data_16904

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

save_entry_information
   _Saveframe_category      entry_information

   _Entry_title            
;
Backbone assignment of human alpha-synuclein in viscous 2 M glucose solution
;
   _BMRB_accession_number   16904
   _BMRB_flat_file_name     bmr16904.str
   _Entry_type              original
   _Submission_date         2010-04-28
   _Accession_date          2010-04-28
   _Entry_origination       author
   _NMR_STAR_version        2.1.1
   _Experimental_method     NMR
   _Details                'assignment of intrinsically disordered human alpha-synuclein in viscous 2 M glucose solution'

   loop_
      _Author_ordinal
      _Author_family_name
      _Author_given_name
      _Author_middle_initials
      _Author_family_title

      1 Wu   Kuen-Phon . . 
      2 Baum Jean      . . 

   stop_

   loop_
      _Saveframe_category_type
      _Saveframe_category_type_count

      assigned_chemical_shifts 1 
      T2_relaxation            1 

   stop_

   loop_
      _Data_type
      _Data_type_count

      "1H chemical shifts"   134 
      "13C chemical shifts"  383 
      "15N chemical shifts"  135 
      "T2 relaxation values" 129 

   stop_

   loop_
      _Revision_date
      _Revision_keyword
      _Revision_author
      _Revision_detail

      2011-03-24 update   BMRB   'update entry citation' 
      2010-09-28 original author 'original release'      

   stop_

   loop_
      _Related_BMRB_accession_number
      _Relationship

      16300  aSyn            
      16342  aSyn-pH3        
      16547 'aSyn E46K-pH6'  
       6968  aSyn-protonless 
       7244  gSyn            

   stop_

save_


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

save_entry_citation
   _Saveframe_category           entry_citation

   _Citation_full                .
   _Citation_title              'Backbone assignment and dynamics of human -synuclein in viscous 2M glucose solution.'
   _Citation_status              published
   _Citation_type                journal
   _CAS_abstract_code            .
   _MEDLINE_UI_code              .
   _PubMed_ID                    20872101

   loop_
      _Author_ordinal
      _Author_family_name
      _Author_given_name
      _Author_middle_initials
      _Author_family_title

      1 Wu   Kuen-Phon . . 
      2 Baum Jean      . . 

   stop_

   _Journal_abbreviation        'Biomol. NMR Assignments'
   _Journal_name_full           'Biomolecular NMR assignments'
   _Journal_volume               5
   _Journal_issue                1
   _Journal_CSD                  .
   _Book_chapter_title           .
   _Book_volume                  .
   _Book_series                  .
   _Book_ISBN                    .
   _Conference_state_province    .
   _Conference_abstract_number   .
   _Page_first                   43
   _Page_last                    46
   _Year                         2011
   _Details                      .

   loop_
      _Keyword

      'intrinsically disordered' 
       Parkinson                 
       synuclein                 

   stop_

save_


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

save_assembly
   _Saveframe_category         molecular_system

   _Mol_system_name            alpha-synuclein
   _Enzyme_commission_number   .

   loop_
      _Mol_system_component_name
      _Mol_label

      alpha-synuclein $alpha-synuclein 

   stop_

   _System_molecular_weight    .
   _System_physical_state      native
   _System_oligomer_state      ?
   _System_paramagnetic        no
   _System_thiol_state         .
   _Database_query_date        .
   _Details                    .

save_


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

save_alpha-synuclein
   _Saveframe_category                          monomeric_polymer

   _Mol_type                                    polymer
   _Mol_polymer_class                           protein
   _Name_common                                 alpha-synuclein
   _Molecular_mass                              .
   _Mol_thiol_state                            'not available'
   _Details                                     .

   	##############################
   	#  Polymer residue sequence  #
   	##############################
   
      _Residue_count                               140
   _Mol_residue_sequence                       
;
MDVFMKGLSKAKEGVVAAAE
KTKQGVAEAAGKTKEGVLYV
GSKTKEGVVHGVATVAEKTK
EQVTNVGGAVVTGVTAVAQK
TVEGAGSIAAATGFVKKDQL
GKNEEGAPQEGILEDMPVDP
DNEAYEMPSEEGYQDYEPEA
;

   loop_
      _Residue_seq_code
      _Residue_label

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

   stop_

   _Sequence_homology_query_date                .
   _Sequence_homology_query_revised_last_date   2015-10-07

   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        16300  alpha-synuclein                                                                                                                  100.00 140 100.00 100.00 1.13e-89 
      BMRB        16302  alpha-synuclein                                                                                                                  100.00 140 100.00 100.00 1.13e-89 
      BMRB        16342  human_a-synuclein                                                                                                                100.00 140 100.00 100.00 1.13e-89 
      BMRB        16543 "monomer alpha-synuclein"                                                                                                         100.00 140 100.00 100.00 1.13e-89 
      BMRB        16546  A30P_alpha-synuclein                                                                                                             100.00 140  99.29  99.29 9.92e-89 
      BMRB        16547  E46K_alpha-synuclein                                                                                                             100.00 140  99.29 100.00 4.77e-89 
      BMRB        16548  A53T_alpha-synuclein                                                                                                             100.00 140  99.29  99.29 3.97e-89 
      BMRB        16939  WT_alpha-synuclein_fibrils                                                                                                       100.00 140  99.29  99.29 2.02e-88 
      BMRB        17214  A30P_alpha-synuclein                                                                                                             100.00 140  99.29  99.29 9.92e-89 
      BMRB        17498  alpha-synuclein                                                                                                                  100.00 140 100.00 100.00 1.13e-89 
      BMRB        17648  A30P_alpha-synuclein                                                                                                             100.00 140  98.57  98.57 2.16e-87 
      BMRB        17649  A53T_alpha-synuclein_fibrils                                                                                                     100.00 140  98.57  98.57 7.32e-88 
      BMRB        17654  E46K_alpha-synuclein_fibrils                                                                                                     100.00 140  98.57  99.29 8.52e-88 
      BMRB        17665  aSyn                                                                                                                             100.00 150 100.00 100.00 5.06e-89 
      BMRB        17910  wild-type_alpha-synuclein_formed_in_phospholipid_vesicles                                                                        100.00 140  99.29  99.29 2.02e-88 
      BMRB        18207  A53T_alpha-synuclein_fibrils                                                                                                     100.00 140  98.57  98.57 7.32e-88 
      BMRB        18208  E46K_alpha-synuclein_fibrils                                                                                                     100.00 140  98.57  99.29 8.52e-88 
      BMRB        18243  alpha-synuclein_fibrils                                                                                                          100.00 140  99.29  99.29 2.02e-88 
      BMRB        18857  alpha_synuclein                                                                                                                  100.00 140 100.00 100.00 1.13e-89 
      BMRB        18860  a-synuclein                                                                                                                      100.00 140 100.00 100.00 1.13e-89 
      BMRB        19257  Alpha-synuclein                                                                                                                  100.00 140 100.00 100.00 1.13e-89 
      BMRB        19337  aSyn                                                                                                                             100.00 140 100.00 100.00 1.13e-89 
      BMRB        19338  aSyn_A53T                                                                                                                        100.00 140  99.29  99.29 3.97e-89 
      BMRB        19344  aSyn_S87N                                                                                                                        100.00 140  99.29 100.00 4.33e-89 
      BMRB        19345  aSyn_A53T&S87N                                                                                                                   100.00 140  98.57  99.29 1.93e-88 
      BMRB        19350  acet_aSyn                                                                                                                        100.00 140 100.00 100.00 1.13e-89 
      BMRB        19351  acet_aSyn_A53T                                                                                                                   100.00 140  99.29  99.29 3.97e-89 
      BMRB        25227  aSyn-WT                                                                                                                          100.00 140 100.00 100.00 1.13e-89 
      BMRB        25228  H50Q                                                                                                                             100.00 140  99.29  99.29 1.71e-88 
      PDB  1XQ8          "Human Micelle-Bound Alpha-Synuclein"                                                                                             100.00 140 100.00 100.00 1.13e-89 
      PDB  2KKW          "Slas-Micelle Bound Alpha-Synuclein"                                                                                              100.00 140 100.00 100.00 1.13e-89 
      DBJ  BAB29375      "unnamed protein product [Mus musculus]"                                                                                           72.86 122  97.06  99.02 2.54e-56 
      DBJ  BAF82858      "unnamed protein product [Homo sapiens]"                                                                                          100.00 140 100.00 100.00 1.13e-89 
      DBJ  BAG73790      "synuclein, alpha [synthetic construct]"                                                                                          100.00 140 100.00 100.00 1.13e-89 
      EMBL CAG33339      "SNCA [Homo sapiens]"                                                                                                             100.00 140 100.00 100.00 1.13e-89 
      EMBL CAG46454      "SNCA [Homo sapiens]"                                                                                                             100.00 140 100.00 100.00 1.13e-89 
      GB   AAA16117      "AD amyloid [Homo sapiens]"                                                                                                       100.00 140 100.00 100.00 1.13e-89 
      GB   AAC02114      "NACP/alpha-synuclein [Homo sapiens]"                                                                                             100.00 140  98.57  98.57 5.63e-88 
      GB   AAG30302      "SNCA isoform NACP140 [Homo sapiens]"                                                                                             100.00 140 100.00 100.00 1.13e-89 
      GB   AAH13293      "Synuclein, alpha (non A4 component of amyloid precursor) [Homo sapiens]"                                                         100.00 140 100.00 100.00 1.13e-89 
      GB   AAI08276      "Synuclein, alpha (non A4 component of amyloid precursor) [Homo sapiens]"                                                         100.00 140 100.00 100.00 1.13e-89 
      REF  NP_000336     "alpha-synuclein isoform NACP140 [Homo sapiens]"                                                                                  100.00 140 100.00 100.00 1.13e-89 
      REF  NP_001009158  "alpha-synuclein [Pan troglodytes]"                                                                                               100.00 140 100.00 100.00 1.13e-89 
      REF  NP_001032222  "alpha-synuclein [Sus scrofa]"                                                                                                    100.00 140  97.86  97.86 1.57e-86 
      REF  NP_001129014  "alpha-synuclein [Pongo abelii]"                                                                                                  100.00 140  99.29  99.29 1.89e-88 
      REF  NP_001139526  "alpha-synuclein isoform NACP140 [Homo sapiens]"                                                                                  100.00 140 100.00 100.00 1.13e-89 
      SP   P37840        "RecName: Full=Alpha-synuclein; AltName: Full=Non-A beta component of AD amyloid; AltName: Full=Non-A4 component of amyloid prec" 100.00 140 100.00 100.00 1.13e-89 
      SP   P61139        "RecName: Full=Alpha-synuclein"                                                                                                   100.00 140  99.29 100.00 2.37e-89 
      SP   P61140        "RecName: Full=Alpha-synuclein"                                                                                                   100.00 140 100.00 100.00 1.13e-89 
      SP   P61142        "RecName: Full=Alpha-synuclein"                                                                                                   100.00 140  98.57 100.00 3.29e-89 
      SP   P61143        "RecName: Full=Alpha-synuclein"                                                                                                   100.00 140  98.57 100.00 3.29e-89 

