . . 0.50 
       21 2JCAN_  28 LEU CA  29 GLU N  -6.34 . . 0.50 
       22 2JCAN_  29 GLU CA  30 ASP N  -5.77 . . 0.50 
       23 2JCAN_  30 ASP CA  31 GLY N  -6.30 . . 0.50 
       24 2JCAN_  31 GLY CA  32 LYS N  -6.84 . . 0.50 
       25 2JCAN_  32 LYS CA  33 LYS N  -5.77 . . 0.50 
       26 2JCAN_  33 LYS CA  34 GLU N  -5.88 . . 0.50 
       27 2JCAN_  34 GLU CA  35 ALA N  -5.48 . . 0.50 
       28 2JCAN_  35 ALA CA  36 ALA N  -6.43 . . 0.50 
       29 2JCAN_  36 ALA CA  37 ALA N  -5.90 . . 0.50 
       30 2JCAN_  37 ALA CA  38 SER N  -6.22 . . 0.50 
       31 2JCAN_  38 SER CA  39 GLY N  -5.71 . . 0.50 
       32 2JCAN_  39 GLY CA  40 LEU N  -6.16 . . 0.50 
       33 2JCAN_  41 PRO CA  42 LEU N  -8.43 . . 0.50 
       34 2JCAN_  42 LEU CA  43 MET N  -8.77 . . 0.50 
       35 2JCAN_  43 MET CA  44 VAL N  -8.77 . . 0.50 
       36 2JCAN_  44 VAL CA  45 ILE N  -8.72 . . 0.50 
       37 2JCAN_  45 ILE CA  46 ILE N  -7.58 . . 0.50 
       38 2JCAN_  46 ILE CA  47 HIS N  -7.75 . . 0.50 
       39 2JCAN_  47 HIS CA  48 LYS N  -9.39 . . 0.50 
       40 2JCAN_  48 LYS CA  49 SER N  -7.21 . . 0.50 
       41 2JCAN_  49 SER CA  50 TRP N  -5.04 . . 0.50 
       42 2JCAN_  53 ALA CA  54 CYS N  -6.26 . . 0.50 
       43 2JCAN_  54 CYS CA  55 LYS N  -6.51 . . 0.50 
       44 2JCAN_  55 LYS CA  56 ALA N  -6.14 . . 0.50 
       45 2JCAN_  56 ALA CA  57 LEU N  -6.11 . . 0.50 
       46 2JCAN_  57 LEU CA  58 LYS N  -5.54 . . 0.50 
       47 2JCAN_  59 PRO CA  60 LYS N  -6.29 . . 0.50 
       48 2JCAN_  60 LYS CA  61 PHE N  -6.48 . . 0.50 
       49 2JCAN_  61 PHE CA  62 ALA N  -6.29 . . 0.50 
       50 2JCAN_  62 ALA CA  63 GLU N  -6.47 . . 0.50 
       51 2JCAN_  63 GLU CA  64 SER N  -5.98 . . 0.50 
       52 2JCAN_  65 THR CA  66 GLU N  -6.49 . . 0.50 
       53 2JCAN_  66 GLU CA  67 ILE N  -6.21 . . 0.50 
       54 2JCAN_  67 ILE CA  68 SER N  -5.74 . . 0.50 
       55 2JCAN_  69 GLU CA  70 LEU N  -5.03 . . 0.50 
       56 2JCAN_  70 LEU CA  71 SER N  -5.90 . . 0.50 
       57 2JCAN_  71 SER CA  72 HIS N  -3.52 . . 0.50 
       58 2JCAN_  72 HIS CA  73 ASN N  -6.28 . . 0.50 
       59 2JCAN_  73 ASN CA  74 PHE N  -6.65 . . 0.50 
       60 2JCAN_  74 PHE CA  75 VAL N  -8.30 . . 0.50 
       61 2JCAN_  75 VAL CA  76 MET N  -7.56 . . 0.50 
       62 2JCAN_  76 MET CA  77 VAL N  -9.65 . . 0.50 
       63 2JCAN_  77 VAL CA  78 ASN N  -8.48 . . 0.50 
       64 2JCAN_  78 ASN CA  79 LEU N  -9.27 . . 0.50 
       65 2JCAN_  79 LEU CA  80 GLU N  -8.72 . . 0.50 
       66 2JCAN_  80 GLU CA  81 ASP N  -7.40 . . 0.50 
       67 2JCAN_  81 ASP CA  82 GLU N  -7.70 . . 0.50 
       68 2JCAN_  82 GLU CA  83 GLU N  -5.75 . . 0.50 
       69 2JCAN_  83 GLU CA  84 GLU N  -6.08 . . 0.50 
       70 2JCAN_  85 PRO CA  86 LYS N  -8.47 . . 0.50 
       71 2JCAN_  86 LYS CA  87 ASP N  -6.58 . . 0.50 
       72 2JCAN_  87 ASP CA  88 GLU N  -9.19 . . 0.50 
       73 2JCAN_  88 GLU CA  89 ASP N  -5.67 . . 0.50 
       74 2JCAN_  89 ASP CA  90 PHE N  -6.65 . . 0.50 
       75 2JCAN_  90 PHE CA  91 SER N  -6.09 . . 0.50 
       76 2JCAN_  92 PRO CA  93 ASP N  -5.94 . . 0.50 
       77 2JCAN_  93 ASP CA  94 GLY N  -6.44 . . 0.50 
       78 2JCAN_  94 GLY CA  95 GLY N -10.64 . . 0.50 
       79 2JCAN_  95 GLY CA  96 TYR N  -6.34 . . 0.50 
       80 2JCAN_  96 TYR CA  97 ILE N  -8.50 . . 0.50 
       81 2JCAN_  98 PRO CA  99 ARG N -10.10 . . 0.50 
       82 2JCAN_  99 ARG CA 100 ILE N  -8.34 . . 0.50 
       83 2JCAN_ 100 ILE CA 101 LEU N  -8.11 . . 0.50 
       84 2JCAN_ 101 LEU CA 102 PHE N  -8.10 . . 0.50 
       85 2JCAN_ 102 PHE CA 103 LEU N -10.97 . . 0.50 
       86 2JCAN_ 103 LEU CA 104 ASP N  -8.55 . . 0.50 
       87 2JCAN_ 105 PRO CA 106 SER N  -6.13 . . 0.50 
       88 2JCAN_ 106 SER CA 107 GLY N  -5.94 . . 0.50 
       89 2JCAN_ 107 GLY CA 108 LYS N  -6.54 . . 0.50 
       90 2JCAN_ 108 LYS CA 109 VAL N  -7.51 . . 0.50 
       91 2JCAN_ 109 VAL CA 110 HIS N  -7.05 . . 0.50 
       92 2JCAN_ 111 PRO CA 112 GLU N  -5.95 . . 0.50 
       93 2JCAN_ 112 GLU CA 113 ILE N  -5.73 . . 0.50 
       94 2JCAN_ 113 ILE CA 114 ILE N  -6.51 . . 0.50 
       95 2JCAN_ 114 ILE CA 115 ASN N  -8.66 . . 0.50 
       96 2JCAN_ 115 ASN CA 116 GLU N  -7.01 . . 0.50 
       97 2JCAN_ 116 GLU CA 117 ASN N  -6.28 . . 0.50 
       98 2JCAN_ 117 ASN CA 118 GLY N  -6.99 . . 0.50 
       99 2JCAN_ 118 GLY CA 119 ASN N  -9.82 . . 0.50 
      100 2JCAN_ 120 PRO CA 121 SER N  -6.03 . . 0.50 
      101 2JCAN_ 121 SER CA 122 TYR N  -6.00 . . 0.50 
      102 2JCAN_ 122 TYR CA 123 LYS N  -6.77 . . 0.50 
      103 2JCAN_ 123 LYS CA 124 TYR N  -6.49 . . 0.50 
      104 2JCAN_ 124 TYR CA 125 PHE N  -5.73 . . 0.50 
      105 2JCAN_ 125 PHE CA 126 TYR N  -8.36 . . 0.50 
      106 2JCAN_ 126 TYR CA 127 VAL N  -8.53 . . 0.50 
      107 2JCAN_ 127 VAL CA 128 SER N  -5.56 . . 0.50 
      108 2JCAN_ 128 SER CA 129 ALA N  -9.68 . . 0.50 
      109 2JCAN_ 129 ALA CA 130 GLU N  -6.55 . . 0.50 
      110 2JCAN_ 130 GLU CA 131 GLN N  -5.21 . . 0.50 
      111 2JCAN_ 131 GLN CA 132 VAL N  -6.09 . . 0.50 
      112 2JCAN_ 132 VAL CA 133 VAL N  -6.12 . . 0.50 
      113 2JCAN_ 133 VAL CA 134 GLN N  -5.99 . . 0.50 
      114 2JCAN_ 134 GLN CA 135 GLY N  -6.29 . . 0.50 
      115 2JCAN_ 135 GLY CA 136 MET N  -6.79 . . 0.50 
      116 2JCAN_ 136 MET CA 137 LYS N  -6.29 . . 0.50 
      117 2JCAN_ 137 LYS CA 138 GLU N  -5.93 . . 0.50 
      118 2JCAN_ 138 GLU CA 139 ALA N  -6.47 . . 0.50 
      119 2JCAN_ 139 ALA CA 140 GLN N  -6.55 . . 0.50 
      120 2JCAN_ 140 GLN CA 141 GLU N  -6.05 . . 0.50 
      121 2JCAN_ 141 GLU CA 142 ARG N  -6.03 . . 0.50 
      122 2JCAN_ 142 ARG CA 143 LEU N  -5.78 . . 0.50 
      123 2JCAN_ 143 LEU CA 144 THR N  -6.32 . . 0.50 
      124 2JCAN_ 144 THR CA 145 GLY N  -7.54 . . 0.50 
      125 2JCAN_ 145 GLY CA 146 ASP N  -8.14 . . 0.50 
      126 2JCAN_ 146 ASP CA 147 ALA N  -6.13 . . 0.50 
      127 2JCAN_ 147 ALA CA 148 PHE N  -6.37 . . 0.50 
      128 2JCAN_ 148 PHE CA 149 ARG N  -6.22 . . 0.50 
      129 2JCAN_ 149 ARG CA 150 LYS N  -7.65 . . 0.50 
      130 2JCAN_ 150 LYS CA 151 LYS N  -7.65 . . 0.50 
      131 2JCAN_ 151 LYS CA 152 HIS N  -6.33 . . 0.50 
      132 2JCAN_ 152 HIS CA 153 LEU N  -7.12 . . 0.50 
      133 2JCAN_ 153 LEU CA 154 GLU N  -7.30 . . 0.50 
      134 2JCAN_ 154 GLU CA 155 ASP N  -6.63 . . 0.50 
      135 2JCAN_ 155 ASP CA 156 GLU N  -7.40 . . 0.50 
      136 2JCAN_ 156 GLU CA 157 LEU N  -6.55 . . 0.50 

