data_10083

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

save_entry_information
   _Saveframe_category      entry_information

   _Entry_title            
;
PDZ domain of human RIM2B
;
   _BMRB_accession_number   10083
   _BMRB_flat_file_name     bmr10083.str
   _Entry_type              original
   _Submission_date         2007-01-24
   _Accession_date          2007-01-24
   _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 Nagashima T. . . 
      2 Hayashi   F. . . 
      3 Yokoyama  S. . . 

   stop_

   loop_
      _Saveframe_category_type
      _Saveframe_category_type_count

      assigned_chemical_shifts 1 

   stop_

   loop_
      _Data_type
      _Data_type_count

      "1H chemical shifts"  757 
      "13C chemical shifts" 561 
      "15N chemical shifts" 136 

   stop_

   loop_
      _Revision_date
      _Revision_keyword
      _Revision_author
      _Revision_detail

      2008-08-14 original author . 

   stop_

   _Original_release_date   2008-08-14

save_


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

save_citation_1
   _Saveframe_category           entry_citation

   _Citation_full                .
   _Citation_title              'PDZ domain of human RIM2B'
   _Citation_status             'in preparation'
   _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 Nagashima T. . . 
      2 Hayashi   F. . . 
      3 Yokoyama  S. . . 

   stop_

   _Journal_abbreviation         .
   _Journal_volume               .
   _Journal_issue                .
   _Journal_CSD                  .
   _Book_chapter_title           .
   _Book_volume                  .
   _Book_series                  .
   _Book_ISBN                    .
   _Conference_state_province    .
   _Conference_abstract_number   .
   _Page_first                   .
   _Page_last                    .
   _Year                         .
   _Details                      .

save_


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

save_assembly
   _Saveframe_category         molecular_system

   _Mol_system_name           'Regulating synaptic membrane exocytosis protein 2'
   _Enzyme_commission_number   .

   loop_
      _Mol_system_component_name
      _Mol_label

      'Regulating synaptic membrane exocytosis protein 2' $entity_1 

   stop_

   _System_molecular_weight    .
   _System_physical_state      native
   _System_oligomer_state     'protein monomer'
   _System_paramagnetic        no
   _System_thiol_state        'all free'
   _Database_query_date        .
   _Details                    .

save_


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

save_entity_1
   _Saveframe_category                          monomeric_polymer

   _Mol_type                                    polymer
   _Mol_polymer_class                           protein
   _Name_common                                'PDZ domain'
   _Molecular_mass                              .
   _Mol_thiol_state                            'all free'
   _Details                                     .

   	##############################
   	#  Polymer residue sequence  #
   	##############################
   
      _Residue_count                               131
   _Mol_residue_sequence                       
;
GSSGSSGHSHSDKHPVTWQP
SKDGDRLIGRILLNKRLKDG
SVPRDSGAMLGLKVVGGKMT
ESGRLCAFITKVKKGSLADT
VGHLRPGDEVLEWNGRLLQG
ATFEEVYNIILESKPEPQVE
LVVSRSGPSSG
;

   loop_
      _Residue_seq_code
      _Residue_label

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

   stop_

   _Sequence_homology_query_date                .
   _Sequence_homology_query_revised_last_date   2015-07-08

   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

      PDB  1WFG         "Pdz Domain Of Human Rim2b"                                                                                                       100.00  131 100.00 100.00 2.27e-87 
      DBJ  BAA34471     "KIAA0751 protein [Homo sapiens]"                                                                                                  90.08 1200 100.00 100.00 5.74e-73 
      DBJ  BAB18975     "Rim2 [Mus musculus]"                                                                                                              90.08 1530 100.00 100.00 2.51e-72 
      DBJ  BAC98016     "mKIAA0751 protein [Mus musculus]"                                                                                                 85.50 1297 100.00 100.00 5.65e-68 
      DBJ  BAG10377     "regulating synaptic membrane exocytosis protein 2 [synthetic construct]"                                                          90.08 1188 100.00 100.00 5.17e-73 
      DBJ  BAG54403     "unnamed protein product [Homo sapiens]"                                                                                           85.50 1349 100.00 100.00 1.07e-67 
      EMBL CAH18227     "hypothetical protein [Homo sapiens]"                                                                                              85.50  471 100.00 100.00 8.49e-72 
      GB   AAC19157     "unknown [Homo sapiens]"                                                                                                           64.89  369 100.00 100.00 2.18e-49 
      GB   AAF81644     "RIM2 [Rattus norvegicus]"                                                                                                         85.50 1555 100.00 100.00 1.01e-67 
      GB   AAF81645     "RIM2-2A [Rattus norvegicus]"                                                                                                      85.50 1352 100.00 100.00 1.17e-67 
      GB   AAF81646     "RIM2-2B [Rattus norvegicus]"                                                                                                      89.31 1399  99.15 100.00 9.39e-71 
      GB   AAF81647     "RIM2-3A [Rattus norvegicus]"                                                                                                      85.50 1368 100.00 100.00 1.26e-67 
      REF  NP_001093587 "regulating synaptic membrane exocytosis protein 2 isoform a [Homo sapiens]"                                                       85.50 1349 100.00 100.00 1.07e-67 
      REF  NP_001243311 "regulating synaptic membrane exocytosis protein 2 isoform a [Mus musculus]"                                                       90.08 1572 100.00 100.00 2.01e-72 
      REF  NP_001243312 "regulating synaptic membrane exocytosis protein 2 isoform b [Mus musculus]"                                                       90.08 1550 100.00 100.00 1.82e-72 
      REF  NP_001269810 "regulating synaptic membrane exocytosis protein 2 isoform c [Homo sapiens]"                                                       90.08 1188 100.00 100.00 5.17e-73 
      REF  NP_055492    "regulating synaptic membrane exocytosis protein 2 isoform b [Homo sapiens]"                                                       85.50 1163 100.00 100.00 3.54e-68 
      SP   Q9EQZ7       "RecName: Full=Regulating synaptic membrane exocytosis protein 2; AltName: Full=Rab-3-interacting molecule 2; Short=RIM 2; AltNa"  90.08 1530 100.00 100.00 2.51e-72 
      SP   Q9JIS1       "RecName: Full=Regulating synaptic membrane exocytosis protein 2; AltName: Full=Rab-3-interacting molecule 2; Short=RIM 2"         85.50 1555 100.00 100.00 1.01e-67 
      SP   Q9UQ26       "RecName: Full=Regulating synaptic membrane exocytosis protein 2; AltName: Full=Rab-3-interacting molecule 2; Short=RIM 2; AltNa"  90.08 1411 100.00 100.00 2.32e-72 

   stop_

save_


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

save_natural_source
   _Saveframe_category   natural_source


   loop_
      _Mol_label
      _Organism_name_common
      _NCBI_taxonomy_ID
      _Superkingdom
      _Kingdom
      _Genus
      _Species

      $entity_1 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_type
      _Vector_name

      $entity_1 'cell free synthesis' . . . . plasmid P021030-35 

   stop_

save_


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

save_sample_1
   _Saveframe_category   sample

   _Sample_type          solution
   _Details              .

   loop_
      _Mol_label
      _Concentration_value
      _Concentration_value_units
      _Isotopic_labeling

      $entity_1   1.17 mM '[U-13C; U-15N]' 
       PiNa      20    mM  .               
       NaCl     100    mM  .               
       DTT        1    mM  .               
       NaN3       0.02 %   .               
       H2O       90    %   .               
       D2O       10    %   .               

   stop_

save_


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

save_software_1
   _Saveframe_category   software

   _Name                 VNMR
   _Version              6.1C

   loop_
      _Vendor
      _Address
      _Electronic_address

      Varian . . 

   stop_

   loop_
      _Task

      collection 

   stop_

   _Details              .

save_


save_software_2
   _Saveframe_category   software

   _Name                 NMRPipe
   _Version              20020425

   loop_
      _Vendor
      _Address
      _Electronic_address

      'Delaglio, F.' . . 

   stop_

   loop_
      _Task

      processing 

   stop_

   _Details              .

save_


save_software_3
   _Saveframe_category   software

   _Name                 NMRView
   _Version              5.0.4

   loop_
      _Vendor
      _Address
      _Electronic_address

      'Johnson, B.A.' . . 

   stop_

   loop_
      _Task

      'data analysis' 

   stop_

   _Details              .

save_


save_software_4
   _Saveframe_category   software

   _Name                 Kujira
   _Version              0.8992

   loop_
      _Vendor
      _Address
      _Electronic_address

      'Kobayashi, N.' . . 

   stop_

   loop_
      _Task

      'data analysis' 

   stop_

   _Details              .

save_


save_software_5
   _Saveframe_category   software

   _Name                 CYANA
   _Version              1.0.7

   loop_
      _Vendor
      _Address
      _Electronic_address

      'Guntert, P.' . . 