   stop_

save_


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

save_natural_source
   _Saveframe_category   natural_source


   loop_
      _Mol_label
      _Organism_name_common
      _NCBI_taxonomy_ID
      _Superkingdom
      _Kingdom
      _Genus
      _Species

      $alpha-synuclein 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
      _Variant
      _Vector_name

      $alpha-synuclein 'recombinant technology' . Escherichia coli BL21 DE3 p7-T7 

   stop_

save_


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

save_13C-15N
   _Saveframe_category   sample

   _Sample_type          solution
   _Details             'used for triple resonance experiments'

   loop_
      _Mol_label
      _Concentration_value
      _Concentration_value_units
      _Concentration_min_value
      _Concentration_max_value
      _Isotopic_labeling

      $alpha-synuclein    . mM 0.3 0.4 '[U-100% 13C; U-100% 15N]' 
       H20              80 %   .   .  'natural abundance'        
       D20              20 %   .   .  'natural abundance'        
       glucose           2 M   .   .  'natural abundance'        
       phosphate        10 mM  .   .  'natural abundance'        
       NaCl            138 mM  .   .  'natural abundance'        
       KCl               2 mM  .   .  'natural abundance'        

   stop_

save_


save_15N
   _Saveframe_category   sample

   _Sample_type          solution
   _Details             'used for regular 15N-edited spectra and 15N dynamics'

   loop_
      _Mol_label
      _Concentration_value
      _Concentration_value_units
      _Concentration_min_value
      _Concentration_max_value
      _Isotopic_labeling

      $alpha-synuclein    . mM 0.1 0.2 '[U-100% 15N]'      
       H20              80 %   .   .  'natural abundance' 
       D20              20 %   .   .  'natural abundance' 
       glucose           2 M   .   .  'natural abundance' 
       phosphate        10 mM  .   .  'natural abundance' 
       NaCl            138 mM  .   .  'natural abundance' 
       KCl               2 mM  .   .  'natural abundance' 

   stop_

save_


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

save_VNMRJ
   _Saveframe_category   software

   _Name                 VNMRJ
   _Version              2.1

   loop_
      _Vendor
      _Address
      _Electronic_address

      Varian . . 

   stop_

   loop_
      _Task

      collection 

   stop_

   _Details             'data acquisition'

save_


save_NMRPipe
   _Saveframe_category   software

   _Name                 NMRPipe
   _Version              .

   loop_
      _Vendor
      _Address
      _Electronic_address

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

   stop_

   loop_
      _Task

      processing 

   stop_

   _Details              .

save_


save_SPARKY
   _Saveframe_category   software

   _Name                 SPARKY
   _Version              .

   loop_
      _Vendor
      _Address
      _Electronic_address

      Goddard . . 

   stop_

   loop_
      _Task

      'chemical shift assignment' 
      'data analysis'             

   stop_

   _Details              .

save_


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

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

save_spectrometer_1
   _Saveframe_category   NMR_spectrometer

   _Manufacturer         Varian
   _Model                INOVA
   _Field_strength       800
   _Details              .

save_


save_spectrometer_2
   _Saveframe_category   NMR_spectrometer

   _Manufacturer         Varian
   _Model                INOVA
   _Field_strength       600
   _Details              .

save_


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

save_2D_1H-15N_HSQC_1
   _Saveframe_category   NMR_applied_experiment

   _Experiment_name     '2D 1H-15N HSQC'
   _Sample_label        $15N

save_


save_3D_CBCA(CO)NH_2
   _Saveframe_category   NMR_applied_experiment

   _Experiment_name     '3D CBCA(CO)NH'
   _Sample_label        $13C-15N

save_


save_3D_HNCO_3
   _Saveframe_category   NMR_applied_experiment

   _Experiment_name     '3D HNCO'
   _Sample_label        $13C-15N

save_


save_3D_HNCACB_4
   _Saveframe_category   NMR_applied_experiment

   _Experiment_name     '3D HNCACB'
   _Sample_label        $13C-15N

save_


save_3D_HN(CA)CO_5
   _Saveframe_category   NMR_applied_experiment

   _Experiment_name     '3D HN(CA)CO'
   _Sample_label        $13C-15N

save_


save_2D_1H-15N_HSQC_6
   _Saveframe_category   NMR_applied_experiment

   _Experiment_name     '2D 1H-15N HSQC'
   _Sample_label        $15N

save_


save_3D_HNN_7
   _Saveframe_category   NMR_applied_experiment

   _Experiment_name     '3D HNN'
   _Sample_label        $13C-15N

save_


save_T2_8
   _Saveframe_category   NMR_applied_experiment

   _Experiment_name      T2
   _Sample_label        $15N

save_


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

save_2_M_glucose_in_PBS
   _Saveframe_category   sample_conditions

   _Details             
;
2 M glucose 
10 mM phosphate 
138 mM NaCl 
2 mM KCl
;

   loop_
      _Variable_type
      _Variable_value
      _Variable_value_error
      _Variable_value_units

      'ionic strength' 150   . mM  
       pH                7.4 . pH  
       pressure          1   . atm 
       temperature     288   . K   

   stop_

save_


####################
#  NMR parameters  #
####################

    ##############################
    #  Assigned chemical shifts  #
    ##############################

	################################
	#  Chemical shift referencing  #
	################################

save_DSS
   _Saveframe_category   chemical_shift_reference

   _Details              .

   loop_
      _Mol_common_name
      _Atom_type
      _Atom_isotope_number
      _Atom_group
      _Chem_shift_units
      _Chem_shift_value
      _Reference_method
      _Reference_type
      _External_reference_sample_geometry
      _External_reference_location
      _External_reference_axis
      _Indirect_shift_ratio