   stop_

save_


save_2JCOHN
   _Saveframe_category          coupling_constants

   _Details                     .

   loop_
      _Experiment_label

      '2D IPAP-type HN(a/b-NCO-J)-TROSY' 

   stop_

   _Sample_conditions_label    $sample_conditions_1
   _Spectrometer_frequency_1H   .
   _Mol_system_component_name   ERp1
   _Text_data_format            .
   _Text_data                   .

   loop_
      _Coupling_constant_ID
      _Coupling_constant_code
      _Atom_one_residue_seq_code
      _Atom_one_residue_label
      _Atom_one_name
      _Atom_two_residue_seq_code
      _Atom_two_residue_label
      _Atom_two_name
      _Coupling_constant_value
      _Coupling_constant_min_value
      _Coupling_constant_max_value
      _Coupling_constant_value_error

        1 2JCOHN   7 HIS C   8 MET HN 4.66 . . 0.50 
        2 2JCOHN   8 MET C   9 SER HN 3.93 . . 0.50 
        3 2JCOHN   9 SER C  10 ASP HN 5.84 . . 0.50 
        4 2JCOHN  10 ASP C  11 GLY HN 3.63 . . 0.50 
        5 2JCOHN  13 ASN C  14 GLY HN 3.84 . . 0.50 
        6 2JCOHN  15 LEU C  16 GLY HN 4.63 . . 0.50 
        7 2JCOHN  16 GLY C  17 LYS HN 4.48 . . 0.50 
        8 2JCOHN  17 LYS C  18 GLY HN 4.38 . . 0.50 
        9 2JCOHN  18 GLY C  19 PHE HN 3.87 . . 0.50 
       10 2JCOHN  19 PHE C  20 GLY HN 4.43 . . 0.50 
       11 2JCOHN  20 GLY C  21 ASP HN 3.16 . . 0.50 
       12 2JCOHN  21 ASP C  22 HIS HN 4.58 . . 0.50 
       13 2JCOHN  22 HIS C  23 ILE HN 3.96 . . 0.50 
       14 2JCOHN  23 ILE C  24 HIS HN 3.54 . . 0.50 
       15 2JCOHN  24 HIS C  25 TRP HN 4.08 . . 0.50 
       16 2JCOHN  25 TRP C  26 ARG HN 4.16 . . 0.50 
       17 2JCOHN  26 ARG C  27 THR HN 3.44 . . 0.50 
       18 2JCOHN  27 THR C  28 LEU HN 4.09 . . 0.50 
       19 2JCOHN  28 LEU C  29 GLU HN 3.97 . . 0.50 
       20 2JCOHN  29 GLU C  30 ASP HN 4.05 . . 0.50 
       21 2JCOHN  30 ASP C  31 GLY HN 4.94 . . 0.50 
       22 2JCOHN  31 GLY C  32 LYS HN 5.27 . . 0.50 
       23 2JCOHN  32 LYS C  33 LYS HN 4.26 . . 0.50 
       24 2JCOHN  34 GLU C  35 ALA HN 4.13 . . 0.50 
       25 2JCOHN  35 ALA C  36 ALA HN 4.63 . . 0.50 
       26 2JCOHN  36 ALA C  37 ALA HN 4.90 . . 0.50 
       27 2JCOHN  37 ALA C  38 SER HN 3.61 . . 0.50 
       28 2JCOHN  38 SER C  39 GLY HN 5.04 . . 0.50 
       29 2JCOHN  39 GLY C  40 LEU HN 3.98 . . 0.50 
       30 2JCOHN  41 PRO C  42 LEU HN 3.59 . . 0.50 
       31 2JCOHN  42 LEU C  43 MET HN 4.07 . . 0.50 
       32 2JCOHN  43 MET C  44 VAL HN 4.42 . . 0.50 
       33 2JCOHN  44 VAL C  45 ILE HN 4.28 . . 0.50 
       34 2JCOHN  45 ILE C  46 ILE HN 3.98 . . 0.50 
       35 2JCOHN  46 ILE C  47 HIS HN 4.52 . . 0.50 
       36 2JCOHN  47 HIS C  48 LYS HN 4.81 . . 0.50 
       37 2JCOHN  48 LYS C  49 SER HN 4.55 . . 0.50 
       38 2JCOHN  49 SER C  50 TRP HN 4.14 . . 0.50 
       39 2JCOHN  53 ALA C  54 CYS HN 3.91 . . 0.50 
       40 2JCOHN  54 CYS C  55 LYS HN 3.97 . . 0.50 
       41 2JCOHN  55 LYS C  56 ALA HN 3.97 . . 0.50 
       42 2JCOHN  56 ALA C  57 LEU HN 3.98 . . 0.50 
       43 2JCOHN  57 LEU C  58 LYS HN 3.43 . . 0.50 
       44 2JCOHN  59 PRO C  60 LYS HN 3.63 . . 0.50 
       45 2JCOHN  60 LYS C  61 PHE HN 5.11 . . 0.50 
       46 2JCOHN  61 PHE C  62 ALA HN 3.97 . . 0.50 
       47 2JCOHN  62 ALA C  63 GLU HN 3.63 . . 0.50 
       48 2JCOHN  63 GLU C  64 SER HN 3.91 . . 0.50 
       49 2JCOHN  66 GLU C  67 ILE HN 4.18 . . 0.50 
       50 2JCOHN  67 ILE C  68 SER HN 3.61 . . 0.50 
       51 2JCOHN  68 SER C  69 GLU HN 4.94 . . 0.50 
       52 2JCOHN  69 GLU C  70 LEU HN 4.14 . . 0.50 
       53 2JCOHN  70 LEU C  71 SER HN 3.09 . . 0.50 
       54 2JCOHN  71 SER C  72 HIS HN 3.57 . . 0.50 
       55 2JCOHN  72 HIS C  73 ASN HN 3.94 . . 0.50 
       56 2JCOHN  73 ASN C  74 PHE HN 4.19 . . 0.50 
       57 2JCOHN  74 PHE C  75 VAL HN 3.62 . . 0.50 