   stop_

   loop_
      _Task

       refinement          
      'structure solution' 

   stop_

   _Details              .

save_


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

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

save_spectrometer_1
   _Saveframe_category   NMR_spectrometer

   _Manufacturer         Varian
   _Model                INOVA
   _Field_strength       800
   _Details              .

save_


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

save_3D_13C-separated_NOESY_1
   _Saveframe_category   NMR_applied_experiment

   _Experiment_name     '3D 13C-separated NOESY'
   _Sample_label        $sample_1

save_


save_3D_15N-separated_NOESY_2
   _Saveframe_category   NMR_applied_experiment

   _Experiment_name     '3D 15N-separated NOESY'
   _Sample_label        $sample_1

save_


save_3D_13C-separated_NOESY
   _Saveframe_category                     NMR_applied_experiment

   _Experiment_name                       '3D 13C-separated NOESY'
   _BMRB_pulse_sequence_accession_number   .
   _Details                                .

save_


save_3D_15N-separated_NOESY
   _Saveframe_category                     NMR_applied_experiment

   _Experiment_name                       '3D 15N-separated NOESY'
   _BMRB_pulse_sequence_accession_number   .
   _Details                                .

save_


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

save_condition_1
   _Saveframe_category   sample_conditions

   _Details              .

   loop_
      _Variable_type
      _Variable_value
      _Variable_value_error
      _Variable_value_units

      'ionic strength' 120   0.1   mM  
       pH                6.0 0.05  pH  
       pressure          1   0.001 atm 
       temperature     298   0.1   K   

   stop_

save_


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

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

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

save_reference_1
   _Saveframe_category   chemical_shift_reference

   _Details             
;
Chemical shift reference of 1H was based on the proton of water (4.784ppm at 
298K) and then those of 15N and 13C were calculated based on their gyromagnetic 
ratios.
;

   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 0.0 . indirect . . . 0.251449530 
      DSS H  1 'methyl protons' ppm 0.0 . indirect . . . 1.0         
      DSS N 15 'methyl protons' ppm 0.0 . 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_chemical_shift_1
   _Saveframe_category               assigned_chemical_shifts

   _Details                          .

   loop_
      _Experiment_label

      '3D 13C-separated NOESY' 
      '3D 15N-separated NOESY' 