      DSS C 13 'methyl protons' ppm 0.00 na       indirect .  .                                                                  . 0.251449530 
      DSS H  1 'methyl protons' ppm 0.00 internal direct   . 'separate tube (no insert) similar to the experimental sample tube' . 1.000000000 
      DSS N 15 'methyl protons' ppm 0.00 na       indirect .  .                                                                  . 0.101329118 

   stop_

save_


	###################################
	#  Assigned chemical shift lists  #
	###################################

###################################################################
#       Chemical Shift Ambiguity Index Value Definitions          #
#                                                                 #
# The values other than 1 are used for those atoms with different #
# chemical shifts that cannot be assigned to stereospecific atoms #
# or to specific residues or chains.                              #
#                                                                 #
#   Index Value            Definition                             #
#                                                                 #
#      1             Unique (including isolated methyl protons,   #
#                         geminal atoms, and geminal methyl       #
#                         groups with identical chemical shifts)  #
#                         (e.g. ILE HD11, HD12, HD13 protons)     #
#      2             Ambiguity of geminal atoms or geminal methyl #
#                         proton groups (e.g. ASP HB2 and HB3     #
#                         protons, LEU CD1 and CD2 carbons, or    #
#                         LEU HD11, HD12, HD13 and HD21, HD22,    #
#                         HD23 methyl protons)                    #
#      3             Aromatic atoms on opposite sides of          #
#                         symmetrical rings (e.g. TYR HE1 and HE2 #
#                         protons)                                #
#      4             Intraresidue ambiguities (e.g. LYS HG and    #
#                         HD protons or TRP HZ2 and HZ3 protons)  #
#      5             Interresidue ambiguities (LYS 12 vs. LYS 27) #
#      6             Intermolecular ambiguities (e.g. ASP 31 CA   #
#                         in monomer 1 and ASP 31 CA in monomer 2 #
#                         of an asymmetrical homodimer, duplex    #
#                         DNA assignments, or other assignments   #
#                         that may apply to atoms in one or more  #
#                         molecule in the molecular assembly)     #
#      9             Ambiguous, specific ambiguity not defined    #
#                                                                 #
###################################################################
save_synuclein_glucose
   _Saveframe_category               assigned_chemical_shifts

   _Details                          .

   loop_
      _Software_label

      $SPARKY 

   stop_

   loop_
      _Experiment_label

      '2D 1H-15N HSQC' 
      '3D CBCA(CO)NH'  
      '3D HNCO'        
      '3D HNCACB'      
      '3D HN(CA)CO'    
      '3D HNN'         

   stop_

   loop_
      _Sample_label

      $15N     
      $13C-15N 

   stop_

   _Sample_conditions_label         $2_M_glucose_in_PBS
   _Chem_shift_reference_set_label  $DSS
   _Mol_system_component_name        alpha-synuclein
   _Text_data_format                 .
   _Text_data                        .

   loop_
      _Atom_shift_assign_ID
      _Residue_author_seq_code
      _Residue_seq_code
      _Residue_label
      _Atom_name
      _Atom_type
      _Chem_shift_value
      _Chem_shift_value_error
      _Chem_shift_ambiguity_code