       58 2JCOHN  75 VAL C  76 MET HN 4.11 . . 0.50 
       59 2JCOHN  76 MET C  77 VAL HN 4.36 . . 0.50 
       60 2JCOHN  77 VAL C  78 ASN HN 4.34 . . 0.50 
       61 2JCOHN  78 ASN C  79 LEU HN 3.68 . . 0.50 
       62 2JCOHN  79 LEU C  80 GLU HN 3.95 . . 0.50 
       63 2JCOHN  80 GLU C  81 ASP HN 3.52 . . 0.50 
       64 2JCOHN  81 ASP C  82 GLU HN 4.92 . . 0.50 
       65 2JCOHN  82 GLU C  83 GLU HN 3.96 . . 0.50 
       66 2JCOHN  83 GLU C  84 GLU HN 4.66 . . 0.50 
       67 2JCOHN  85 PRO C  86 LYS HN 3.98 . . 0.50 
       68 2JCOHN  86 LYS C  87 ASP HN 3.89 . . 0.50 
       69 2JCOHN  88 GLU C  89 ASP HN 4.10 . . 0.50 
       70 2JCOHN  89 ASP C  90 PHE HN 4.00 . . 0.50 
       71 2JCOHN  90 PHE C  91 SER HN 4.36 . . 0.50 
       72 2JCOHN  92 PRO C  93 ASP HN 4.38 . . 0.50 
       73 2JCOHN  93 ASP C  94 GLY HN 3.76 . . 0.50 
       74 2JCOHN  94 GLY C  95 GLY HN 3.67 . . 0.50 
       75 2JCOHN  95 GLY C  96 TYR HN 3.07 . . 0.50 
       76 2JCOHN  96 TYR C  97 ILE HN 3.37 . . 0.50 
       77 2JCOHN  99 ARG C 100 ILE HN 4.04 . . 0.50 
       78 2JCOHN 100 ILE C 101 LEU HN 3.87 . . 0.50 
       79 2JCOHN 101 LEU C 102 PHE HN 4.10 . . 0.50 
       80 2JCOHN 102 PHE C 103 LEU HN 4.94 . . 0.50 
       81 2JCOHN 103 LEU C 104 ASP HN 2.80 . . 0.50 
       82 2JCOHN 105 PRO C 106 SER HN 3.71 . . 0.50 
       83 2JCOHN 106 SER C 107 GLY HN 4.67 . . 0.50 
       84 2JCOHN 107 GLY C 108 LYS HN 4.45 . . 0.50 
       85 2JCOHN 108 LYS C 109 VAL HN 4.56 . . 0.50 
       86 2JCOHN 109 VAL C 110 HIS HN 2.36 . . 0.50 
       87 2JCOHN 111 PRO C 112 GLU HN 5.09 . . 0.50 
       88 2JCOHN 112 GLU C 113 ILE HN 4.13 . . 0.50 
       89 2JCOHN 114 ILE C 115 ASN HN 4.10 . . 0.50 
       90 2JCOHN 115 ASN C 116 GLU HN 3.67 . . 0.50 
       91 2JCOHN 116 GLU C 117 ASN HN 3.89 . . 0.50 
       92 2JCOHN 117 ASN C 118 GLY HN 4.45 . . 0.50 
       93 2JCOHN 118 GLY C 119 ASN HN 3.96 . . 0.50 
       94 2JCOHN 121 SER C 122 TYR HN 4.17 . . 0.50 
       95 2JCOHN 122 TYR C 123 LYS HN 4.27 . . 0.50 
       96 2JCOHN 123 LYS C 124 TYR HN 4.17 . . 0.50 
       97 2JCOHN 124 TYR C 125 PHE HN 4.07 . . 0.50 
       98 2JCOHN 125 PHE C 126 TYR HN 2.62 . . 0.50 
       99 2JCOHN 126 TYR C 127 VAL HN 3.57 . . 0.50 
      100 2JCOHN 127 VAL C 128 SER HN 4.51 . . 0.50 
      101 2JCOHN 128 SER C 129 ALA HN 2.79 . . 0.50 
      102 2JCOHN 129 ALA C 130 GLU HN 4.35 . . 0.50 
      103 2JCOHN 130 GLU C 131 GLN HN 3.93 . . 0.50 
      104 2JCOHN 131 GLN C 132 VAL HN 3.89 . . 0.50 
      105 2JCOHN 132 VAL C 133 VAL HN 5.80 . . 0.50 
      106 2JCOHN 133 VAL C 134 GLN HN 4.32 . . 0.50 
      107 2JCOHN 134 GLN C 135 GLY HN 4.35 . . 0.50 
      108 2JCOHN 136 MET C 137 LYS HN 3.98 . . 0.50 
      109 2JCOHN 137 LYS C 138 GLU HN 4.18 . . 0.50 
      110 2JCOHN 138 GLU C 139 ALA HN 3.32 . . 0.50 
      111 2JCOHN 139 ALA C 140 GLN HN 3.98 . . 0.50 
      112 2JCOHN 140 GLN C 141 GLU HN 3.87 . . 0.50 
      113 2JCOHN 141 GLU C 142 ARG HN 3.67 . . 0.50 
      114 2JCOHN 142 ARG C 143 LEU HN 4.42 . . 0.50 
      115 2JCOHN 143 LEU C 144 THR HN 3.71 . . 0.50 
      116 2JCOHN 144 THR C 145 GLY HN 4.58 . . 0.50 
      117 2JCOHN 145 GLY C 146 ASP HN 3.97 . . 0.50 
      118 2JCOHN 146 ASP C 147 ALA HN 3.86 . . 0.50 
      119 2JCOHN 147 ALA C 148 PHE HN 4.04 . . 0.50 
      120 2JCOHN 148 PHE C 149 ARG HN 4.08 . . 0.50 
      121 2JCOHN 149 ARG C 150 LYS HN 3.86 . . 0.50 
      122 2JCOHN 150 LYS C 151 LYS HN 3.66 . . 0.50 
      123 2JCOHN 151 LYS C 152 HIS HN 3.96 . . 0.50 
      124 2JCOHN 152 HIS C 153 LEU HN 4.00 . . 0.50 
      125 2JCOHN 153 LEU C 154 GLU HN 3.75 . . 0.50 
      126 2JCOHN 154 GLU C 155 ASP HN 3.95 . . 0.50 
      127 2JCOHN 155 ASP C 156 GLU HN 3.83 . . 0.50 
      128 2JCOHN 156 GLU C 157 LEU HN 3.86 . . 0.50 