   stop_

   loop_
      _Sample_label

      $sample_1 

   stop_

   _Sample_conditions_label         $condition_1
   _Chem_shift_reference_set_label  $reference_1
   _Mol_system_component_name       'Regulating synaptic membrane exocytosis protein 2'
   _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   2   2 SER HA   H   4.565 0.030 1 
         2   2   2 SER HB2  H   3.901 0.030 1 
         3   2   2 SER HB3  H   3.901 0.030 1 
         4   2   2 SER C    C 174.787 0.300 1 
         5   2   2 SER CA   C  58.345 0.300 1 
         6   2   2 SER CB   C  64.010 0.300 1 
         7   3   3 SER H    H   8.585 0.030 1 
         8   3   3 SER HA   H   4.504 0.030 1 
         9   3   3 SER HB2  H   3.906 0.030 1 
        10   3   3 SER HB3  H   3.906 0.030 1 
        11   3   3 SER C    C 175.096 0.300 1 
        12   3   3 SER CA   C  58.624 0.300 1 
        13   3   3 SER CB   C  63.852 0.300 1 
        14   3   3 SER N    N 118.136 0.300 1 
        15   4   4 GLY H    H   8.479 0.030 1 
        16   4   4 GLY HA2  H   4.015 0.030 1 
        17   4   4 GLY HA3  H   4.015 0.030 1 
        18   4   4 GLY C    C 174.369 0.300 1 
        19   4   4 GLY CA   C  45.460 0.300 1 
        20   4   4 GLY N    N 110.916 0.300 1 
        21   5   5 SER H    H   8.290 0.030 1 
        22   5   5 SER HA   H   4.496 0.030 1 
        23   5   5 SER HB2  H   3.892 0.030 1 
        24   5   5 SER HB3  H   3.892 0.030 1 
        25   5   5 SER C    C 174.887 0.300 1 
        26   5   5 SER CA   C  58.361 0.300 1 
        27   5   5 SER CB   C  63.906 0.300 1 
        28   5   5 SER N    N 115.761 0.300 1 
        29   6   6 SER H    H   8.433 0.030 1 
        30   6   6 SER HA   H   4.467 0.030 1 
        31   6   6 SER HB2  H   3.890 0.030 1 
        32   6   6 SER HB3  H   3.890 0.030 1 
        33   6   6 SER C    C 175.047 0.300 1 
        34   6   6 SER CA   C  58.644 0.300 1 
        35   6   6 SER CB   C  63.875 0.300 1 
        36   6   6 SER N    N 117.855 0.300 1 
        37   7   7 GLY H    H   8.384 0.030 1 
        38   7   7 GLY HA2  H   3.913 0.030 1 
        39   7   7 GLY HA3  H   3.913 0.030 1 
        40   7   7 GLY C    C 173.957 0.300 1 
        41   7   7 GLY CA   C  45.408 0.300 1 
        42   7   7 GLY N    N 110.377 0.300 1 
        43   8   8 HIS H    H   8.251 0.030 1 
        44   8   8 HIS HA   H   4.702 0.030 1 
        45   8   8 HIS HB2  H   3.184 0.030 2 
        46   8   8 HIS HB3  H   3.070 0.030 2 
        47   8   8 HIS HD2  H   7.117 0.030 1 
        48   8   8 HIS C    C 174.970 0.300 1 
        49   8   8 HIS CA   C  55.565 0.300 1 
        50   8   8 HIS CB   C  29.947 0.300 1 
        51   8   8 HIS CD2  C 120.034 0.300 1 
        52   8   8 HIS N    N 118.576 0.300 1 
        53   9   9 SER H    H   8.407 0.030 1 
        54   9   9 SER HA   H   4.408 0.030 1 
        55   9   9 SER HB2  H   3.845 0.030 2 
        56   9   9 SER HB3  H   3.775 0.030 2 
        57   9   9 SER C    C 174.453 0.300 1 
        58   9   9 SER CA   C  58.468 0.300 1 
        59   9   9 SER CB   C  63.860 0.300 1 
        60   9   9 SER N    N 117.100 0.300 1 
        61  10  10 HIS HA   H   4.691 0.030 1 
        62  10  10 HIS HB2  H   3.217 0.030 2 
        63  10  10 HIS HB3  H   3.132 0.030 2 
        64  10  10 HIS HD2  H   7.146 0.030 1 
        65  10  10 HIS C    C 174.982 0.300 1 
        66  10  10 HIS CA   C  56.160 0.300 1 
        67  10  10 HIS CB   C  29.870 0.300 1 
        68  10  10 HIS CD2  C 120.109 0.300 1 
        69  11  11 SER H    H   8.300 0.030 1 
        70  11  11 SER HA   H   4.406 0.030 1 
        71  11  11 SER HB2  H   3.842 0.030 1 
        72  11  11 SER HB3  H   3.842 0.030 1 
        73  11  11 SER C    C 174.215 0.300 1 
        74  11  11 SER CA   C  58.373 0.300 1 
        75  11  11 SER CB   C  63.906 0.300 1 
        76  11  11 SER N    N 116.746 0.300 1 
        77  12  12 ASP H    H   8.407 0.030 1 
        78  12  12 ASP HA   H   4.527 0.030 1 
        79  12  12 ASP HB2  H   2.620 0.030 1 
        80  12  12 ASP HB3  H   2.620 0.030 1 
        81  12  12 ASP C    C 176.095 0.300 1 
        82  12  12 ASP CA   C  54.546 0.300 1 
        83  12  12 ASP CB   C  41.045 0.300 1 
        84  12  12 ASP N    N 122.641 0.300 1 
        85  13  13 LYS H    H   8.084 0.030 1 
        86  13  13 LYS HA   H   4.196 0.030 1 
        87  13  13 LYS HB2  H   1.680 0.030 2 
        88  13  13 LYS HB3  H   1.617 0.030 2 
        89  13  13 LYS HG2  H   1.351 0.030 2 
        90  13  13 LYS HG3  H   1.291 0.030 2 
        91  13  13 LYS HD2  H   1.600 0.030 1 
        92  13  13 LYS HD3  H   1.600 0.030 1 
        93  13  13 LYS HE2  H   2.937 0.030 1 
        94  13  13 LYS HE3  H   2.937 0.030 1 
        95  13  13 LYS C    C 176.144 0.300 1 
        96  13  13 LYS CA   C  56.182 0.300 1 
        97  13  13 LYS CB   C  32.951 0.300 1 
        98  13  13 LYS CG   C  24.730 0.300 1 
        99  13  13 LYS CD   C  28.890 0.300 1 
       100  13  13 LYS CE   C  42.144 0.300 1 
       101  13  13 LYS N    N 120.314 0.300 1 
       102  14  14 HIS H    H   8.336 0.030 1 
       103  14  14 HIS HA   H   4.949 0.030 1 
       104  14  14 HIS HB2  H   3.169 0.030 2 
       105  14  14 HIS HB3  H   3.041 0.030 2 
       106  14  14 HIS HD2  H   7.194 0.030 1 
       107  14  14 HIS C    C 173.008 0.300 1 
       108  14  14 HIS CA   C  53.567 0.300 1 
       109  14  14 HIS CB   C  29.416 0.300 1 
       110  14  14 HIS CD2  C 120.443 0.300 1 
       111  14  14 HIS N    N 119.904 0.300 1 
       112  15  15 PRO HA   H   4.470 0.030 1 
       113  15  15 PRO HB2  H   2.286 0.030 2 
       114  15  15 PRO HB3  H   2.073 0.030 2 
       115  15  15 PRO HG2  H   2.004 0.030 1 
       116  15  15 PRO HG3  H   2.004 0.030 1 
       117  15  15 PRO HD2  H   3.663 0.030 2 
       118  15  15 PRO HD3  H   3.626 0.030 2 
       119  15  15 PRO C    C 175.985 0.300 1 
       120  15  15 PRO CA   C  64.070 0.300 1 
       121  15  15 PRO CB   C  32.294 0.300 1 
       122  15  15 PRO CG   C  27.291 0.300 1 
       123  15  15 PRO CD   C  50.650 0.300 1 
       124  16  16 VAL H    H   7.969 0.030 1 
       125  16  16 VAL HA   H   4.539 0.030 1 
       126  16  16 VAL HB   H   2.010 0.030 1 
       127  16  16 VAL HG1  H   0.971 0.030 1 
       128  16  16 VAL HG2  H   0.831 0.030 1 
       129  16  16 VAL C    C 175.971 0.300 1 
       130  16  16 VAL CA   C  61.903 0.300 1 
       131  16  16 VAL CB   C  34.165 0.300 1 
       132  16  16 VAL CG1  C  21.659 0.300 2 
       133  16  16 VAL CG2  C  21.166 0.300 2 
       134  16  16 VAL N    N 119.179 0.300 1 
       135  17  17 THR H    H   8.260 0.030 1 
       136  17  17 THR HA   H   4.530 0.030 1 
       137  17  17 THR HB   H   4.054 0.030 1 
       138  17  17 THR HG2  H   1.141 0.030 1 
       139  17  17 THR C    C 172.839 0.300 1 
       140  17  17 THR CA   C  61.516 0.300 1 
       141  17  17 THR CB   C  71.173 0.300 1 
       142  17  17 THR CG2  C  21.642 0.300 1 
       143  17  17 THR N    N 120.522 0.300 1 
       144  18  18 TRP H    H   8.583 0.030 1 
       145  18  18 TRP HA   H   5.242 0.030 1 
       146  18  18 TRP HB2  H   2.984 0.030 1 