        1   1   1 MET CA C  59.99 0.1  1 
        2   1   1 MET CB C  34.63 0.1  1 
        3   1   1 MET N  N 119.8  0.07 1 
        4   2   2 ASP H  H   8.65 0.02 1 
        5   2   2 ASP C  C 176.35 0.07 1 
        6   2   2 ASP CA C  54.44 0.1  1 
        7   2   2 ASP CB C  41.58 0.1  1 
        8   2   2 ASP N  N 125.2  0.07 1 
        9   3   3 VAL H  H   8.20 0.02 1 
       10   3   3 VAL C  C 176.24 0.07 1 
       11   3   3 VAL CA C  62.60 0.1  1 
       12   3   3 VAL CB C  32.85 0.1  1 
       13   3   3 VAL N  N 120.3  0.07 1 
       14   4   4 PHE H  H   8.17 0.02 1 
       15   4   4 PHE C  C 175.67 0.07 1 
       16   4   4 PHE CB C  41.09 0.1  1 
       17   4   4 PHE N  N 123.9  0.07 1 
       18   5   5 MET H  H   8.18 0.02 1 
       19   5   5 MET CA C  55.43 0.1  1 
       20   5   5 MET CB C  32.70 0.1  1 
       21   5   5 MET N  N 121.9  0.07 1 
       22   6   6 LYS H  H   8.20 0.02 1 
       23   6   6 LYS C  C 177.13 0.07 1 
       24   6   6 LYS CA C  56.86 0.1  1 
       25   6   6 LYS CB C  32.77 0.1  1 
       26   6   6 LYS N  N 122.2  0.07 1 
       27   7   7 GLY H  H   8.37 0.02 1 
       28   7   7 GLY C  C 174.25 0.07 1 
       29   7   7 GLY CA C  45.44 0.1  1 
       30   7   7 GLY N  N 109.8  0.07 1 
       31   8   8 LEU H  H   8.27 0.02 1 
       32   8   8 LEU C  C 177.57 0.07 1 
       33   8   8 LEU CA C  55.21 0.1  1 
       34   8   8 LEU CB C  42.51 0.1  1 
       35   8   8 LEU N  N 121.5  0.07 1 
       36   9   9 SER H  H   8.27 0.02 1 
       37   9   9 SER C  C 174.53 0.07 1 
       38   9   9 SER CA C  58.40 0.1  1 
       39   9   9 SER CB C  63.69 0.1  1 
       40   9   9 SER N  N 116.6  0.07 1 
       41  10  10 LYS H  H   8.30 0.02 1 
       42  10  10 LYS C  C 176.44 0.07 1 
       43  10  10 LYS CA C  56.35 0.1  1 
       44  10  10 LYS CB C  33.00 0.1  1 
       45  10  10 LYS N  N 123.5  0.07 1 
       46  11  11 ALA H  H   8.23 0.02 1 
       47  11  11 ALA C  C 177.91 0.07 1 
       48  11  11 ALA CA C  52.84 0.1  1 
       49  11  11 ALA CB C  19.20 0.1  1 
       50  11  11 ALA N  N 125.0  0.07 1 
       51  12  12 LYS H  H   8.25 0.02 1 
       52  12  12 LYS C  C 176.66 0.07 1 
       53  12  12 LYS CA C  56.43 0.1  1 
       54  12  12 LYS CB C  33.04 0.1  1 
       55  12  12 LYS N  N 120.6  0.07 1 
       56  13  13 GLU H  H   8.38 0.02 1 
       57  13  13 GLU C  C 177.02 0.07 1 
       58  13  13 GLU CA C  56.82 0.1  1 
       59  13  13 GLU CB C  30.16 0.1  1 
       60  13  13 GLU N  N 121.9  0.07 1 
       61  14  14 GLY H  H   8.40 0.02 9 
       62  14  14 GLY C  C 174.10 0.07 1 
       63  14  14 GLY CA C  45.43 0.1  1 
       64  14  14 GLY N  N 110.0  0.07 9 
       65  15  15 VAL H  H   7.91 0.02 1 
       66  15  15 VAL C  C 176.47 0.07 1 
       67  15  15 VAL CA C  62.63 0.1  1 
       68  15  15 VAL CB C  32.71 0.1  1 
       69  15  15 VAL N  N 120.1  0.07 1 
       70  16  16 VAL H  H   8.21 0.02 1 
       71  16  16 VAL C  C 176.02 0.07 1 
       72  16  16 VAL CA C  62.38 0.1  1 
       73  16  16 VAL CB C  32.92 0.1  1 
       74  16  16 VAL N  N 124.8  0.07 1 
       75  17  17 ALA H  H   8.37 0.02 1 
       76  17  17 ALA C  C 177.69 0.07 1 
       77  17  17 ALA CA C  52.56 0.1  1 
       78  17  17 ALA CB C  19.31 0.1  1 
       79  17  17 ALA N  N 128.0  0.07 1 
       80  18  18 ALA H  H   8.25 0.02 1 
       81  18  18 ALA C  C 177.73 0.07 1 
       82  18  18 ALA CA C  52.86 0.1  1 
       83  18  18 ALA CB C  18.94 0.1  1 
       84  18  18 ALA N  N 123.4  0.07 1 
       85  19  19 ALA H  H   8.21 0.02 1 
       86  19  19 ALA C  C 178.27 0.07 1 
       87  19  19 ALA CA C  52.80 0.1  1 
       88  19  19 ALA CB C  19.07 0.1  1 
       89  19  19 ALA N  N 122.7  0.07 1 
       90  20  20 GLU H  H   8.25 0.02 1 
       91  20  20 GLU C  C 176.96 0.07 1 
       92  20  20 GLU CA C  56.87 0.1  1 
       93  20  20 GLU CB C  29.72 0.1  1 
       94  20  20 GLU N  N 119.8  0.07 1 
       95  21  21 LYS H  H   8.23 0.02 1 
       96  21  21 LYS C  C 177.18 0.07 1 
       97  21  21 LYS CA C  56.87 0.1  1 
       98  21  21 LYS CB C  32.77 0.1  1 
       99  21  21 LYS N  N 121.9  0.07 1 
      100  22  22 THR H  H   8.06 0.02 1 
      101  22  22 THR C  C 174.7  0.07 1 
      102  22  22 THR CA C  62.26 0.1  1 
      103  22  22 THR CB C  69.74 0.1  1 
      104  22  22 THR N  N 114.8  0.07 1 
      105  23  23 LYS H  H   8.25 0.02 1 
      106  23  23 LYS C  C 176.7  0.07 1 
      107  23  23 LYS CA C  56.66 0.1  1 
      108  23  23 LYS CB C  32.95 0.1  1 
      109  23  23 LYS N  N 123.5  0.07 1 
      110  24  24 GLN H  H   8.34 0.02 1 
      111  24  24 GLN C  C 176.56 0.07 1 
      112  24  24 GLN CA C  56.27 0.1  1 
      113  24  24 GLN CB C  29.96 0.1  1 
      114  24  24 GLN N  N 121.4  0.07 1 
      115  25  25 GLY H  H   8.42 0.02 1 
      116  25  25 GLY C  C 174.3  0.07 1 
      117  25  25 GLY CA C  45.49 0.1  1 
      118  25  25 GLY N  N 110.4  0.07 1 
      119  26  26 VAL H  H   7.95 0.02 1 
      120  26  26 VAL C  C 176.33 0.07 1 
      121  26  26 VAL CA C  62.51 0.1  1 
      122  26  26 VAL CB C  32.92 0.1  1 
      123  26  26 VAL N  N 119.7  0.07 1 
      124  27  27 ALA H  H   8.36 0.02 1 
      125  27  27 ALA C  C 178.13 0.07 1 
      126  27  27 ALA CA C  52.93 0.1  1 
      127  27  27 ALA CB C  19.38 0.1  1 
      128  27  27 ALA N  N 127.2  0.07 1 
      129  28  28 GLU H  H   8.34 0.02 1 
      130  28  28 GLU C  C 176.65 0.07 1 
      131  28  28 GLU CA C  56.65 0.1  1 
      132  28  28 GLU CB C  29.67 0.1  1 
      133  28  28 GLU N  N 120.3  0.07 1 
      134  29  29 ALA H  H   8.22 0.02 1 
      135  29  29 ALA C  C 177.68 0.07 1 
      136  29  29 ALA CA C  52.70 0.1  1 
      137  29  29 ALA CB C  19.25 0.1  1 
      138  29  29 ALA N  N 124.6  0.07 1 
      139  30  30 ALA H  H   8.17 0.02 1 
      140  30  30 ALA C  C 178.39 0.07 1 
      141  30  30 ALA CA C  52.85 0.1  1 
      142  30  30 ALA CB C  19.17 0.1  1 
      143  30  30 ALA N  N 122.6  0.07 1 
      144  31  31 GLY H  H   8.25 0.02 1 
      145  31  31 GLY C  C 174.17 0.07 1 
      146  31  31 GLY CA C  45.42 0.1  1 
      147  31  31 GLY N  N 107.7  0.07 1 
      148  32  32 LYS H  H   8.04 0.02 1 
      149  32  32 LYS C  C 176.92 0.07 1 
      150  32  32 LYS CA C  56.27 0.1  1 
      151  32  32 LYS CB C  33.30 0.1  1 
      152  32  32 LYS N  N 120.6  0.07 1 
      153  33  33 THR H  H   8.19 0.02 1 
      154  33  33 THR C  C 174.6  0.07 1 
      155  33  33 THR CA C  61.83 0.1  1 
      156  33  33 THR CB C  70.00 0.1  1 
      157  33  33 THR N  N 115.3  0.07 1 
      158  34  34 LYS H  H   8.38 0.02 1 
      159  34  34 LYS C  C 176.45 0.07 1 
      160  34  34 LYS CA C  56.60 0.1  1 
      161  34  34 LYS CB C  32.86 0.1  1 
      162  34  34 LYS N  N 123.6  0.07 1 
      163  35  35 GLU H  H   8.38 0.02 9 