   stop_

save_


save_2JHaCO
   _Saveframe_category          coupling_constants

   _Details                     .

   loop_
      _Experiment_label

      '3D Ha-coupled [15N,1H]-TROSY-H(N)COCA' 

   stop_

   _Sample_conditions_label    $sample_conditions_1
   _Spectrometer_frequency_1H   .
   _Mol_system_component_name   ERp1
   _Text_data_format            .
   _Text_data                   .

   loop_
      _Coupling_constant_ID
      _Coupling_constant_code
      _Atom_one_residue_seq_code
      _Atom_one_residue_label
      _Atom_one_name
      _Atom_two_residue_seq_code
      _Atom_two_residue_label
      _Atom_two_name
      _Coupling_constant_value
      _Coupling_constant_min_value
      _Coupling_constant_max_value
      _Coupling_constant_value_error

       1 2JHACO  15 LEU HA  15 LEU C -6.21 . . 0.50 
       2 2JHACO  19 PHE HA  19 PHE C -5.74 . . 0.50 
       3 2JHACO  21 ASP HA  21 ASP C -1.46 . . 0.50 
       4 2JHACO  22 HIS HA  22 HIS C -5.41 . . 0.50 
       5 2JHACO  24 HIS HA  24 HIS C -2.72 . . 0.50 
       6 2JHACO  25 TRP HA  25 TRP C -3.33 . . 0.50 
       7 2JHACO  27 THR HA  27 THR C -0.41 . . 0.50 
       8 2JHACO  28 LEU HA  28 LEU C -3.68 . . 0.50 
       9 2JHACO  29 GLU HA  29 GLU C -1.42 . . 0.50 
      10 2JHACO  30 ASP HA  30 ASP C -3.31 . . 0.50 
      11 2JHACO  32 LYS HA  32 LYS C -4.66 . . 0.50 
      12 2JHACO  33 LYS HA  33 LYS C -3.91 . . 0.50 
      13 2JHACO  34 GLU HA  34 GLU C -4.65 . . 0.50 
      14 2JHACO  35 ALA HA  35 ALA C -3.79 . . 0.50 
      15 2JHACO  36 ALA HA  36 ALA C -4.02 . . 0.50 
      16 2JHACO  37 ALA HA  37 ALA C -4.61 . . 0.50 
      17 2JHACO  41 PRO HA  41 PRO C -0.16 . . 0.50 
      18 2JHACO  42 LEU HA  42 LEU C -7.91 . . 0.50 
      19 2JHACO  43 MET HA  43 MET C -3.12 . . 0.50 
      20 2JHACO  45 ILE HA  45 ILE C -3.64 . . 0.50 
      21 2JHACO  46 ILE HA  46 ILE C -3.51 . . 0.50 
      22 2JHACO  47 HIS HA  47 HIS C -4.58 . . 0.50 
      23 2JHACO  48 LYS HA  48 LYS C -6.20 . . 0.50 
      24 2JHACO  49 SER HA  49 SER C -7.40 . . 0.50 
      25 2JHACO  53 ALA HA  53 ALA C -5.10 . . 0.50 
      26 2JHACO  54 CYS HA  54 CYS C -2.26 . . 0.50 
      27 2JHACO  55 LYS HA  55 LYS C -6.49 . . 0.50 
      28 2JHACO  56 ALA HA  56 ALA C -4.56 . . 0.50 
      29 2JHACO  57 LEU HA  57 LEU C -0.07 . . 0.50 
      30 2JHACO  59 PRO HA  59 PRO C -1.24 . . 0.50 
      31 2JHACO  61 PHE HA  61 PHE C -7.51 . . 0.50 
      32 2JHACO  62 ALA HA  62 ALA C -2.80 . . 0.50 
      33 2JHACO  63 GLU HA  63 GLU C -4.11 . . 0.50 
      34 2JHACO  67 ILE HA  67 ILE C -3.35 . . 0.50 
      35 2JHACO  68 SER HA  68 SER C -1.37 . . 0.50 
      36 2JHACO  69 GLU HA  69 GLU C -5.79 . . 0.50 
      37 2JHACO  70 LEU HA  70 LEU C -6.32 . . 0.50 
      38 2JHACO  71 SER HA  71 SER C -3.16 . . 0.50 
      39 2JHACO  73 ASN HA  73 ASN C -5.03 . . 0.50 
      40 2JHACO  74 PHE HA  74 PHE C -4.25 . . 0.50 
      41 2JHACO  76 MET HA  76 MET C -2.99 . . 0.50 
      42 2JHACO  77 VAL HA  77 VAL C -4.02 . . 0.50 
      43 2JHACO  78 ASN HA  78 ASN C  0.26 . . 0.50 
      44 2JHACO  79 LEU HA  79 LEU C -3.83 . . 0.50 
      45 2JHACO  80 GLU HA  80 GLU C -3.61 . . 0.50 
      46 2JHACO  83 GLU HA  83 GLU C -4.73 . . 0.50 
      47 2JHACO  85 PRO HA  85 PRO C -0.58 . . 0.50 
      48 2JHACO  86 LYS HA  86 LYS C -4.92 . . 0.50 
      49 2JHACO  88 GLU HA  88 GLU C -5.51 . . 0.50 
      50 2JHACO  89 ASP HA  89 ASP C -0.52 . . 0.50 
      51 2JHACO  93 ASP HA  93 ASP C -6.07 . . 0.50 
      52 2JHACO 100 ILE HA 100 ILE C -0.81 . . 0.50 
      53 2JHACO 101 LEU HA 101 LEU C -6.52 . . 0.50 
      54 2JHACO 102 PHE HA 102 PHE C -1.99 . . 0.50 
      55 2JHACO 105 PRO HA 105 PRO C -2.60 . . 0.50 
      56 2JHACO 106 SER HA 106 SER C -5.49 . . 0.50 
      57 2JHACO 108 LYS HA 108 LYS C  0.50 . . 0.50 
      58 2JHACO 109 VAL HA 109 VAL C -3.11 . . 0.50 
      59 2JHACO 111 PRO HA 111 PRO C -3.54 . . 0.50 
      60 2JHACO 112 GLU HA 112 GLU C -4.13 . . 0.50 
      61 2JHACO 114 ILE HA 114 ILE C -2.91 . . 0.50 
      62 2JHACO 116 GLU HA 116 GLU C -3.71 . . 0.50 
      63 2JHACO 117 ASN HA 117 ASN C -6.27 . . 0.50 
      64 2JHACO 120 PRO HA 120 PRO C -1.17 . . 0.50 
      65 2JHACO 121 SER HA 121 SER C -5.13 . . 0.50 
      66 2JHACO 122 TYR HA 122 TYR C -2.63 . . 0.50 
      67 2JHACO 123 LYS HA 123 LYS C -5.67 . . 0.50 
      68 2JHACO 124 TYR HA 124 TYR C -2.69 . . 0.50 
      69 2JHACO 126 TYR HA 126 TYR C -5.46 . . 0.50 
      70 2JHACO 127 VAL HA 127 VAL C -5.51 . . 0.50 
      71 2JHACO 128 SER HA 128 SER C -5.67 . . 0.50 
      72 2JHACO 129 ALA HA 129 ALA C -5.20 . . 0.50 
      73 2JHACO 130 GLU HA 130 GLU C -4.98 . . 0.50 
      74 2JHACO 131 GLN HA 131 GLN C -1.17 . . 0.50 
      75 2JHACO 132 VAL HA 132 VAL C -3.55 . . 0.50 
      76 2JHACO 133 VAL HA 133 VAL C -4.19 . . 0.50 
      77 2JHACO 134 GLN HA 134 GLN C -3.05 . . 0.50 
      78 2JHACO 136 MET HA 136 MET C -5.64 . . 0.50 
      79 2JHACO 137 LYS HA 137 LYS C -5.47 . . 0.50 
      80 2JHACO 138 GLU HA 138 GLU C -5.07 . . 0.50 
      81 2JHACO 139 ALA HA 139 ALA C -3.93 . . 0.50 
      82 2JHACO 140 GLN HA 140 GLN C -4.49 . . 0.50 
      83 2JHACO 141 GLU HA 141 GLU C -4.16 . . 0.50 
      84 2JHACO 143 LEU HA 143 LEU C -5.14 . . 0.50 
      85 2JHACO 144 THR HA 144 THR C -4.86 . . 0.50 
      86 2JHACO 146 ASP HA 146 ASP C -5.00 . . 0.50 
      87 2JHACO 147 ALA HA 147 ALA C -4.63 . . 0.50 
      88 2JHACO 148 PHE HA 148 PHE C -4.76 . . 0.50 
      89 2JHACO 149 ARG HA 149 ARG C -4.69 . . 0.50 
      90 2JHACO 150 LYS HA 150 LYS C -2.41 . . 0.50 
      91 2JHACO 152 HIS HA 152 HIS C -4.18 . . 0.50 
      92 2JHACO 153 LEU HA 153 LEU C -4.52 . . 0.50 
      93 2JHACO 154 GLU HA 154 GLU C -4.88 . . 0.50 
      94 2JHACO 155 ASP HA 155 ASP C -4.88 . . 0.50 
      95 2JHACO 156 GLU HA 156 GLU C -4.45 . . 0.50 