       147  18  18 TRP HB3  H   2.984 0.030 1 
       148  18  18 TRP HD1  H   7.169 0.030 1 
       149  18  18 TRP HE1  H  10.043 0.030 1 
       150  18  18 TRP HE3  H   7.139 0.030 1 
       151  18  18 TRP HZ2  H   7.314 0.030 1 
       152  18  18 TRP HZ3  H   6.776 0.030 1 
       153  18  18 TRP HH2  H   6.856 0.030 1 
       154  18  18 TRP C    C 175.998 0.300 1 
       155  18  18 TRP CA   C  56.130 0.300 1 
       156  18  18 TRP CB   C  31.557 0.300 1 
       157  18  18 TRP CD1  C 127.062 0.300 1 
       158  18  18 TRP CE3  C 119.855 0.300 1 
       159  18  18 TRP CZ2  C 114.060 0.300 1 
       160  18  18 TRP CZ3  C 121.276 0.300 1 
       161  18  18 TRP CH2  C 124.011 0.300 1 
       162  18  18 TRP N    N 124.515 0.300 1 
       163  18  18 TRP NE1  N 129.119 0.300 1 
       164  19  19 GLN H    H   9.219 0.030 1 
       165  19  19 GLN HA   H   5.055 0.030 1 
       166  19  19 GLN HB2  H   2.135 0.030 2 
       167  19  19 GLN HB3  H   2.004 0.030 2 
       168  19  19 GLN HG2  H   2.391 0.030 2 
       169  19  19 GLN HG3  H   2.331 0.030 2 
       170  19  19 GLN HE21 H   7.473 0.030 2 
       171  19  19 GLN HE22 H   6.863 0.030 2 
       172  19  19 GLN C    C 173.008 0.300 1 
       173  19  19 GLN CA   C  52.878 0.300 1 
       174  19  19 GLN CB   C  31.557 0.300 1 
       175  19  19 GLN CG   C  33.327 0.300 1 
       176  19  19 GLN N    N 121.854 0.300 1 
       177  19  19 GLN NE2  N 111.944 0.300 1 
       178  20  20 PRO HA   H   4.991 0.030 1 
       179  20  20 PRO HB2  H   2.391 0.030 2 
       180  20  20 PRO HB3  H   2.076 0.030 2 
       181  20  20 PRO HG2  H   2.163 0.030 2 
       182  20  20 PRO HG3  H   2.024 0.030 2 
       183  20  20 PRO HD2  H   3.857 0.030 2 
       184  20  20 PRO HD3  H   3.776 0.030 2 
       185  20  20 PRO C    C 177.544 0.300 1 
       186  20  20 PRO CA   C  62.909 0.300 1 
       187  20  20 PRO CB   C  32.294 0.300 1 
       188  20  20 PRO CG   C  27.636 0.300 1 
       189  20  20 PRO CD   C  50.745 0.300 1 
       190  21  21 SER H    H   8.688 0.030 1 
       191  21  21 SER HA   H   4.431 0.030 1 
       192  21  21 SER HB2  H   4.306 0.030 2 
       193  21  21 SER HB3  H   3.795 0.030 2 
       194  21  21 SER C    C 175.690 0.300 1 
       195  21  21 SER CA   C  57.759 0.300 1 
       196  21  21 SER CB   C  64.430 0.300 1 
       197  21  21 SER N    N 117.174 0.300 1 
       198  22  22 LYS H    H   8.910 0.030 1 
       199  22  22 LYS HA   H   4.111 0.030 1 
       200  22  22 LYS HB2  H   1.896 0.030 2 
       201  22  22 LYS HB3  H   1.844 0.030 2 
       202  22  22 LYS HG2  H   1.490 0.030 2 
       203  22  22 LYS HG3  H   1.465 0.030 2 
       204  22  22 LYS HD2  H   1.693 0.030 1 
       205  22  22 LYS HD3  H   1.693 0.030 1 
       206  22  22 LYS HE2  H   3.012 0.030 1 
       207  22  22 LYS HE3  H   3.012 0.030 1 
       208  22  22 LYS C    C 177.409 0.300 1 
       209  22  22 LYS CA   C  59.081 0.300 1 
       210  22  22 LYS CB   C  32.138 0.300 1 
       211  22  22 LYS CG   C  24.586 0.300 1 
       212  22  22 LYS CD   C  29.098 0.300 1 
       213  22  22 LYS CE   C  42.163 0.300 1 
       214  22  22 LYS N    N 123.193 0.300 1 
       215  23  23 ASP H    H   8.141 0.030 1 
       216  23  23 ASP HA   H   4.683 0.030 1 
       217  23  23 ASP HB2  H   2.720 0.030 1 
       218  23  23 ASP HB3  H   2.720 0.030 1 
       219  23  23 ASP C    C 176.934 0.300 1 
       220  23  23 ASP CA   C  54.172 0.300 1 
       221  23  23 ASP CB   C  41.289 0.300 1 
       222  23  23 ASP N    N 115.424 0.300 1 
       223  24  24 GLY H    H   7.997 0.030 1 
       224  24  24 GLY HA2  H   4.144 0.030 2 
       225  24  24 GLY HA3  H   3.724 0.030 2 
       226  24  24 GLY C    C 173.852 0.300 1 
       227  24  24 GLY CA   C  45.910 0.300 1 
       228  24  24 GLY N    N 108.706 0.300 1 
       229  25  25 ASP H    H   8.421 0.030 1 
       230  25  25 ASP HA   H   4.613 0.030 1 
       231  25  25 ASP HB2  H   2.721 0.030 2 
       232  25  25 ASP HB3  H   2.674 0.030 2 
       233  25  25 ASP C    C 175.739 0.300 1 
       234  25  25 ASP CA   C  54.520 0.300 1 
       235  25  25 ASP CB   C  40.886 0.300 1 
       236  25  25 ASP N    N 118.220 0.300 1 
       237  26  26 ARG H    H   7.828 0.030 1 
       238  26  26 ARG HA   H   4.895 0.030 1 
       239  26  26 ARG HB2  H   1.911 0.030 2 
       240  26  26 ARG HB3  H   1.649 0.030 2 
       241  26  26 ARG HG2  H   1.562 0.030 1 
       242  26  26 ARG HG3  H   1.562 0.030 1 
       243  26  26 ARG HD2  H   3.180 0.030 2 
       244  26  26 ARG HD3  H   3.116 0.030 2 
       245  26  26 ARG HE   H   7.192 0.030 1 
       246  26  26 ARG C    C 174.774 0.300 1 
       247  26  26 ARG CA   C  54.407 0.300 1 
       248  26  26 ARG CB   C  33.541 0.300 1 
       249  26  26 ARG CG   C  27.120 0.300 1 
       250  26  26 ARG CD   C  43.300 0.300 1 
       251  26  26 ARG N    N 118.189 0.300 1 
       252  26  26 ARG NE   N  84.888 0.300 1 
       253  27  27 LEU H    H   9.009 0.030 1 
       254  27  27 LEU HA   H   4.882 0.030 1 
       255  27  27 LEU HB2  H   1.638 0.030 1 
       256  27  27 LEU HB3  H   1.638 0.030 1 
       257  27  27 LEU HG   H   1.624 0.030 1 
       258  27  27 LEU HD1  H   0.695 0.030 1 
       259  27  27 LEU HD2  H   0.733 0.030 1 
       260  27  27 LEU C    C 175.186 0.300 1 
       261  27  27 LEU CA   C  54.166 0.300 1 
       262  27  27 LEU CB   C  45.547 0.300 1 
       263  27  27 LEU CG   C  27.214 0.300 1 
       264  27  27 LEU CD1  C  24.910 0.300 2 
       265  27  27 LEU CD2  C  23.916 0.300 2 
       266  27  27 LEU N    N 123.017 0.300 1 
       267  28  28 ILE H    H   9.188 0.030 1 
       268  28  28 ILE HA   H   5.293 0.030 1 
       269  28  28 ILE HB   H   1.953 0.030 1 
       270  28  28 ILE HG12 H   1.431 0.030 2 
       271  28  28 ILE HG13 H   1.305 0.030 2 
       272  28  28 ILE HG2  H   0.761 0.030 1 
       273  28  28 ILE HD1  H   0.785 0.030 1 
       274  28  28 ILE C    C 176.305 0.300 1 
       275  28  28 ILE CA   C  58.617 0.300 1 
       276  28  28 ILE CB   C  38.312 0.300 1 
       277  28  28 ILE CG1  C  27.141 0.300 1 
       278  28  28 ILE CG2  C  17.293 0.300 1 
       279  28  28 ILE CD1  C  11.207 0.300 1 
       280  28  28 ILE N    N 123.366 0.300 1 
       281  29  29 GLY H    H   9.226 0.030 1 
       282  29  29 GLY HA2  H   4.366 0.030 2 
       283  29  29 GLY HA3  H   1.502 0.030 2 
       284  29  29 GLY C    C 171.224 0.300 1 
       285  29  29 GLY CA   C  43.437 0.300 1 
       286  29  29 GLY N    N 119.066 0.300 1 
       287  30  30 ARG H    H   8.189 0.030 1 
       288  30  30 ARG HA   H   4.912 0.030 1 
       289  30  30 ARG HB2  H   1.619 0.030 2 
       290  30  30 ARG HB3  H   1.505 0.030 2 
       291  30  30 ARG HG2  H   1.396 0.030 2 
       292  30  30 ARG HG3  H   1.235 0.030 2 
       293  30  30 ARG HD2  H   3.087 0.030 2 
       294  30  30 ARG HD3  H   2.974 0.030 2 
       295  30  30 ARG HE   H   7.239 0.030 1 
       296  30  30 ARG C    C 174.837 0.300 1 
       297  30  30 ARG CA   C  55.371 0.300 1 
       298  30  30 ARG CB   C  31.121 0.300 1 
       299  30  30 ARG CG   C  28.017 0.300 1 