      164  35  35 GLU C  C 176.29 0.07 1 
      165  35  35 GLU CA C  56.82 0.1  1 
      166  35  35 GLU CB C  30.27 0.1  1 
      167  35  35 GLU N  N 121.8  0.07 9 
      168  36  36 GLY H  H   8.38 0.02 9 
      169  36  36 GLY C  C 173.97 0.07 1 
      170  36  36 GLY CA C  45.34 0.1  1 
      171  36  36 GLY N  N 109.9  0.07 9 
      172  37  37 VAL H  H   7.83 0.02 1 
      173  37  37 VAL C  C 175.76 0.07 1 
      174  37  37 VAL CA C  62.16 0.1  1 
      175  37  37 VAL CB C  33.00 0.1  1 
      176  37  37 VAL N  N 119.5  0.07 1 
      177  38  38 LEU H  H   8.23 0.02 1 
      178  38  38 LEU C  C 176.51 0.07 1 
      179  38  38 LEU CA C  54.92 0.1  1 
      180  38  38 LEU CB C  42.64 0.1  1 
      181  38  38 LEU N  N 125.7  0.07 1 
      182  39  39 TYR H  H   8.23 0.02 1 
      183  39  39 TYR C  C 177.55 0.07 1 
      184  39  39 TYR CA C  57.80 0.1  1 
      185  39  39 TYR CB C  38.88 0.1  1 
      186  39  39 TYR N  N 122.3  0.07 1 
      187  40  40 VAL H  H   8.06 0.02 1 
      188  40  40 VAL C  C 176.12 0.07 1 
      189  40  40 VAL CA C  62.15 0.1  1 
      190  40  40 VAL CB C  32.87 0.1  1 
      191  40  40 VAL N  N 122.8  0.07 1 
      192  41  41 GLY H  H   8.04 0.02 1 
      193  41  41 GLY C  C 173.96 0.07 1 
      194  41  41 GLY CA C  45.31 0.1  1 
      195  41  41 GLY N  N 112.1  0.07 1 
      196  42  42 SER H  H   8.21 0.02 1 
      197  42  42 SER C  C 174.66 0.07 1 
      198  42  42 SER CA C  58.36 0.1  1 
      199  42  42 SER CB C  63.86 0.1  1 
      200  42  42 SER N  N 115.6  0.07 1 
      201  43  43 LYS H  H   8.42 0.02 1 
      202  43  43 LYS C  C 176.80 0.07 1 
      203  43  43 LYS CA C  56.45 0.1  1 
      204  43  43 LYS CB C  33.07 0.1  1 
      205  43  43 LYS N  N 123.3  0.07 1 
      206  44  44 THR H  H   8.13 0.02 1 
      207  44  44 THR C  C 174.66 0.07 1 
      208  44  44 THR CA C  62.05 0.1  1 
      209  44  44 THR CB C  70.06 0.1  1 
      210  44  44 THR N  N 115.2  0.07 1 
      211  45  45 LYS H  H   8.43 0.02 1 
      212  45  45 LYS C  C 176.41 0.07 1 
      213  45  45 LYS CA C  56.50 0.1  1 
      214  45  45 LYS CB C  33.14 0.1  1 
      215  45  45 LYS N  N 123.7  0.07 1 
      216  46  46 GLU H  H   8.25 0.02 1 
      217  46  46 GLU C  C 176.3  0.07 1 
      218  46  46 GLU CA C  56.91 0.1  1 
      219  46  46 GLU CB C  30.88 0.1  1 
      220  46  46 GLU N  N 126.2  0.07 1 
      221  47  47 GLY H  H   8.38 0.02 9 
      222  47  47 GLY C  C 173.85 0.07 1 
      223  47  47 GLY CA C  45.19 0.1  1 
      224  47  47 GLY N  N 109.9  0.07 9 
      225  48  48 VAL H  H   7.84 0.02 1 
      226  48  48 VAL C  C 176.65 0.07 1 
      227  48  48 VAL CA C  62.23 0.1  1 
      228  48  48 VAL CB C  32.85 0.1  1 
      229  48  48 VAL N  N 119.8  0.07 1 
      230  49  49 VAL H  H   8.24 0.02 1 
      231  49  49 VAL C  C 175.81 0.07 1 
      232  49  49 VAL CA C  62.22 0.1  1 
      233  49  49 VAL CB C  34.08 0.1  1 
      234  49  49 VAL N  N 124.8  0.07 1 
      235  50  50 HIS H  H   8.54 0.02 1 
      236  50  50 HIS C  C 175.11 0.07 1 
      237  50  50 HIS CA C  55.47 0.1  1 
      238  50  50 HIS CB C  29.11 0.1  1 
      239  50  50 HIS N  N 123.7  0.07 1 
      240  51  51 GLY H  H   8.40 0.02 1 
      241  51  51 GLY C  C 173.72 0.07 1 
      242  51  51 GLY CA C  45.19 0.1  1 
      243  51  51 GLY N  N 110.4  0.07 1 
      244  52  52 VAL H  H   8.01 0.02 1 
      245  52  52 VAL C  C 175.81 0.07 1 
      246  52  52 VAL CA C  62.04 0.1  1 
      247  52  52 VAL CB C  32.95 0.1  1 
      248  52  52 VAL N  N 119.4  0.07 1 
      249  53  53 ALA H  H   8.44 0.02 1 
      250  53  53 ALA C  C 177.74 0.07 1 
      251  53  53 ALA CA C  52.49 0.1  1 
      252  53  53 ALA CB C  19.48 0.1  1 
      253  53  53 ALA N  N 128.1  0.07 1 
      254  54  54 THR H  H   8.16 0.02 1 
      255  54  54 THR C  C 174.48 0.07 1 
      256  54  54 THR CA C  61.78 0.1  1 
      257  54  54 THR CB C  69.96 0.1  1 
      258  54  54 THR N  N 114.6  0.07 1 
      259  55  55 VAL H  H   8.16 0.02 1 
      260  55  55 VAL C  C 175.83 0.07 1 
      261  55  55 VAL CA C  62.23 0.1  1 
      262  55  55 VAL CB C  32.71 0.1  1 
      263  55  55 VAL N  N 122.8  0.07 1 
      264  56  56 ALA H  H   8.36 0.02 1 
      265  56  56 ALA C  C 177.76 0.07 1 
      266  56  56 ALA CA C  52.48 0.1  1 
      267  56  56 ALA CB C  19.31 0.1  1 
      268  56  56 ALA N  N 127.8  0.07 1 
      269  57  57 GLU H  H   8.30 0.02 1 
      270  57  57 GLU C  C 176.68 0.07 1 
      271  57  57 GLU CA C  56.65 0.1  1 
      272  57  57 GLU CB C  30.32 0.1  1 
      273  57  57 GLU N  N 120.6  0.07 1 
      274  58  58 LYS H  H   8.35 0.02 1 
      275  58  58 LYS C  C 176.94 0.07 1 
      276  58  58 LYS CA C  56.43 0.1  1 
      277  58  58 LYS CB C  33.14 0.1  1 
      278  58  58 LYS N  N 122.5  0.07 1 
      279  59  59 THR H  H   8.14 0.02 1 
      280  59  59 THR C  C 174.61 0.07 1 
      281  59  59 THR CA C  61.93 0.1  1 
      282  59  59 THR CB C  69.97 0.1  1 
      283  59  59 THR N  N 115.5  0.07 1 
      284  60  60 LYS H  H   8.29 0.02 1 
      285  60  60 LYS C  C 176.64 0.07 1 
      286  60  60 LYS CA C  56.35 0.1  1 
      287  60  60 LYS CB C  32.97 0.1  1 
      288  60  60 LYS N  N 123.4  0.07 1 
      289  61  61 GLU H  H   8.36 0.02 9 
      290  61  61 GLU C  C 176.37 0.07 1 
      291  61  61 GLU CA C  56.70 0.1  9 
      292  61  61 GLU CB C  30.27 0.1  9 
      293  61  61 GLU N  N 121.7  0.07 9 
      294  62  62 GLN H  H   8.33 0.02 1 
      295  62  62 GLN C  C 175.91 0.07 1 
      296  62  62 GLN N  N 121.5  0.07 9 
      297  63  63 VAL H  H   8.23 0.02 1 
      298  63  63 VAL C  C 176.26 0.07 1 
      299  63  63 VAL CA C  62.38 0.1  1 
      300  63  63 VAL CB C  32.77 0.1  1 
      301  63  63 VAL N  N 121.8  0.07 1 
      302  64  64 THR H  H   8.24 0.02 1 
      303  64  64 THR C  C 174.0  0.07 1 
      304  64  64 THR CA C  61.90 0.1  1 
      305  64  64 THR CB C  70.02 0.1  1 
      306  64  64 THR N  N 117.8  0.07 1 
      307  65  65 ASN H  H   8.45 0.02 1 
      308  65  65 ASN CA C  53.15 0.1  1 
      309  65  65 ASN CB C  38.93 0.1  1 
      310  65  65 ASN N  N 121.7  0.07 1 
      311  66  66 VAL H  H   8.17 0.02 1 
      312  66  66 VAL C  C 176.76 0.07 1 
      313  66  66 VAL CA C  62.56 0.1  1 
      314  66  66 VAL CB C  32.57 0.1  1 
      315  66  66 VAL N  N 120.4  0.07 1 
      316  67  67 GLY H  H   8.49 0.02 1 
      317  67  67 GLY C  C 174.64 0.07 1 
      318  67  67 GLY CA C  45.40 0.1  1 
      319  67  67 GLY N  N 112.6  0.07 1 
      320  68  68 GLY H  H   8.19 0.02 1 
      321  68  68 GLY C  C 173.7  0.07 1 
      322  68  68 GLY CA C  45.15 0.1  1 
      323  68  68 GLY N  N 108.9  0.07 1 
      324  69  69 ALA H  H   8.10 0.02 1 
      325  69  69 ALA C  C 177.55 0.07 1 
      326  69  69 ALA CA C  52.30 0.1  1 