   stop_

save_


save_2JHNCa
   _Saveframe_category          coupling_constants

   _Details                     .

   loop_
      _Experiment_label

      '2D IPAP-type HN(CO-a/b-NCa-J)-TROSY' 

   stop_

   _Sample_conditions_label    $sample_conditions_1
   _Spectrometer_frequency_1H   .
   _Mol_system_component_name   ERp1
   _Text_data_format            .
   _Text_data                   .

   loop_
      _Coupling_constant_ID
      _Coupling_constant_code
      _Atom_one_residue_seq_code
      _Atom_one_residue_label
      _Atom_one_name
      _Atom_two_residue_seq_code
      _Atom_two_residue_label
      _Atom_two_name
      _Coupling_constant_value
      _Coupling_constant_min_value
      _Coupling_constant_max_value
      _Coupling_constant_value_error

        1 2JHNCA   8 MET HN   8 MET CA  2.52 . . 0.50 
        2 2JHNCA   9 SER HN   9 SER CA  1.03 . . 0.50 
        3 2JHNCA  10 ASP HN  10 ASP CA  2.81 . . 0.50 
        4 2JHNCA  11 GLY HN  11 GLY CA  3.35 . . 0.50 
        5 2JHNCA  13 ASN HN  13 ASN CA  1.15 . . 0.50 
        6 2JHNCA  14 GLY HN  14 GLY CA  2.48 . . 0.50 
        7 2JHNCA  15 LEU HN  15 LEU CA  1.06 . . 0.50 
        8 2JHNCA  16 GLY HN  16 GLY CA  1.32 . . 0.50 
        9 2JHNCA  17 LYS HN  17 LYS CA  1.93 . . 0.50 
       10 2JHNCA  18 GLY HN  18 GLY CA  3.86 . . 0.50 
       11 2JHNCA  19 PHE HN  19 PHE CA  2.17 . . 0.50 
       12 2JHNCA  20 GLY HN  20 GLY CA  1.05 . . 0.50 
       13 2JHNCA  21 ASP HN  21 ASP CA  1.15 . . 0.50 
       14 2JHNCA  22 HIS HN  22 HIS CA  0.38 . . 0.50 
       15 2JHNCA  23 ILE HN  23 ILE CA -0.05 . . 0.50 
       16 2JHNCA  24 HIS HN  24 HIS CA  5.18 . . 0.50 
       17 2JHNCA  25 TRP HN  25 TRP CA  2.31 . . 0.50 
       18 2JHNCA  26 ARG HN  26 ARG CA  1.81 . . 0.50 
       19 2JHNCA  27 THR HN  27 THR CA  1.24 . . 0.50 
       20 2JHNCA  28 LEU HN  28 LEU CA  1.43 . . 0.50 
       21 2JHNCA  29 GLU HN  29 GLU CA  2.96 . . 0.50 
       22 2JHNCA  30 ASP HN  30 ASP CA  2.38 . . 0.50 
       23 2JHNCA  31 GLY HN  31 GLY CA  0.66 . . 0.50 
       24 2JHNCA  32 LYS HN  32 LYS CA  4.54 . . 0.50 
       25 2JHNCA  33 LYS HN  33 LYS CA  2.69 . . 0.50 
       26 2JHNCA  34 GLU HN  34 GLU CA  2.98 . . 0.50 
       27 2JHNCA  35 ALA HN  35 ALA CA  2.48 . . 0.50 
       28 2JHNCA  36 ALA HN  36 ALA CA  2.33 . . 0.50 
       29 2JHNCA  37 ALA HN  37 ALA CA  2.29 . . 0.50 
       30 2JHNCA  38 SER HN  38 SER CA  1.95 . . 0.50 
       31 2JHNCA  39 GLY HN  39 GLY CA  1.41 . . 0.50 
       32 2JHNCA  40 LEU HN  40 LEU CA  1.48 . . 0.50 
       33 2JHNCA  42 LEU HN  42 LEU CA  1.29 . . 0.50 
       34 2JHNCA  43 MET HN  43 MET CA  2.41 . . 0.50 
       35 2JHNCA  44 VAL HN  44 VAL CA  0.96 . . 0.50 
       36 2JHNCA  45 ILE HN  45 ILE CA  1.00 . . 0.50 
       37 2JHNCA  46 ILE HN  46 ILE CA  1.87 . . 0.50 
       38 2JHNCA  47 HIS HN  47 HIS CA  1.91 . . 0.50 
       39 2JHNCA  48 LYS HN  48 LYS CA  0.80 . . 0.50 
       40 2JHNCA  49 SER HN  49 SER CA  2.12 . . 0.50 
       41 2JHNCA  50 TRP HN  50 TRP CA  3.10 . . 0.50 
       42 2JHNCA  54 CYS HN  54 CYS CA  1.09 . . 0.50 
       43 2JHNCA  55 LYS HN  55 LYS CA  1.91 . . 0.50 
       44 2JHNCA  56 ALA HN  56 ALA CA  1.88 . . 0.50 
       45 2JHNCA  57 LEU HN  57 LEU CA  2.16 . . 0.50 
       46 2JHNCA  58 LYS HN  58 LYS CA  2.01 . . 0.50 
       47 2JHNCA  60 LYS HN  60 LYS CA  0.98 . . 0.50 
       48 2JHNCA  61 PHE HN  61 PHE CA  2.82 . . 0.50 
       49 2JHNCA  62 ALA HN  62 ALA CA  2.08 . . 0.50 
       50 2JHNCA  63 GLU HN  63 GLU CA  1.62 . . 0.50 
       51 2JHNCA  64 SER HN  64 SER CA  3.23 . . 0.50 
       52 2JHNCA  66 GLU HN  66 GLU CA  2.90 . . 0.50 
       53 2JHNCA  67 ILE HN  67 ILE CA  1.11 . . 0.50 
       54 2JHNCA  68 SER HN  68 SER CA  3.35 . . 0.50 
       55 2JHNCA  70 LEU HN  70 LEU CA -0.22 . . 0.50 
       56 2JHNCA  71 SER HN  71 SER CA  2.73 . . 0.50 
       57 2JHNCA  72 HIS HN  72 HIS CA  1.83 . . 0.50 
       58 2JHNCA  73 ASN HN  73 ASN CA  2.34 . . 0.50 