       300  30  30 ARG CD   C  42.989 0.300 1 
       301  30  30 ARG N    N 124.199 0.300 1 
       302  30  30 ARG NE   N  83.551 0.300 1 
       303  31  31 ILE H    H   8.825 0.030 1 
       304  31  31 ILE HA   H   4.459 0.030 1 
       305  31  31 ILE HB   H   1.657 0.030 1 
       306  31  31 ILE HG12 H   1.137 0.030 1 
       307  31  31 ILE HG13 H   1.137 0.030 1 
       308  31  31 ILE HG2  H   0.703 0.030 1 
       309  31  31 ILE HD1  H   0.535 0.030 1 
       310  31  31 ILE C    C 173.020 0.300 1 
       311  31  31 ILE CA   C  59.571 0.300 1 
       312  31  31 ILE CB   C  41.588 0.300 1 
       313  31  31 ILE CG1  C  28.314 0.300 1 
       314  31  31 ILE CG2  C  18.965 0.300 1 
       315  31  31 ILE CD1  C  14.110 0.300 1 
       316  31  31 ILE N    N 126.589 0.300 1 
       317  32  32 LEU H    H   8.430 0.030 1 
       318  32  32 LEU HA   H   4.808 0.030 1 
       319  32  32 LEU HB2  H   1.661 0.030 2 
       320  32  32 LEU HB3  H   1.356 0.030 2 
       321  32  32 LEU HG   H   1.232 0.030 1 
       322  32  32 LEU HD1  H   0.683 0.030 1 
       323  32  32 LEU HD2  H   0.649 0.030 1 
       324  32  32 LEU C    C 175.173 0.300 1 
       325  32  32 LEU CA   C  53.836 0.300 1 
       326  32  32 LEU CB   C  43.456 0.300 1 
       327  32  32 LEU CG   C  27.762 0.300 1 
       328  32  32 LEU CD1  C  24.932 0.300 2 
       329  32  32 LEU CD2  C  24.062 0.300 2 
       330  32  32 LEU N    N 129.511 0.300 1 
       331  33  33 LEU H    H   8.866 0.030 1 
       332  33  33 LEU HA   H   4.556 0.030 1 
       333  33  33 LEU HB2  H   1.732 0.030 2 
       334  33  33 LEU HB3  H   0.942 0.030 2 
       335  33  33 LEU HG   H   1.365 0.030 1 
       336  33  33 LEU HD1  H   0.587 0.030 1 
       337  33  33 LEU HD2  H   0.554 0.030 1 
       338  33  33 LEU C    C 174.166 0.300 1 
       339  33  33 LEU CA   C  52.819 0.300 1 
       340  33  33 LEU CB   C  42.291 0.300 1 
       341  33  33 LEU CG   C  26.273 0.300 1 
       342  33  33 LEU CD1  C  26.171 0.300 2 
       343  33  33 LEU CD2  C  23.611 0.300 2 
       344  33  33 LEU N    N 124.984 0.300 1 
       345  34  34 ASN H    H   8.976 0.030 1 
       346  34  34 ASN HA   H   4.685 0.030 1 
       347  34  34 ASN HB2  H   2.976 0.030 2 
       348  34  34 ASN HB3  H   2.634 0.030 2 
       349  34  34 ASN HD21 H   7.561 0.030 2 
       350  34  34 ASN HD22 H   6.886 0.030 2 
       351  34  34 ASN C    C 175.151 0.300 1 
       352  34  34 ASN CA   C  52.858 0.300 1 
       353  34  34 ASN CB   C  39.330 0.300 1 
       354  34  34 ASN N    N 123.766 0.300 1 
       355  34  34 ASN ND2  N 111.702 0.300 1 
       356  35  35 LYS H    H   8.572 0.030 1 
       357  35  35 LYS HA   H   4.083 0.030 1 
       358  35  35 LYS HB2  H   2.076 0.030 2 
       359  35  35 LYS HB3  H   1.498 0.030 2 
       360  35  35 LYS HG2  H   1.271 0.030 2 
       361  35  35 LYS HG3  H   1.239 0.030 2 
       362  35  35 LYS HD2  H   1.776 0.030 2 
       363  35  35 LYS HD3  H   1.539 0.030 2 
       364  35  35 LYS HE2  H   2.868 0.030 2 
       365  35  35 LYS HE3  H   2.722 0.030 2 
       366  35  35 LYS C    C 175.571 0.300 1 
       367  35  35 LYS CA   C  56.750 0.300 1 
       368  35  35 LYS CB   C  33.448 0.300 1 
       369  35  35 LYS CG   C  25.104 0.300 1 
       370  35  35 LYS CD   C  30.315 0.300 1 
       371  35  35 LYS CE   C  42.144 0.300 1 
       372  35  35 LYS N    N 123.569 0.300 1 
       373  36  36 ARG H    H   7.740 0.030 1 
       374  36  36 ARG HA   H   4.365 0.030 1 
       375  36  36 ARG HB2  H   1.745 0.030 2 
       376  36  36 ARG HB3  H   1.717 0.030 2 
       377  36  36 ARG HG2  H   1.749 0.030 2 
       378  36  36 ARG HG3  H   1.540 0.030 2 
       379  36  36 ARG HD2  H   3.203 0.030 2 
       380  36  36 ARG HD3  H   3.173 0.030 2 
       381  36  36 ARG HE   H   7.367 0.030 1 
       382  36  36 ARG C    C 177.548 0.300 1 
       383  36  36 ARG CA   C  56.337 0.300 1 
       384  36  36 ARG CB   C  31.424 0.300 1 
       385  36  36 ARG CG   C  27.895 0.300 1 
       386  36  36 ARG CD   C  43.843 0.300 1 
       387  36  36 ARG N    N 116.668 0.300 1 
       388  36  36 ARG NE   N  85.109 0.300 1 
       389  37  37 LEU H    H   8.684 0.030 1 
       390  37  37 LEU HA   H   4.447 0.030 1 
       391  37  37 LEU HB2  H   1.873 0.030 2 
       392  37  37 LEU HB3  H   1.625 0.030 2 
       393  37  37 LEU HG   H   1.641 0.030 1 
       394  37  37 LEU HD1  H   0.879 0.030 1 
       395  37  37 LEU HD2  H   0.854 0.030 1 
       396  37  37 LEU C    C 179.212 0.300 1 
       397  37  37 LEU CA   C  54.210 0.300 1 
       398  37  37 LEU CB   C  42.147 0.300 1 
       399  37  37 LEU CG   C  27.322 0.300 1 
       400  37  37 LEU CD1  C  25.361 0.300 2 
       401  37  37 LEU CD2  C  22.506 0.300 2 
       402  37  37 LEU N    N 122.322 0.300 1 
       403  38  38 LYS H    H   8.567 0.030 1 
       404  38  38 LYS HA   H   4.106 0.030 1 
       405  38  38 LYS HB2  H   1.835 0.030 1 
       406  38  38 LYS HB3  H   1.835 0.030 1 
       407  38  38 LYS HG2  H   1.468 0.030 1 
       408  38  38 LYS HG3  H   1.468 0.030 1 
       409  38  38 LYS HD2  H   1.695 0.030 1 
       410  38  38 LYS HD3  H   1.695 0.030 1 
       411  38  38 LYS HE2  H   2.994 0.030 1 
       412  38  38 LYS HE3  H   2.994 0.030 1 
       413  38  38 LYS C    C 176.857 0.300 1 
       414  38  38 LYS CA   C  58.519 0.300 1 
       415  38  38 LYS CB   C  32.325 0.300 1 
       416  38  38 LYS CG   C  24.790 0.300 1 
       417  38  38 LYS CD   C  29.126 0.300 1 
       418  38  38 LYS CE   C  42.139 0.300 1 
       419  38  38 LYS N    N 121.541 0.300 1 
       420  39  39 ASP H    H   7.894 0.030 1 
       421  39  39 ASP HA   H   4.506 0.030 1 
       422  39  39 ASP HB2  H   2.985 0.030 2 
       423  39  39 ASP HB3  H   2.621 0.030 2 
       424  39  39 ASP C    C 176.983 0.300 1 
       425  39  39 ASP CA   C  53.721 0.300 1 
       426  39  39 ASP CB   C  40.184 0.300 1 
       427  39  39 ASP N    N 117.058 0.300 1 
       428  40  40 GLY H    H   8.329 0.030 1 
       429  40  40 GLY HA2  H   4.296 0.030 2 
       430  40  40 GLY HA3  H   3.659 0.030 2 
       431  40  40 GLY C    C 173.908 0.300 1 
       432  40  40 GLY CA   C  45.344 0.300 1 
       433  40  40 GLY N    N 108.849 0.300 1 
       434  41  41 SER H    H   8.231 0.030 1 
       435  41  41 SER HA   H   4.409 0.030 1 
       436  41  41 SER HB2  H   3.838 0.030 1 
       437  41  41 SER HB3  H   3.838 0.030 1 
       438  41  41 SER C    C 172.678 0.300 1 
       439  41  41 SER CA   C  58.606 0.300 1 
       440  41  41 SER CB   C  64.455 0.300 1 
       441  41  41 SER N    N 117.295 0.300 1 
       442  42  42 VAL H    H   8.278 0.030 1 
       443  42  42 VAL HA   H   4.574 0.030 1 
       444  42  42 VAL HB   H   2.010 0.030 1 
       445  42  42 VAL HG1  H   0.937 0.030 1 
       446  42  42 VAL HG2  H   0.903 0.030 1 
       447  42  42 VAL C    C 174.818 0.300 1 
       448  42  42 VAL CA   C  59.485 0.300 1 
       449  42  42 VAL CB   C  33.233 0.300 1 
       450  42  42 VAL CG1  C  21.045 0.300 2 
       451  42  42 VAL CG2  C  21.455 0.300 2 