      327  69  69 ALA CB C  19.45 0.1  1 
      328  69  69 ALA N  N 123.8  0.07 1 
      329  70  70 VAL H  H   8.15 0.02 1 
      330  70  70 VAL C  C 176.23 0.07 1 
      331  70  70 VAL CA C  62.36 0.1  1 
      332  70  70 VAL CB C  32.64 0.1  1 
      333  70  70 VAL N  N 120.3  0.07 1 
      334  71  71 VAL H  H   8.32 0.02 1 
      335  71  71 VAL C  C 176.17 0.07 1 
      336  71  71 VAL CA C  62.18 0.1  1 
      337  71  71 VAL CB C  32.86 0.1  1 
      338  71  71 VAL N  N 125.2  0.07 1 
      339  72  72 THR H  H   8.24 0.02 1 
      340  72  72 THR C  C 174.84 0.07 1 
      341  72  72 THR CA C  61.86 0.1  1 
      342  72  72 THR CB C  69.86 0.1  1 
      343  72  72 THR N  N 118.3  0.07 1 
      344  73  73 GLY H  H   8.38 0.02 1 
      345  73  73 GLY C  C 174.02 0.07 1 
      346  73  73 GLY CA C  45.27 0.1  1 
      347  73  73 GLY N  N 111.2  0.07 1 
      348  74  74 VAL H  H   8.02 0.02 1 
      349  74  74 VAL C  C 176.46 0.07 1 
      350  74  74 VAL CA C  62.25 0.1  1 
      351  74  74 VAL CB C  32.91 0.1  1 
      352  74  74 VAL N  N 119.4  0.07 1 
      353  75  75 THR H  H   8.23 0.02 1 
      354  75  75 THR C  C 174.04 0.07 1 
      355  75  75 THR CA C  61.92 0.1  1 
      356  75  75 THR CB C  69.86 0.1  1 
      357  75  75 THR N  N 118.6  0.07 1 
      358  76  76 ALA H  H   8.29 0.02 1 
      359  76  76 ALA C  C 177.53 0.07 1 
      360  76  76 ALA CA C  52.63 0.1  1 
      361  76  76 ALA CB C  19.38 0.1  1 
      362  76  76 ALA N  N 127.1  0.07 1 
      363  77  77 VAL H  H   8.06 0.02 1 
      364  77  77 VAL C  C 175.97 0.07 1 
      365  77  77 VAL CA C  62.23 0.1  1 
      366  77  77 VAL CB C  32.85 0.1  1 
      367  77  77 VAL N  N 119.7  0.07 1 
      368  78  78 ALA H  H   8.33 0.02 1 
      369  78  78 ALA C  C 178.13 0.07 1 
      370  78  78 ALA CA C  53.01 0.1  1 
      371  78  78 ALA CB C  19.09 0.1  1 
      372  78  78 ALA N  N 127.8  0.07 1 
      373  79  79 GLN H  H   8.30 0.02 1 
      374  79  79 GLN C  C 175.89 0.07 1 
      375  79  79 GLN CA C  55.92 0.1  1 
      376  79  79 GLN CB C  29.68 0.1  1 
      377  79  79 GLN N  N 120.1  0.07 1 
      378  80  80 LYS H  H   8.35 0.02 1 
      379  80  80 LYS C  C 176.62 0.07 1 
      380  80  80 LYS CA C  56.43 0.1  1 
      381  80  80 LYS CB C  33.05 0.1  1 
      382  80  80 LYS N  N 122.9  0.07 1 
      383  81  81 THR H  H   8.22 0.02 1 
      384  81  81 THR C  C 174.41 0.07 1 
      385  81  81 THR CA C  61.87 0.1  1 
      386  81  81 THR CB C  69.89 0.1  1 
      387  81  81 THR N  N 116.6  0.07 1 
      388  82  82 VAL H  H   8.22 0.02 1 
      389  82  82 VAL C  C 176.06 0.07 1 
      390  82  82 VAL CA C  62.34 0.1  1 
      391  82  82 VAL CB C  32.87 0.1  1 
      392  82  82 VAL N  N 122.8  0.07 1 
      393  83  83 GLU H  H   8.50 0.02 1 
      394  83  83 GLU C  C 176.95 0.07 1 
      395  83  83 GLU CA C  56.87 0.1  1 
      396  83  83 GLU CB C  30.24 0.1  1 
      397  83  83 GLU N  N 125.0  0.07 1 
      398  84  84 GLY H  H   8.44 0.02 1 
      399  84  84 GLY C  C 174.13 0.07 1 
      400  84  84 GLY CA C  45.35 0.1  1 
      401  84  84 GLY N  N 110.6  0.07 1 
      402  85  85 ALA H  H   8.20 0.02 1 
      403  85  85 ALA C  C 178.41 0.07 1 
      404  85  85 ALA CA C  52.89 0.1  1 
      405  85  85 ALA CB C  19.29 0.1  1 
      406  85  85 ALA N  N 123.9  0.07 1 
      407  86  86 GLY H  H   8.44 0.02 1 
      408  86  86 GLY C  C 174.29 0.07 1 
      409  86  86 GLY CA C  45.39 0.1  1 
      410  86  86 GLY N  N 108.2  0.07 1 
      411  87  87 SER H  H   8.10 0.02 1 
      412  87  87 SER C  C 174.67 0.07 1 
      413  87  87 SER CA C  58.33 0.1  1 
      414  87  87 SER CB C  63.90 0.1  1 
      415  87  87 SER N  N 115.7  0.07 1 
      416  88  88 ILE H  H   8.14 0.02 1 
      417  88  88 ILE C  C 176.23 0.07 1 
      418  88  88 ILE CA C  61.38 0.1  1 
      419  88  88 ILE CB C  38.69 0.1  1 
      420  88  88 ILE N  N 122.6  0.07 1 
      421  89  89 ALA H  H   8.29 0.02 1 
      422  89  89 ALA C  C 177.55 0.07 1 
      423  89  89 ALA CA C  52.67 0.1  1 
      424  89  89 ALA CB C  19.13 0.1  1 
      425  89  89 ALA N  N 127.8  0.07 1 
      426  90  90 ALA H  H   8.13 0.02 1 
      427  90  90 ALA C  C 177.70 0.07 1 
      428  90  90 ALA CA C  52.53 0.1  1 
      429  90  90 ALA CB C  19.25 0.1  1 
      430  90  90 ALA N  N 123.1  0.07 1 
      431  91  91 ALA H  H   8.21 0.02 1 
      432  91  91 ALA C  C 178.05 0.07 1 
      433  91  91 ALA CA C  52.65 0.1  1 
      434  91  91 ALA CB C  19.20 0.1  1 
      435  91  91 ALA N  N 123.2  0.07 1 
      436  92  92 THR H  H   8.02 0.02 1 
      437  92  92 THR C  C 175.08 0.07 1 
      438  92  92 THR CA C  61.93 0.1  1 
      439  92  92 THR CB C  69.88 0.1  1 
      440  92  92 THR N  N 112.3  0.07 1 
      441  93  93 GLY H  H   8.24 0.02 1 
      442  93  93 GLY C  C 173.60 0.07 1 
      443  93  93 GLY CA C  45.29 0.1  1 
      444  93  93 GLY N  N 110.7  0.07 1 
      445  94  94 PHE H  H   8.04 0.02 1 
      446  94  94 PHE C  C 175.39 0.07 1 
      447  94  94 PHE CA C  57.78 0.1  1 
      448  94  94 PHE CB C  39.68 0.1  1 
      449  94  94 PHE N  N 120.3  0.07 1 
      450  95  95 VAL H  H   8.01 0.02 1 
      451  95  95 VAL C  C 175.34 0.07 1 
      452  95  95 VAL CA C  61.92 0.1  1 
      453  95  95 VAL CB C  33.15 0.1  1 
      454  95  95 VAL N  N 123.5  0.07 1 
      455  96  96 LYS H  H   8.33 0.02 1 
      456  96  96 LYS C  C 176.44 0.07 1 
      457  96  96 LYS CA C  56.39 0.1  1 
      458  96  96 LYS CB C  33.14 0.1  1 
      459  96  96 LYS N  N 126.3  0.07 1 
      460  97  97 LYS H  H   8.41 0.02 1 
      461  97  97 LYS C  C 176.35 0.07 1 
      462  97  97 LYS CA C  56.58 0.1  1 
      463  97  97 LYS CB C  32.98 0.1  1 
      464  97  97 LYS N  N 123.6  0.07 1 
      465  98  98 ASP H  H   8.35 0.02 1 
      466  98  98 ASP C  C 176.16 0.07 1 
      467  98  98 ASP CA C  54.43 0.1  1 
      468  98  98 ASP CB C  41.05 0.1  1 
      469  98  98 ASP N  N 120.9  0.07 1 
      470  99  99 GLN H  H   8.26 0.02 1 
      471  99  99 GLN C  C 175.93 0.07 1 
      472  99  99 GLN CA C  55.78 0.1  1 
      473  99  99 GLN CB C  29.65 0.1  1 
      474  99  99 GLN N  N 119.9  0.07 1 
      475 100 100 LEU H  H   8.23 0.02 1 
      476 100 100 LEU C  C 177.91 0.07 1 
      477 100 100 LEU CA C  55.29 0.1  1 
      478 100 100 LEU CB C  42.16 0.1  1 
      479 100 100 LEU N  N 122.7  0.07 1 
      480 101 101 GLY H  H   8.43 0.02 1 
      481 101 101 GLY C  C 174.06 0.07 1 
      482 101 101 GLY CA C  45.35 0.1  1 
      483 101 101 GLY N  N 109.8  0.07 1 
      484 102 102 LYS H  H   8.15 0.02 1 
      485 102 102 LYS C  C 176.40 0.07 1 
      486 102 102 LYS CA C  56.17 0.1  1 
      487 102 102 LYS CB C  33.19 0.1  1 
      488 102 102 LYS N  N 120.7  0.07 1 
      489 103 103 ASN H  H   8.56 0.02 1 