       59 2JHNCA  74 PHE HN  74 PHE CA  0.64 . . 0.50 
       60 2JHNCA  75 VAL HN  75 VAL CA  2.36 . . 0.50 
       61 2JHNCA  76 MET HN  76 MET CA  1.68 . . 0.50 
       62 2JHNCA  77 VAL HN  77 VAL CA  1.31 . . 0.50 
       63 2JHNCA  78 ASN HN  78 ASN CA  0.56 . . 0.50 
       64 2JHNCA  79 LEU HN  79 LEU CA  1.01 . . 0.50 
       65 2JHNCA  80 GLU HN  80 GLU CA  1.51 . . 0.50 
       66 2JHNCA  81 ASP HN  81 ASP CA  0.93 . . 0.50 
       67 2JHNCA  82 GLU HN  82 GLU CA  1.23 . . 0.50 
       68 2JHNCA  83 GLU HN  83 GLU CA  1.89 . . 0.50 
       69 2JHNCA  84 GLU HN  84 GLU CA  3.12 . . 0.50 
       70 2JHNCA  86 LYS HN  86 LYS CA  2.47 . . 0.50 
       71 2JHNCA  87 ASP HN  87 ASP CA  1.97 . . 0.50 
       72 2JHNCA  89 ASP HN  89 ASP CA  2.44 . . 0.50 
       73 2JHNCA  90 PHE HN  90 PHE CA  1.00 . . 0.50 
       74 2JHNCA  91 SER HN  91 SER CA  2.39 . . 0.50 
       75 2JHNCA  93 ASP HN  93 ASP CA  0.81 . . 0.50 
       76 2JHNCA  94 GLY HN  94 GLY CA  1.80 . . 0.50 
       77 2JHNCA  95 GLY HN  95 GLY CA  2.23 . . 0.50 
       78 2JHNCA  96 TYR HN  96 TYR CA  1.30 . . 0.50 
       79 2JHNCA 100 ILE HN 100 ILE CA  1.99 . . 0.50 
       80 2JHNCA 101 LEU HN 101 LEU CA  1.02 . . 0.50 
       81 2JHNCA 102 PHE HN 102 PHE CA -1.17 . . 0.50 
       82 2JHNCA 103 LEU HN 103 LEU CA  2.75 . . 0.50 
       83 2JHNCA 104 ASP HN 104 ASP CA  3.55 . . 0.50 
       84 2JHNCA 106 SER HN 106 SER CA  1.42 . . 0.50 
       85 2JHNCA 107 GLY HN 107 GLY CA  0.93 . . 0.50 
       86 2JHNCA 108 LYS HN 108 LYS CA  1.22 . . 0.50 
       87 2JHNCA 109 VAL HN 109 VAL CA  4.09 . . 0.50 
       88 2JHNCA 110 HIS HN 110 HIS CA  1.51 . . 0.50 
       89 2JHNCA 112 GLU HN 112 GLU CA  1.34 . . 0.50 
       90 2JHNCA 113 ILE HN 113 ILE CA  2.83 . . 0.50 
       91 2JHNCA 114 ILE HN 114 ILE CA  1.29 . . 0.50 
       92 2JHNCA 115 ASN HN 115 ASN CA  1.51 . . 0.50 
       93 2JHNCA 116 GLU HN 116 GLU CA  2.79 . . 0.50 
       94 2JHNCA 117 ASN HN 117 ASN CA  1.08 . . 0.50 
       95 2JHNCA 118 GLY HN 118 GLY CA  1.51 . . 0.50 
       96 2JHNCA 119 ASN HN 119 ASN CA  1.99 . . 0.50 
       97 2JHNCA 122 TYR HN 122 TYR CA  1.58 . . 0.50 
       98 2JHNCA 123 LYS HN 123 LYS CA  2.05 . . 0.50 
       99 2JHNCA 124 TYR HN 124 TYR CA  2.40 . . 0.50 
      100 2JHNCA 125 PHE HN 125 PHE CA  1.86 . . 0.50 
      101 2JHNCA 126 TYR HN 126 TYR CA  3.54 . . 0.50 
      102 2JHNCA 127 VAL HN 127 VAL CA  2.34 . . 0.50 
      103 2JHNCA 128 SER HN 128 SER CA  1.12 . . 0.50 
      104 2JHNCA 129 ALA HN 129 ALA CA  1.83 . . 0.50 
      105 2JHNCA 130 GLU HN 130 GLU CA  3.68 . . 0.50 
      106 2JHNCA 131 GLN HN 131 GLN CA  1.76 . . 0.50 
      107 2JHNCA 132 VAL HN 132 VAL CA  2.55 . . 0.50 
      108 2JHNCA 133 VAL HN 133 VAL CA  1.74 . . 0.50 
      109 2JHNCA 134 GLN HN 134 GLN CA  2.18 . . 0.50 
      110 2JHNCA 135 GLY HN 135 GLY CA  1.57 . . 0.50 
      111 2JHNCA 136 MET HN 136 MET CA  2.85 . . 0.50 
      112 2JHNCA 137 LYS HN 137 LYS CA  2.87 . . 0.50 
      113 2JHNCA 138 GLU HN 138 GLU CA  1.85 . . 0.50 
      114 2JHNCA 139 ALA HN 139 ALA CA  1.48 . . 0.50 
      115 2JHNCA 140 GLN HN 140 GLN CA  3.18 . . 0.50 
      116 2JHNCA 141 GLU HN 141 GLU CA  1.89 . . 0.50 
      117 2JHNCA 142 ARG HN 142 ARG CA  1.08 . . 0.50 
      118 2JHNCA 144 THR HN 144 THR CA  1.87 . . 0.50 
      119 2JHNCA 145 GLY HN 145 GLY CA  1.95 . . 0.50 
      120 2JHNCA 146 ASP HN 146 ASP CA  2.99 . . 0.50 
      121 2JHNCA 147 ALA HN 147 ALA CA  2.29 . . 0.50 
      122 2JHNCA 148 PHE HN 148 PHE CA  2.16 . . 0.50 
      123 2JHNCA 149 ARG HN 149 ARG CA  1.92 . . 0.50 
      124 2JHNCA 150 LYS HN 150 LYS CA  2.04 . . 0.50 
      125 2JHNCA 151 LYS HN 151 LYS CA  1.64 . . 0.50 
      126 2JHNCA 152 HIS HN 152 HIS CA  0.54 . . 0.50 
      127 2JHNCA 153 LEU HN 153 LEU CA  2.03 . . 0.50 
      128 2JHNCA 154 GLU HN 154 GLU CA  1.93 . . 0.50 
      129 2JHNCA 155 ASP HN 155 ASP CA  1.97 . . 0.50 
      130 2JHNCA 156 GLU HN 156 GLU CA  1.92 . . 0.50 
      131 2JHNCA 157 LEU HN 157 LEU CA  1.62 . . 0.50 