       452  42  42 VAL N    N 120.288 0.300 1 
       453  43  43 PRO HA   H   4.435 0.030 1 
       454  43  43 PRO HB2  H   2.325 0.030 2 
       455  43  43 PRO HB3  H   1.880 0.030 2 
       456  43  43 PRO HG2  H   2.003 0.030 1 
       457  43  43 PRO HG3  H   2.003 0.030 1 
       458  43  43 PRO HD2  H   3.949 0.030 2 
       459  43  43 PRO HD3  H   3.728 0.030 2 
       460  43  43 PRO C    C 176.723 0.300 1 
       461  43  43 PRO CA   C  62.922 0.300 1 
       462  43  43 PRO CB   C  32.529 0.300 1 
       463  43  43 PRO CG   C  27.613 0.300 1 
       464  43  43 PRO CD   C  51.508 0.300 1 
       465  44  44 ARG H    H   8.572 0.030 1 
       466  44  44 ARG HA   H   4.206 0.030 1 
       467  44  44 ARG HB2  H   1.858 0.030 2 
       468  44  44 ARG HB3  H   1.814 0.030 2 
       469  44  44 ARG HG2  H   1.727 0.030 2 
       470  44  44 ARG HG3  H   1.669 0.030 2 
       471  44  44 ARG HD2  H   3.230 0.030 1 
       472  44  44 ARG HD3  H   3.230 0.030 1 
       473  44  44 ARG HE   H   7.242 0.030 1 
       474  44  44 ARG C    C 176.619 0.300 1 
       475  44  44 ARG CA   C  57.330 0.300 1 
       476  44  44 ARG CB   C  30.420 0.300 1 
       477  44  44 ARG CG   C  27.248 0.300 1 
       478  44  44 ARG CD   C  43.327 0.300 1 
       479  44  44 ARG N    N 121.500 0.300 1 
       480  44  44 ARG NE   N  84.707 0.300 1 
       481  45  45 ASP H    H   8.289 0.030 1 
       482  45  45 ASP HA   H   4.751 0.030 1 
       483  45  45 ASP HB2  H   2.778 0.030 2 
       484  45  45 ASP HB3  H   2.706 0.030 2 
       485  45  45 ASP C    C 176.640 0.300 1 
       486  45  45 ASP CA   C  53.465 0.300 1 
       487  45  45 ASP CB   C  40.805 0.300 1 
       488  45  45 ASP N    N 118.637 0.300 1 
       489  46  46 SER H    H   8.232 0.030 1 
       490  46  46 SER HA   H   4.264 0.030 1 
       491  46  46 SER HB2  H   3.956 0.030 1 
       492  46  46 SER HB3  H   3.956 0.030 1 
       493  46  46 SER C    C 175.906 0.300 1 
       494  46  46 SER CA   C  60.180 0.300 1 
       495  46  46 SER CB   C  63.397 0.300 1 
       496  46  46 SER N    N 116.708 0.300 1 
       497  47  47 GLY H    H   8.730 0.030 1 
       498  47  47 GLY HA2  H   4.055 0.030 2 
       499  47  47 GLY HA3  H   3.965 0.030 2 
       500  47  47 GLY C    C 175.802 0.300 1 
       501  47  47 GLY CA   C  46.706 0.300 1 
       502  47  47 GLY N    N 111.172 0.300 1 
       503  48  48 ALA H    H   8.214 0.030 1 
       504  48  48 ALA HA   H   4.280 0.030 1 
       505  48  48 ALA HB   H   1.428 0.030 1 
       506  48  48 ALA C    C 178.751 0.300 1 
       507  48  48 ALA CA   C  53.903 0.300 1 
       508  48  48 ALA CB   C  18.962 0.300 1 
       509  48  48 ALA N    N 124.475 0.300 1 
       510  49  49 MET H    H   7.990 0.030 1 
       511  49  49 MET HA   H   4.354 0.030 1 
       512  49  49 MET HB2  H   2.231 0.030 2 
       513  49  49 MET HB3  H   2.167 0.030 2 
       514  49  49 MET HG2  H   2.636 0.030 2 
       515  49  49 MET HG3  H   2.530 0.030 2 
       516  49  49 MET HE   H   2.085 0.030 1 
       517  49  49 MET C    C 177.231 0.300 1 
       518  49  49 MET CA   C  57.032 0.300 1 
       519  49  49 MET CB   C  32.919 0.300 1 
       520  49  49 MET CG   C  32.447 0.300 1 
       521  49  49 MET CE   C  17.388 0.300 1 
       522  49  49 MET N    N 116.154 0.300 1 
       523  50  50 LEU H    H   8.098 0.030 1 
       524  50  50 LEU HA   H   4.098 0.030 1 
       525  50  50 LEU HB2  H   2.050 0.030 2 
       526  50  50 LEU HB3  H   1.552 0.030 2 
       527  50  50 LEU HG   H   1.745 0.030 1 
       528  50  50 LEU HD1  H   0.875 0.030 1 
       529  50  50 LEU HD2  H   0.821 0.030 1 
       530  50  50 LEU C    C 176.834 0.300 1 
       531  50  50 LEU CA   C  57.657 0.300 1 
       532  50  50 LEU CB   C  42.021 0.300 1 
       533  50  50 LEU CG   C  27.065 0.300 1 
       534  50  50 LEU CD1  C  26.072 0.300 2 
       535  50  50 LEU CD2  C  24.325 0.300 2 
       536  50  50 LEU N    N 116.980 0.300 1 
       537  51  51 GLY H    H   7.924 0.030 1 
       538  51  51 GLY HA2  H   4.742 0.030 2 
       539  51  51 GLY HA3  H   3.696 0.030 2 
       540  51  51 GLY C    C 174.383 0.300 1 
       541  51  51 GLY CA   C  45.610 0.300 1 
       542  51  51 GLY N    N 102.006 0.300 1 
       543  52  52 LEU H    H   7.588 0.030 1 
       544  52  52 LEU HA   H   5.171 0.030 1 
       545  52  52 LEU HB2  H   1.837 0.030 2 
       546  52  52 LEU HB3  H   1.321 0.030 2 
       547  52  52 LEU HG   H   1.606 0.030 1 
       548  52  52 LEU HD1  H   0.899 0.030 1 
       549  52  52 LEU HD2  H   0.853 0.030 1 
       550  52  52 LEU C    C 175.962 0.300 1 
       551  52  52 LEU CA   C  53.669 0.300 1 
       552  52  52 LEU CB   C  46.030 0.300 1 
       553  52  52 LEU CG   C  26.871 0.300 1 
       554  52  52 LEU CD1  C  26.081 0.300 2 
       555  52  52 LEU CD2  C  25.742 0.300 2 
       556  52  52 LEU N    N 118.065 0.300 1 
       557  53  53 LYS H    H   8.065 0.030 1 
       558  53  53 LYS HA   H   4.663 0.030 1 
       559  53  53 LYS HB2  H   1.832 0.030 2 
       560  53  53 LYS HB3  H   1.663 0.030 2 
       561  53  53 LYS HG2  H   1.375 0.030 2 
       562  53  53 LYS HG3  H   1.283 0.030 2 
       563  53  53 LYS HD2  H   1.649 0.030 1 
       564  53  53 LYS HD3  H   1.649 0.030 1 
       565  53  53 LYS HE2  H   2.964 0.030 2 
       566  53  53 LYS HE3  H   2.939 0.030 2 
       567  53  53 LYS C    C 174.677 0.300 1 
       568  53  53 LYS CA   C  56.028 0.300 1 
       569  53  53 LYS CB   C  34.958 0.300 1 
       570  53  53 LYS CG   C  25.264 0.300 1 
       571  53  53 LYS CD   C  29.092 0.300 1 
       572  53  53 LYS CE   C  42.368 0.300 1 
       573  53  53 LYS N    N 121.984 0.300 1 
       574  54  54 VAL H    H   8.611 0.030 1 
       575  54  54 VAL HA   H   4.800 0.030 1 
       576  54  54 VAL HB   H   1.583 0.030 1 
       577  54  54 VAL HG1  H   0.868 0.030 1 
       578  54  54 VAL HG2  H   0.496 0.030 1 
       579  54  54 VAL C    C 174.613 0.300 1 
       580  54  54 VAL CA   C  60.590 0.300 1 
       581  54  54 VAL CB   C  34.683 0.300 1 
       582  54  54 VAL CG1  C  22.452 0.300 2 
       583  54  54 VAL CG2  C  21.053 0.300 2 
       584  54  54 VAL N    N 126.652 0.300 1 
       585  55  55 VAL H    H   8.964 0.030 1 
       586  55  55 VAL HA   H   4.262 0.030 1 
       587  55  55 VAL HB   H   2.103 0.030 1 
       588  55  55 VAL HG1  H   1.117 0.030 1 
       589  55  55 VAL HG2  H   1.256 0.030 1 
       590  55  55 VAL C    C 175.173 0.300 1 
       591  55  55 VAL CA   C  62.061 0.300 1 
       592  55  55 VAL CB   C  34.091 0.300 1 
       593  55  55 VAL CG1  C  22.024 0.300 2 
       594  55  55 VAL CG2  C  21.651 0.300 2 
       595  55  55 VAL N    N 126.827 0.300 1 
       596  56  56 GLY H    H   8.945 0.030 1 
       597  56  56 GLY HA2  H   4.749 0.030 2 
       598  56  56 GLY HA3  H   3.315 0.030 2 
       599  56  56 GLY C    C 172.893 0.300 1 
       600  56  56 GLY CA   C  43.233 0.300 1 
       601  56  56 GLY N    N 113.582 0.300 1 
       602  57  57 GLY H    H   8.416 0.030 1 
       603  57  57 GLY HA2  H   4.049 0.030 2 
       604  57  57 GLY HA3  H   3.885 0.030 2 