      490 103 103 ASN CA C  53.38 0.1  1 
      491 103 103 ASN CB C  38.81 0.1  1 
      492 103 103 ASN N  N 119.9  0.07 1 
      493 104 104 GLU H  H   8.41 0.02 1 
      494 104 104 GLU C  C 176.45 0.07 1 
      495 104 104 GLU CA C  56.64 0.1  1 
      496 104 104 GLU CB C  30.21 0.1  1 
      497 104 104 GLU N  N 121.3  0.07 1 
      498 105 105 GLU H  H   8.40 0.02 1 
      499 105 105 GLU C  C 176.93 0.07 1 
      500 105 105 GLU CA C  56.58 0.1  1 
      501 105 105 GLU CB C  30.27 0.1  1 
      502 105 105 GLU N  N 121.8  0.07 1 
      503 106 106 GLY H  H   8.37 0.02 1 
      504 106 106 GLY C  C 173.4  0.07 1 
      505 106 106 GLY CA C  45.05 0.1  1 
      506 106 106 GLY N  N 110.2  0.07 1 
      507 107 107 ALA H  H   8.07 0.02 1 
      508 107 107 ALA C  C 175.49 0.07 1 
      509 107 107 ALA CA C  50.49 0.1  1 
      510 107 107 ALA CB C  18.37 0.1  1 
      511 107 107 ALA N  N 124.9  0.07 1 
      512 108 108 PRO CA C  63.10 0.1  1 
      513 108 108 PRO CB C  32.12 0.1  1 
      514 109 109 GLN H  H   8.51 0.02 1 
      515 109 109 GLN C  C 175.89 0.07 1 
      516 109 109 GLN CA C  55.81 0.1  1 
      517 109 109 GLN CB C  29.70 0.1  1 
      518 109 109 GLN N  N 121.1  0.07 1 
      519 110 110 GLU H  H   8.45 0.02 1 
      520 110 110 GLU C  C 176.75 0.07 1 
      521 110 110 GLU CA C  56.58 0.1  1 
      522 110 110 GLU CB C  30.54 0.1  1 
      523 110 110 GLU N  N 122.3  0.07 1 
      524 111 111 GLY H  H   8.42 0.02 1 
      525 111 111 GLY C  C 173.74 0.07 1 
      526 111 111 GLY CA C  45.27 0.1  1 
      527 111 111 GLY N  N 110.2  0.07 1 
      528 112 112 ILE H  H   7.94 0.02 1 
      529 112 112 ILE C  C 176.16 0.07 1 
      530 112 112 ILE CA C  60.90 0.1  1 
      531 112 112 ILE CB C  38.71 0.1  1 
      532 112 112 ILE N  N 120.1  0.07 1 
      533 113 113 LEU H  H   8.35 0.02 1 
      534 113 113 LEU C  C 177.03 0.07 1 
      535 113 113 LEU CA C  54.98 0.1  1 
      536 113 113 LEU CB C  42.39 0.1  1 
      537 113 113 LEU N  N 126.9  0.07 1 
      538 114 114 GLU H  H   8.37 0.02 1 
      539 114 114 GLU C  C 175.80 0.07 1 
      540 114 114 GLU CA C  56.45 0.1  1 
      541 114 114 GLU CB C  30.47 0.1  1 
      542 114 114 GLU N  N 122.1  0.07 1 
      543 115 115 ASP H  H   8.30 0.02 1 
      544 115 115 ASP C  C 174.89 0.07 1 
      545 115 115 ASP CA C  54.18 0.1  1 
      546 115 115 ASP CB C  41.13 0.1  1 
      547 115 115 ASP N  N 121.2  0.07 1 
      548 116 116 MET H  H   8.18 0.02 1 
      549 116 116 MET CB C  32.54 0.1  1 
      550 116 116 MET N  N 121.7  0.07 1 
      551 117 117 PRO CA C  62.76 0.1  1 
      552 117 117 PRO CB C  32.19 0.1  1 
      553 118 118 VAL H  H   8.21 0.02 1 
      554 118 118 VAL C  C 175.64 0.07 1 
      555 118 118 VAL CA C  61.89 0.1  1 
      556 118 118 VAL CB C  33.01 0.1  1 
      557 118 118 VAL N  N 120.6  0.07 1 
      558 119 119 ASP H  H   8.45 0.02 1 
      559 119 119 ASP C  C 174.58 0.07 1 
      560 119 119 ASP CA C  52.09 0.1  1 
      561 119 119 ASP CB C  41.12 0.1  1 
      562 119 119 ASP N  N 125.6  0.07 1 
      563 120 120 PRO CA C  63.28 0.1  1 
      564 120 120 PRO CB C  32.30 0.1  1 
      565 121 121 ASP H  H   8.33 0.02 1 
      566 121 121 ASP C  C 176.09 0.07 1 
      567 121 121 ASP CA C  54.51 0.1  1 
      568 121 121 ASP CB C  40.98 0.1  1 
      569 121 121 ASP N  N 119.2  0.07 1 
      570 122 122 ASN H  H   8.06 0.02 1 
      571 122 122 ASN CA C  53.45 0.1  1 
      572 122 122 ASN CB C  39.41 0.1  1 
      573 122 122 ASN N  N 119.1  0.07 1 
      574 123 123 GLU H  H   8.33 0.02 1 
      575 123 123 GLU C  C 175.99 0.07 1 
      576 123 123 GLU CA C  56.73 0.1  1 
      577 123 123 GLU CB C  29.98 0.1  1 
      578 123 123 GLU N  N 121.7  0.07 1 
      579 124 124 ALA H  H   8.17 0.02 1 
      580 124 124 ALA C  C 177.13 0.07 1 
      581 124 124 ALA CB C  19.24 0.1  1 
      582 124 124 ALA N  N 124.3  0.07 1 
      583 125 125 TYR H  H   7.96 0.02 1 
      584 125 125 TYR C  C 175.28 0.07 1 
      585 125 125 TYR CA C  57.66 0.1  1 
      586 125 125 TYR CB C  38.98 0.1  1 
      587 125 125 TYR N  N 119.9  0.07 1 
      588 126 126 GLU H  H   8.08 0.02 1 
      589 126 126 GLU C  C 175.38 0.07 1 
      590 126 126 GLU CA C  55.63 0.1  1 
      591 126 126 GLU CB C  30.69 0.1  1 
      592 126 126 GLU N  N 123.6  0.07 1 
      593 127 127 MET H  H   8.35 0.02 1 
      594 127 127 MET CA C  53.24 0.1  1 
      595 127 127 MET CB C  32.38 0.1  1 
      596 127 127 MET N  N 123.8  0.07 1 
      597 128 128 PRO CA C  62.96 0.1  1 
      598 128 128 PRO CB C  32.21 0.1  1 
      599 129 129 SER H  H   8.42 0.02 1 
      600 129 129 SER CA C  58.18 0.1  1 
      601 129 129 SER CB C  63.90 0.1  1 
      602 129 129 SER N  N 116.7  0.07 1 
      603 130 130 GLU H  H   8.51 0.02 1 
      604 130 130 GLU C  C 176.41 0.07 1 
      605 130 130 GLU CA C  56.51 0.1  1 
      606 130 130 GLU CB C  30.23 0.1  1 
      607 130 130 GLU N  N 123.0  0.07 1 
      608 131 131 GLU H  H   8.40 0.02 1 
      609 131 131 GLU C  C 176.88 0.07 1 
      610 131 131 GLU CA C  56.82 0.1  1 
      611 131 131 GLU CB C  30.17 0.1  1 
      612 131 131 GLU N  N 121.7  0.07 1 
      613 132 132 GLY H  H   8.35 0.02 1 
      614 132 132 GLY CA C  45.19 0.1  1 
      615 132 132 GLY N  N 109.9  0.07 1 
      616 133 133 TYR H  H   8.00 0.02 1 
      617 133 133 TYR C  C 175.66 0.07 1 
      618 133 133 TYR CA C  57.92 0.1  1 
      619 133 133 TYR CB C  39.17 0.1  1 
      620 133 133 TYR N  N 120.3  0.07 1 
      621 134 134 GLN H  H   8.20 0.02 1 
      622 134 134 GLN C  C 175.91 0.07 1 
      623 134 134 GLN CA C  55.83 0.1  1 
      624 134 134 GLN CB C  29.17 0.1  1 
      625 134 134 GLN N  N 122.6  0.07 1 
      626 135 135 ASP H  H   8.21 0.02 1 
      627 135 135 ASP C  C 175.39 0.07 1 
      628 135 135 ASP CA C  54.19 0.1  1 
      629 135 135 ASP CB C  41.09 0.1  1 
      630 135 135 ASP N  N 121.6  0.07 1 
      631 136 136 TYR H  H   7.98 0.02 1 
      632 136 136 TYR C  C 174.96 0.07 1 
      633 136 136 TYR CA C  57.51 0.1  1 
      634 136 136 TYR CB C  39.10 0.1  1 
      635 136 136 TYR N  N 120.4  0.07 1 
      636 137 137 GLU H  H   8.19 0.02 1 
      637 137 137 GLU C  C 173.64 0.07 1 
      638 137 137 GLU CA C  53.45 0.1  1 
      639 137 137 GLU CB C  30.26 0.1  1 
      640 137 137 GLU N  N 125.2  0.07 1 
      641 138 138 PRO CA C  62.93 0.1  1 
      642 138 138 PRO CB C  32.26 0.1  1 
      643 139 139 GLU H  H   8.46 0.02 1 
      644 139 139 GLU C  C 175.34 0.07 1 
      645 139 139 GLU CA C  56.49 0.1  1 
      646 139 139 GLU CB C  30.23 0.1  1 
      647 139 139 GLU N  N 121.4  0.07 1 
      648 140 140 ALA H  H   7.95 0.02 1 
      649 140 140 ALA C  C 172.54 0.07 1 
      650 140 140 ALA CA C  53.78 0.1  1 
      651 140 140 ALA CB C  20.37 0.1  1 
      652 140 140 ALA N  N 130.7  0.07 1 