   stop_

save_


save_1JN_HN
   _Saveframe_category          coupling_constants

   _Details                     .

   loop_
      _Experiment_label

      '2D [15N,1H]-IPAP-HSQC' 

   stop_

   _Sample_conditions_label    $sample_conditions_1
   _Spectrometer_frequency_1H   .
   _Mol_system_component_name   ERp1
   _Text_data_format            .
   _Text_data                   .

   loop_
      _Coupling_constant_ID
      _Coupling_constant_code
      _Atom_one_residue_seq_code
      _Atom_one_residue_label
      _Atom_one_name
      _Atom_two_residue_seq_code
      _Atom_two_residue_label
      _Atom_two_name
      _Coupling_constant_value
      _Coupling_constant_min_value
      _Coupling_constant_max_value
      _Coupling_constant_value_error

        1 1JN_HN  11 GLY N  11 GLY HN -94.03 . . 0.50 
        2 1JN_HN  14 GLY N  14 GLY HN -94.21 . . 0.50 
        3 1JN_HN  16 GLY N  16 GLY HN -94.55 . . 0.50 
        4 1JN_HN  17 LYS N  17 LYS HN -93.16 . . 0.50 
        5 1JN_HN  18 GLY N  18 GLY HN -92.74 . . 0.50 
        6 1JN_HN  20 GLY N  20 GLY HN -93.78 . . 0.50 
        7 1JN_HN  21 ASP N  21 ASP HN -92.64 . . 0.50 
        8 1JN_HN  23 ILE N  23 ILE HN -92.68 . . 0.50 
        9 1JN_HN  24 HIS N  24 HIS HN -92.45 . . 0.50 
       10 1JN_HN  25 TRP N  25 TRP HN -92.96 . . 0.50 
       11 1JN_HN  26 ARG N  26 ARG HN -93.38 . . 0.50 
       12 1JN_HN  27 THR N  27 THR HN -93.10 . . 0.50 
       13 1JN_HN  28 LEU N  28 LEU HN -94.01 . . 0.50 
       14 1JN_HN  29 GLU N  29 GLU HN -93.42 . . 0.50 
       15 1JN_HN  30 ASP N  30 ASP HN -97.95 . . 0.50 
       16 1JN_HN  31 GLY N  31 GLY HN -95.12 . . 0.50 
       17 1JN_HN  32 LYS N  32 LYS HN -94.32 . . 0.50 
       18 1JN_HN  33 LYS N  33 LYS HN -94.56 . . 0.50 
       19 1JN_HN  35 ALA N  35 ALA HN -93.59 . . 0.50 
       20 1JN_HN  36 ALA N  36 ALA HN -94.34 . . 0.50 
       21 1JN_HN  37 ALA N  37 ALA HN -94.67 . . 0.50 
       22 1JN_HN  38 SER N  38 SER HN -92.99 . . 0.50 
       23 1JN_HN  39 GLY N  39 GLY HN -94.14 . . 0.50 
       24 1JN_HN  40 LEU N  40 LEU HN -93.56 . . 0.50 
       25 1JN_HN  42 LEU N  42 LEU HN -91.30 . . 0.50 
       26 1JN_HN  43 MET N  43 MET HN -92.31 . . 0.50 
       27 1JN_HN  44 VAL N  44 VAL HN -93.07 . . 0.50 
       28 1JN_HN  45 ILE N  45 ILE HN -92.02 . . 0.50 
       29 1JN_HN  46 ILE N  46 ILE HN -92.80 . . 0.50 
       30 1JN_HN  47 HIS N  47 HIS HN -93.66 . . 0.50 
       31 1JN_HN  48 LYS N  48 LYS HN -90.45 . . 0.50 
       32 1JN_HN  49 SER N  49 SER HN -91.99 . . 0.50 
       33 1JN_HN  50 TRP N  50 TRP HN -91.40 . . 0.50 
       34 1JN_HN  54 CYS N  54 CYS HN -92.86 . . 0.50 
       35 1JN_HN  55 LYS N  55 LYS HN -94.50 . . 0.50 
       36 1JN_HN  56 ALA N  56 ALA HN -92.12 . . 0.50 
       37 1JN_HN  57 LEU N  57 LEU HN -93.39 . . 0.50 
       38 1JN_HN  58 LYS N  58 LYS HN -93.47 . . 0.50 
       39 1JN_HN  60 LYS N  60 LYS HN -92.19 . . 0.50 
       40 1JN_HN  61 PHE N  61 PHE HN -93.81 . . 0.50 
       41 1JN_HN  62 ALA N  62 ALA HN -93.25 . . 0.50 
       42 1JN_HN  63 GLU N  63 GLU HN -96.27 . . 0.50 
       43 1JN_HN  64 SER N  64 SER HN -94.75 . . 0.50 
       44 1JN_HN  67 ILE N  67 ILE HN -93.63 . . 0.50 
       45 1JN_HN  68 SER N  68 SER HN -92.49 . . 0.50 
       46 1JN_HN  70 LEU N  70 LEU HN -92.30 . . 0.50 
       47 1JN_HN  72 HIS N  72 HIS HN -94.10 . . 0.50 
       48 1JN_HN  73 ASN N  73 ASN HN -92.07 . . 0.50 
       49 1JN_HN  74 PHE N  74 PHE HN -93.39 . . 0.50 
       50 1JN_HN  75 VAL N  75 VAL HN -92.15 . . 0.50 
       51 1JN_HN  76 MET N  76 MET HN -92.51 . . 0.50 
       52 1JN_HN  77 VAL N  77 VAL HN -93.78 . . 0.50 