       605  57  57 GLY C    C 174.216 0.300 1 
       606  57  57 GLY CA   C  47.406 0.300 1 
       607  57  57 GLY N    N 106.453 0.300 1 
       608  58  58 LYS H    H   9.121 0.030 1 
       609  58  58 LYS HA   H   4.409 0.030 1 
       610  58  58 LYS HB2  H   2.095 0.030 2 
       611  58  58 LYS HB3  H   1.992 0.030 2 
       612  58  58 LYS HG2  H   1.522 0.030 2 
       613  58  58 LYS HG3  H   1.408 0.030 2 
       614  58  58 LYS HD2  H   1.715 0.030 2 
       615  58  58 LYS HD3  H   1.625 0.030 2 
       616  58  58 LYS HE2  H   2.896 0.030 1 
       617  58  58 LYS HE3  H   2.896 0.030 1 
       618  58  58 LYS C    C 176.102 0.300 1 
       619  58  58 LYS CA   C  55.653 0.300 1 
       620  58  58 LYS CB   C  32.605 0.300 1 
       621  58  58 LYS CG   C  24.893 0.300 1 
       622  58  58 LYS CD   C  29.099 0.300 1 
       623  58  58 LYS CE   C  42.087 0.300 1 
       624  58  58 LYS N    N 122.279 0.300 1 
       625  59  59 MET H    H   8.739 0.030 1 
       626  59  59 MET HA   H   4.744 0.030 1 
       627  59  59 MET HB2  H   2.020 0.030 1 
       628  59  59 MET HB3  H   2.020 0.030 1 
       629  59  59 MET HG2  H   2.685 0.030 2 
       630  59  59 MET HG3  H   2.413 0.030 2 
       631  59  59 MET HE   H   2.033 0.030 1 
       632  59  59 MET C    C 176.598 0.300 1 
       633  59  59 MET CA   C  55.641 0.300 1 
       634  59  59 MET CB   C  31.275 0.300 1 
       635  59  59 MET CG   C  31.645 0.300 1 
       636  59  59 MET CE   C  16.351 0.300 1 
       637  59  59 MET N    N 126.166 0.300 1 
       638  60  60 THR H    H   7.983 0.030 1 
       639  60  60 THR HA   H   4.817 0.030 1 
       640  60  60 THR HB   H   4.718 0.030 1 
       641  60  60 THR HG2  H   1.584 0.030 1 
       642  60  60 THR C    C 176.745 0.300 1 
       643  60  60 THR CA   C  60.599 0.300 1 
       644  60  60 THR CB   C  72.532 0.300 1 
       645  60  60 THR CG2  C  22.644 0.300 1 
       646  60  60 THR N    N 117.318 0.300 1 
       647  61  61 GLU H    H   9.303 0.030 1 
       648  61  61 GLU HA   H   4.101 0.030 1 
       649  61  61 GLU HB2  H   2.118 0.030 1 
       650  61  61 GLU HB3  H   2.118 0.030 1 
       651  61  61 GLU HG2  H   2.382 0.030 1 
       652  61  61 GLU HG3  H   2.382 0.030 1 
       653  61  61 GLU C    C 177.332 0.300 1 
       654  61  61 GLU CA   C  59.288 0.300 1 
       655  61  61 GLU CB   C  29.173 0.300 1 
       656  61  61 GLU CG   C  36.359 0.300 1 
       657  61  61 GLU N    N 121.895 0.300 1 
       658  62  62 SER H    H   8.018 0.030 1 
       659  62  62 SER HA   H   4.385 0.030 1 
       660  62  62 SER HB2  H   4.004 0.030 2 
       661  62  62 SER HB3  H   3.977 0.030 2 
       662  62  62 SER C    C 175.397 0.300 1 
       663  62  62 SER CA   C  58.941 0.300 1 
       664  62  62 SER CB   C  64.014 0.300 1 
       665  62  62 SER N    N 111.919 0.300 1 
       666  63  63 GLY H    H   8.195 0.030 1 
       667  63  63 GLY HA2  H   4.290 0.030 2 
       668  63  63 GLY HA3  H   3.838 0.030 2 
       669  63  63 GLY C    C 173.384 0.300 1 
       670  63  63 GLY CA   C  45.499 0.300 1 
       671  63  63 GLY N    N 110.422 0.300 1 
       672  64  64 ARG H    H   7.178 0.030 1 
       673  64  64 ARG HA   H   4.485 0.030 1 
       674  64  64 ARG HB2  H   1.634 0.030 2 
       675  64  64 ARG HB3  H   1.507 0.030 2 
       676  64  64 ARG HG2  H   1.511 0.030 1 
       677  64  64 ARG HG3  H   1.511 0.030 1 
       678  64  64 ARG HD2  H   3.065 0.030 2 
       679  64  64 ARG HD3  H   3.023 0.030 2 
       680  64  64 ARG HE   H   7.020 0.030 1 
       681  64  64 ARG C    C 175.837 0.300 1 
       682  64  64 ARG CA   C  54.718 0.300 1 
       683  64  64 ARG CB   C  31.977 0.300 1 
       684  64  64 ARG CG   C  27.143 0.300 1 
       685  64  64 ARG CD   C  43.408 0.300 1 
       686  64  64 ARG N    N 119.155 0.300 1 
       687  64  64 ARG NE   N  84.295 0.300 1 
       688  65  65 LEU H    H   8.556 0.030 1 
       689  65  65 LEU HA   H   4.692 0.030 1 
       690  65  65 LEU HB2  H   1.503 0.030 2 
       691  65  65 LEU HB3  H   1.161 0.030 2 
       692  65  65 LEU HG   H   1.672 0.030 1 
       693  65  65 LEU HD1  H   0.768 0.030 1 
       694  65  65 LEU HD2  H   0.726 0.030 1 
       695  65  65 LEU C    C 176.647 0.300 1 
       696  65  65 LEU CA   C  54.509 0.300 1 
       697  65  65 LEU CB   C  42.764 0.300 1 
       698  65  65 LEU CG   C  26.714 0.300 1 
       699  65  65 LEU CD1  C  25.291 0.300 2 
       700  65  65 LEU CD2  C  22.824 0.300 2 
       701  65  65 LEU N    N 124.825 0.300 1 
       702  66  66 CYS H    H   9.051 0.030 1 
       703  66  66 CYS HA   H   4.879 0.030 1 
       704  66  66 CYS HB2  H   2.531 0.030 2 
       705  66  66 CYS HB3  H   2.396 0.030 2 
       706  66  66 CYS C    C 171.615 0.300 1 
       707  66  66 CYS CA   C  57.785 0.300 1 
       708  66  66 CYS CB   C  33.728 0.300 1 
       709  66  66 CYS N    N 122.080 0.300 1 
       710  67  67 ALA H    H   9.395 0.030 1 
       711  67  67 ALA HA   H   5.455 0.030 1 
       712  67  67 ALA HB   H   1.247 0.030 1 
       713  67  67 ALA C    C 176.005 0.300 1 
       714  67  67 ALA CA   C  49.468 0.300 1 
       715  67  67 ALA CB   C  22.002 0.300 1 
       716  67  67 ALA N    N 123.123 0.300 1 
       717  68  68 PHE H    H   8.248 0.030 1 
       718  68  68 PHE HA   H   5.417 0.030 1 
       719  68  68 PHE HB2  H   2.941 0.030 2 
       720  68  68 PHE HB3  H   2.585 0.030 2 
       721  68  68 PHE HD1  H   7.105 0.030 1 
       722  68  68 PHE HD2  H   7.105 0.030 1 
       723  68  68 PHE HE1  H   7.226 0.030 1 
       724  68  68 PHE HE2  H   7.226 0.030 1 
       725  68  68 PHE HZ   H   7.259 0.030 1 
       726  68  68 PHE C    C 175.767 0.300 1 
       727  68  68 PHE CA   C  56.553 0.300 1 
       728  68  68 PHE CB   C  43.933 0.300 1 
       729  68  68 PHE CD1  C 131.938 0.300 1 
       730  68  68 PHE CD2  C 131.938 0.300 1 
       731  68  68 PHE CE1  C 131.190 0.300 1 
       732  68  68 PHE CE2  C 131.190 0.300 1 
       733  68  68 PHE CZ   C 129.285 0.300 1 
       734  68  68 PHE N    N 116.487 0.300 1 
       735  69  69 ILE H    H   9.085 0.030 1 
       736  69  69 ILE HA   H   4.579 0.030 1 
       737  69  69 ILE HB   H   2.119 0.030 1 
       738  69  69 ILE HG12 H   1.879 0.030 2 
       739  69  69 ILE HG13 H   0.943 0.030 2 
       740  69  69 ILE HG2  H   0.744 0.030 1 
       741  69  69 ILE HD1  H   0.948 0.030 1 
       742  69  69 ILE C    C 177.647 0.300 1 
       743  69  69 ILE CA   C  61.981 0.300 1 
       744  69  69 ILE CB   C  38.070 0.300 1 
       745  69  69 ILE CG1  C  29.007 0.300 1 
       746  69  69 ILE CG2  C  19.444 0.300 1 
       747  69  69 ILE CD1  C  15.464 0.300 1 
       748  69  69 ILE N    N 121.273 0.300 1 
       749  70  70 THR H    H   9.286 0.030 1 
       750  70  70 THR HA   H   4.698 0.030 1 
       751  70  70 THR HB   H   4.298 0.030 1 
       752  70  70 THR HG2  H   1.186 0.030 1 
       753  70  70 THR C    C 175.137 0.300 1 
       754  70  70 THR CA   C  61.908 0.300 1 
       755  70  70 THR CB   C  69.005 0.300 1 
       756  70  70 THR CG2  C  22.921 0.300 1 