   stop_

save_


save_heteronuclear_T2_list_1
   _Saveframe_category          T2_relaxation

   _Details                     .

   loop_
      _Software_label

      $SPARKY 

   stop_

   loop_
      _Sample_label

      $15N 
      $15N 

   stop_

   _Sample_conditions_label    $2_M_glucose_in_PBS
   _Spectrometer_frequency_1H   800
   _T2_coherence_type           Nz
   _T2_value_units              ms
   _Mol_system_component_name   alpha-synuclein
   _Text_data_format            .
   _Text_data                   .

   loop_
      _T2_ID
      _Residue_seq_code
      _Residue_label
      _Atom_name
      _T2_value
      _T2_value_error
      _Rex_value
      _Rex_error

        1   2 ASP N 179.1  3.99  . . 
        2   3 VAL N 157.7  3.71  . . 
        3   5 MET N 119.2  0.569 . . 
        4   6 LYS N 116.7  1.74  . . 
        5   7 GLY N 117.7  2.11  . . 
        6   8 LEU N 126.3  0.9   . . 
        7   9 SER N 126.1  1.13  . . 
        8  10 LYS N 107.2  1.32  . . 
        9  11 ALA N 124.8  4.37  . . 
       10  12 LYS N 110.3  2.1   . . 
       11  13 GLU N 115.4  0.346 . . 
       12  14 GLY N 128.7  1.37  . . 
       13  15 VAL N 121.0  0.503 . . 
       14  16 VAL N 118.6  2.14  . . 
       15  17 ALA N  92.24 1.99  . . 
       16  18 ALA N 117.8  1.79  . . 
       17  19 ALA N 132.1  1.16  . . 
       18  20 GLU N  93.82 5.5   . . 
       19  21 LYS N 108.3  2.51  . . 
       20  22 THR N 104.2  0.725 . . 
       21  23 LYS N 105.5  2.03  . . 
       22  24 GLN N 109.8  1.09  . . 
       23  25 GLY N 114.5  3.36  . . 
       24  26 VAL N 109.7  0.57  . . 
       25  27 ALA N 100.8  0.478 . . 
       26  28 GLU N 109.2  1.24  . . 
       27  29 ALA N 110.9  2.16  . . 
       28  30 ALA N 129.8  0.28  . . 
       29  31 GLY N 120    1.29  . . 
       30  32 LYS N 109.9  0.54  . . 
       31  33 THR N 110.7  0.46  . . 
       32  34 LYS N 108.5  1.31  . . 
       33  35 GLU N 115.1  0.46  . . 
       34  36 GLY N 113    0.97  . . 
       35  37 VAL N  99.73 0.80  . . 
       36  38 LEU N  96.99 2.74  . . 
       37  39 TYR N  96.48 0.94  . . 
       38  40 VAL N  92.75 1.34  . . 
       39  41 GLY N  96.08 0.91  . . 
       40  42 SER N 104.3  3.13  . . 
       41  43 LYS N 100.8  1.57  . . 
       42  44 THR N 106.2  0.38  . . 
       43  45 LYS N 108.7  1.34  . . 
       44  48 VAL N 118.2  0.79  . . 
       45  49 VAL N 115.2  2.1   . . 
       46  50 HIS N  91.17 2.25  . . 
       47  51 GLY N 106.1  3.2   . . 
       48  52 VAL N 127.4  0.77  . . 
       49  53 ALA N 122.2  1.14  . . 
       50  54 THR N 128.8  1.55  . . 
       51  55 VAL N 127.2  0.69  . . 
       52  56 ALA N 112.4  0.77  . . 
       53  57 GLU N 117.2  1.23  . . 
       54  58 LYS N 110.5  0.52  . . 
       55  59 THR N 113.2  2.53  . . 
       56  60 LYS N 118.6  3.53  . . 
       57  61 GLU N 110.3  0.78  . . 
       58  64 THR N 123.4  0.95  . . 
       59  65 ASN N 125.8  2.58  . . 
       60  66 VAL N 162    0.34  . . 
       61  67 GLY N 155.6  0.65  . . 
       62  68 GLY N 180.8  0.90  . . 
       63  69 ALA N 162.4  0.93  . . 
       64  70 VAL N 172.2  1.69  . . 
       65  71 VAL N 163.7  1.66  . . 
       66  72 THR N 144.1  0.58  . . 
       67  73 GLY N 143.2  2.87  . . 
       68  74 VAL N 144.1  0.64  . . 
       69  75 THR N 133.2  1.55  . . 
       70  76 ALA N 143.5  2.49  . . 
       71  77 VAL N 141.8  1.87  . . 
       72  78 ALA N 130.6  0.57  . . 
       73  79 GLN N 128.7  2.92  . . 
       74  80 LYS N 131.9  0.86  . . 
       75  81 THR N 136.7  0.88  . . 
       76  82 VAL N 135.6  1.09  . . 
       77  83 GLU N 148.2  1.92  . . 
       78  84 GLY N 150.8  1.49  . . 
       79  85 ALA N 159.6  0.99  . . 
       80  86 GLY N 174.3  2.88  . . 
       81  87 SER N 155.6  0.97  . . 
       82  88 ILE N 145.5  0.69  . . 
       83  89 ALA N 140.2  1.76  . . 
       84  90 ALA N 157.6  0.78  . . 
       85  91 ALA N 159.4  1.49  . . 
       86  92 THR N 139.6  1.53  . . 
       87  93 GLY N 132.8  1.95  . . 
       88  94 PHE N 129.5  0.59  . . 
       89  95 VAL N 125.2  0.61  . . 
       90  96 LYS N 119    0.87  . . 
       91  97 LYS N 109.8  0.38  . . 
       92  98 ASP N 109.9  0.90  . . 
       93  99 GLN N 113.1  0.60  . . 
       94 100 LEU N 130.8  1.46  . . 
       95 101 GLY N 136.8  1.95  . . 
       96 102 LYS N 129.1  1.43  . . 
       97 103 ASN N 125.2  0.48  . . 
       98 104 GLU N 135.1  1.48  . . 
       99 105 GLU N 125.6  0.42  . . 
      100 106 GLY N 149.1  1.35  . . 
      101 107 ALA N 148.1  1.73  . . 
      102 109 GLN N 143.8  1.19  . . 
      103 110 GLU N 142.8  0.62  . . 
      104 111 GLY N 135.2  1.61  . . 
      105 112 ILE N 130.6  0.37  . . 
      106 113 LEU N 121.7  0.68  . . 
      107 114 GLU N 127.7  1.65  . . 
      108 115 ASP N 125.2  2.88  . . 
      109 116 MET N 125.6  2.68  . . 
      110 118 VAL N 114.9  0.70  . . 
      111 119 ASP N 104.5  1.44  . . 
      112 121 ASP N  90    0.65  . . 
      113 122 ASN N 100.8  1.24  . . 
      114 123 GLU N 110.9  0.68  . . 
      115 124 ALA N 113.8  0.71  . . 
      116 125 TYR N 113.5  0.71  . . 
      117 126 GLU N 140    2.17  . . 
      118 127 MET N 120.5  1.64  . . 
      119 129 SER N 123    1.42  . . 
      120 130 GLU N 129.6  0.81  . . 
      121 131 GLU N 121.2  1.29  . . 
      122 132 GLY N 136.7  0.99  . . 
      123 133 TYR N 135.9  0.73  . . 
      124 134 GLN N 129.7  0.65  . . 
      125 135 ASP N 122.7  3.29  . . 
      126 136 TYR N 151.7  0.4   . . 
      127 137 GLU N 169.8  0.95  . . 
      128 139 GLU N 198.8  1.6   . . 
      129 140 ALA N 340.8  6.16  . . 

   stop_

save_