       53 1JN_HN  78 ASN N  78 ASN HN -93.62 . . 0.50 
       54 1JN_HN  79 LEU N  79 LEU HN -92.78 . . 0.50 
       55 1JN_HN  80 GLU N  80 GLU HN -92.46 . . 0.50 
       56 1JN_HN  81 ASP N  81 ASP HN -93.37 . . 0.50 
       57 1JN_HN  82 GLU N  82 GLU HN -93.85 . . 0.50 
       58 1JN_HN  83 GLU N  83 GLU HN -93.39 . . 0.50 
       59 1JN_HN  84 GLU N  84 GLU HN -94.33 . . 0.50 
       60 1JN_HN  86 LYS N  86 LYS HN -92.79 . . 0.50 
       61 1JN_HN  87 ASP N  87 ASP HN -93.36 . . 0.50 
       62 1JN_HN  88 GLU N  88 GLU HN -94.60 . . 0.50 
       63 1JN_HN  89 ASP N  89 ASP HN -93.62 . . 0.50 
       64 1JN_HN  90 PHE N  90 PHE HN -92.40 . . 0.50 
       65 1JN_HN  91 SER N  91 SER HN -93.40 . . 0.50 
       66 1JN_HN  93 ASP N  93 ASP HN -93.10 . . 0.50 
       67 1JN_HN  94 GLY N  94 GLY HN -93.31 . . 0.50 
       68 1JN_HN  95 GLY N  95 GLY HN -92.86 . . 0.50 
       69 1JN_HN  96 TYR N  96 TYR HN -91.61 . . 0.50 
       70 1JN_HN  97 ILE N  97 ILE HN -91.05 . . 0.50 
       71 1JN_HN  99 ARG N  99 ARG HN -92.80 . . 0.50 
       72 1JN_HN 100 ILE N 100 ILE HN -92.86 . . 0.50 
       73 1JN_HN 101 LEU N 101 LEU HN -95.06 . . 0.50 
       74 1JN_HN 102 PHE N 102 PHE HN -93.26 . . 0.50 
       75 1JN_HN 103 LEU N 103 LEU HN -94.04 . . 0.50 
       76 1JN_HN 104 ASP N 104 ASP HN -92.87 . . 0.50 
       77 1JN_HN 106 SER N 106 SER HN -91.87 . . 0.50 
       78 1JN_HN 107 GLY N 107 GLY HN -93.67 . . 0.50 
       79 1JN_HN 108 LYS N 108 LYS HN -94.06 . . 0.50 
       80 1JN_HN 112 GLU N 112 GLU HN -92.82 . . 0.50 
       81 1JN_HN 113 ILE N 113 ILE HN -92.87 . . 0.50 
       82 1JN_HN 114 ILE N 114 ILE HN -93.98 . . 0.50 
       83 1JN_HN 115 ASN N 115 ASN HN -95.12 . . 0.50 
       84 1JN_HN 116 GLU N 116 GLU HN -94.80 . . 0.50 
       85 1JN_HN 117 ASN N 117 ASN HN -92.63 . . 0.50 
       86 1JN_HN 118 GLY N 118 GLY HN -93.67 . . 0.50 
       87 1JN_HN 119 ASN N 119 ASN HN -92.72 . . 0.50 
       88 1JN_HN 122 TYR N 122 TYR HN -93.02 . . 0.50 
       89 1JN_HN 123 LYS N 123 LYS HN -93.83 . . 0.50 
       90 1JN_HN 124 TYR N 124 TYR HN -92.27 . . 0.50 
       91 1JN_HN 125 PHE N 125 PHE HN -93.27 . . 0.50 
       92 1JN_HN 126 TYR N 126 TYR HN -92.36 . . 0.50 
       93 1JN_HN 128 SER N 128 SER HN -93.83 . . 0.50 
       94 1JN_HN 129 ALA N 129 ALA HN -93.10 . . 0.50 
       95 1JN_HN 130 GLU N 130 GLU HN -92.36 . . 0.50 
       96 1JN_HN 131 GLN N 131 GLN HN -92.84 . . 0.50 
       97 1JN_HN 132 VAL N 132 VAL HN -92.74 . . 0.50 
       98 1JN_HN 134 GLN N 134 GLN HN -93.52 . . 0.50 
       99 1JN_HN 135 GLY N 135 GLY HN -94.27 . . 0.50 
      100 1JN_HN 138 GLU N 138 GLU HN -93.25 . . 0.50 
      101 1JN_HN 139 ALA N 139 ALA HN -96.03 . . 0.50 
      102 1JN_HN 140 GLN N 140 GLN HN -92.83 . . 0.50 
      103 1JN_HN 142 ARG N 142 ARG HN -93.41 . . 0.50 
      104 1JN_HN 143 LEU N 143 LEU HN -93.70 . . 0.50 
      105 1JN_HN 144 THR N 144 THR HN -93.06 . . 0.50 
      106 1JN_HN 145 GLY N 145 GLY HN -94.10 . . 0.50 
      107 1JN_HN 146 ASP N 146 ASP HN -93.59 . . 0.50 
      108 1JN_HN 147 ALA N 147 ALA HN -93.91 . . 0.50 
      109 1JN_HN 148 PHE N 148 PHE HN -93.10 . . 0.50 
      110 1JN_HN 149 ARG N 149 ARG HN -93.33 . . 0.50 
      111 1JN_HN 150 LYS N 150 LYS HN -93.17 . . 0.50 
      112 1JN_HN 151 LYS N 151 LYS HN -92.45 . . 0.50 
      113 1JN_HN 153 LEU N 153 LEU HN -93.64 . . 0.50 
      114 1JN_HN 154 GLU N 154 GLU HN -92.84 . . 0.50 
      115 1JN_HN 155 ASP N 155 ASP HN -93.57 . . 0.50 
      116 1JN_HN 156 GLU N 156 GLU HN -92.87 . . 0.50 
      117 1JN_HN 157 LEU N 157 LEU HN -92.34 . . 0.50 

   stop_

save_