       757  70  70 THR N    N 120.377 0.300 1 
       758  71  71 LYS H    H   7.385 0.030 1 
       759  71  71 LYS HA   H   4.515 0.030 1 
       760  71  71 LYS HB2  H   1.727 0.030 2 
       761  71  71 LYS HB3  H   1.671 0.030 2 
       762  71  71 LYS HG2  H   1.431 0.030 2 
       763  71  71 LYS HG3  H   1.312 0.030 2 
       764  71  71 LYS HD2  H   1.683 0.030 2 
       765  71  71 LYS HD3  H   1.630 0.030 2 
       766  71  71 LYS HE2  H   2.939 0.030 1 
       767  71  71 LYS HE3  H   2.939 0.030 1 
       768  71  71 LYS C    C 173.901 0.300 1 
       769  71  71 LYS CA   C  56.358 0.300 1 
       770  71  71 LYS CB   C  37.052 0.300 1 
       771  71  71 LYS CG   C  25.020 0.300 1 
       772  71  71 LYS CD   C  29.289 0.300 1 
       773  71  71 LYS CE   C  42.262 0.300 1 
       774  71  71 LYS N    N 121.577 0.300 1 
       775  72  72 VAL H    H   8.568 0.030 1 
       776  72  72 VAL HA   H   4.424 0.030 1 
       777  72  72 VAL HB   H   1.798 0.030 1 
       778  72  72 VAL HG1  H   0.533 0.030 1 
       779  72  72 VAL HG2  H   0.618 0.030 1 
       780  72  72 VAL C    C 175.054 0.300 1 
       781  72  72 VAL CA   C  61.357 0.300 1 
       782  72  72 VAL CB   C  35.029 0.300 1 
       783  72  72 VAL CG1  C  21.486 0.300 2 
       784  72  72 VAL CG2  C  20.543 0.300 2 
       785  72  72 VAL N    N 122.680 0.300 1 
       786  73  73 LYS H    H   9.085 0.030 1 
       787  73  73 LYS HA   H   4.293 0.030 1 
       788  73  73 LYS HB2  H   1.831 0.030 2 
       789  73  73 LYS HB3  H   1.735 0.030 2 
       790  73  73 LYS HG2  H   1.483 0.030 2 
       791  73  73 LYS HG3  H   1.426 0.030 2 
       792  73  73 LYS HD2  H   1.774 0.030 2 
       793  73  73 LYS HD3  H   1.709 0.030 2 
       794  73  73 LYS HE2  H   3.029 0.030 1 
       795  73  73 LYS HE3  H   3.029 0.030 1 
       796  73  73 LYS C    C 177.465 0.300 1 
       797  73  73 LYS CA   C  56.130 0.300 1 
       798  73  73 LYS CB   C  32.986 0.300 1 
       799  73  73 LYS CG   C  24.676 0.300 1 
       800  73  73 LYS CD   C  29.320 0.300 1 
       801  73  73 LYS CE   C  42.252 0.300 1 
       802  73  73 LYS N    N 128.852 0.300 1 
       803  74  74 LYS H    H   9.259 0.030 1 
       804  74  74 LYS HA   H   4.155 0.030 1 
       805  74  74 LYS HB2  H   1.884 0.030 2 
       806  74  74 LYS HB3  H   1.790 0.030 2 
       807  74  74 LYS HG2  H   1.537 0.030 2 
       808  74  74 LYS HG3  H   1.439 0.030 2 
       809  74  74 LYS HD2  H   1.723 0.030 1 
       810  74  74 LYS HD3  H   1.723 0.030 1 
       811  74  74 LYS HE2  H   3.029 0.030 1 
       812  74  74 LYS HE3  H   3.029 0.030 1 
       813  74  74 LYS C    C 178.409 0.300 1 
       814  74  74 LYS CA   C  57.842 0.300 1 
       815  74  74 LYS CB   C  31.672 0.300 1 
       816  74  74 LYS CG   C  24.538 0.300 1 
       817  74  74 LYS CD   C  28.885 0.300 1 
       818  74  74 LYS CE   C  42.109 0.300 1 
       819  74  74 LYS N    N 133.879 0.300 1 
       820  75  75 GLY H    H  10.857 0.030 1 
       821  75  75 GLY HA2  H   4.334 0.030 2 
       822  75  75 GLY HA3  H   3.615 0.030 2 
       823  75  75 GLY C    C 174.215 0.300 1 
       824  75  75 GLY CA   C  45.551 0.300 1 
       825  75  75 GLY N    N 116.862 0.300 1 
       826  76  76 SER H    H   7.865 0.030 1 
       827  76  76 SER HA   H   4.657 0.030 1 
       828  76  76 SER HB2  H   4.252 0.030 2 
       829  76  76 SER HB3  H   3.783 0.030 2 
       830  76  76 SER C    C 175.298 0.300 1 
       831  76  76 SER CA   C  58.232 0.300 1 
       832  76  76 SER CB   C  65.802 0.300 1 
       833  76  76 SER N    N 116.081 0.300 1 
       834  77  77 LEU H    H   8.935 0.030 1 
       835  77  77 LEU HA   H   4.180 0.030 1 
       836  77  77 LEU HB2  H   1.833 0.030 2 
       837  77  77 LEU HB3  H   1.427 0.030 2 
       838  77  77 LEU HG   H   1.790 0.030 1 
       839  77  77 LEU HD1  H   0.887 0.030 1 
       840  77  77 LEU HD2  H   0.902 0.030 1 
       841  77  77 LEU C    C 179.393 0.300 1 
       842  77  77 LEU CA   C  58.398 0.300 1 
       843  77  77 LEU CB   C  43.083 0.300 1 
       844  77  77 LEU CG   C  27.136 0.300 1 
       845  77  77 LEU CD1  C  25.907 0.300 2 
       846  77  77 LEU CD2  C  23.330 0.300 2 
       847  77  77 LEU N    N 121.262 0.300 1 
       848  78  78 ALA H    H   8.342 0.030 1 
       849  78  78 ALA HA   H   3.704 0.030 1 
       850  78  78 ALA HB   H   1.403 0.030 1 
       851  78  78 ALA C    C 176.690 0.300 1 
       852  78  78 ALA CA   C  55.730 0.300 1 
       853  78  78 ALA CB   C  19.728 0.300 1 
       854  78  78 ALA N    N 118.884 0.300 1 
       855  79  79 ASP H    H   7.148 0.030 1 
       856  79  79 ASP HA   H   4.461 0.030 1 
       857  79  79 ASP HB2  H   3.043 0.030 2 
       858  79  79 ASP HB3  H   2.726 0.030 2 
       859  79  79 ASP C    C 176.850 0.300 1 
       860  79  79 ASP CA   C  56.517 0.300 1 
       861  79  79 ASP CB   C  43.757 0.300 1 
       862  79  79 ASP N    N 114.375 0.300 1 
       863  80  80 THR H    H   8.821 0.030 1 
       864  80  80 THR HA   H   3.788 0.030 1 
       865  80  80 THR HB   H   4.190 0.030 1 
       866  80  80 THR HG2  H   1.258 0.030 1 
       867  80  80 THR C    C 175.348 0.300 1 
       868  80  80 THR CA   C  65.100 0.300 1 
       869  80  80 THR CB   C  69.218 0.300 1 
       870  80  80 THR CG2  C  22.198 0.300 1 
       871  80  80 THR N    N 108.315 0.300 1 
       872  81  81 VAL H    H   8.058 0.030 1 
       873  81  81 VAL HA   H   4.012 0.030 1 
       874  81  81 VAL HB   H   2.030 0.030 1 
       875  81  81 VAL HG1  H   0.991 0.030 1 
       876  81  81 VAL HG2  H   0.859 0.030 1 
       877  81  81 VAL C    C 177.416 0.300 1 
       878  81  81 VAL CA   C  63.938 0.300 1 
       879  81  81 VAL CB   C  32.228 0.300 1 
       880  81  81 VAL CG1  C  22.055 0.300 2 
       881  81  81 VAL CG2  C  21.119 0.300 2 
       882  81  81 VAL N    N 119.719 0.300 1 
       883  82  82 GLY H    H   7.441 0.030 1 
       884  82  82 GLY HA2  H   3.844 0.030 2 
       885  82  82 GLY HA3  H   3.340 0.030 2 
       886  82  82 GLY C    C 172.559 0.300 1 
       887  82  82 GLY CA   C  47.406 0.300 1 
       888  82  82 GLY N    N 101.235 0.300 1 
       889  83  83 HIS H    H   7.296 0.030 1 
       890  83  83 HIS HA   H   4.876 0.030 1 
       891  83  83 HIS HB2  H   3.543 0.030 2 
       892  83  83 HIS HB3  H   3.308 0.030 2 
       893  83  83 HIS HD2  H   7.150 0.030 1 
       894  83  83 HIS HE1  H   8.500 0.030 1 
       895  83  83 HIS C    C 175.816 0.300 1 
       896  83  83 HIS CA   C  55.693 0.300 1 
       897  83  83 HIS CB   C  26.572 0.300 1 
       898  83  83 HIS CD2  C 120.069 0.300 1 
       899  83  83 HIS CE1  C 136.048 0.300 1 
       900  83  83 HIS N    N 113.794 0.300 1 
       901  84  84 LEU H    H   7.865 0.030 1 
       902  84  84 LEU HA   H   4.213 0.030 1 
       903  84  84 LEU HB2  H   1.508 0.030 2 
       904  84  84 LEU HB3  H   1.429 0.030 2 
       905  84  84 LEU HG   H   1.694 0.030 1 
       906  84  84 LEU HD1  H   0.892 0.030 1 
       907  84  84 LEU HD2  H   1.063 0.030 1 
       908  84  84 LEU C    C 175.466 0.300 1 
       909  84  84 LEU CA   C  54.802 0.300 1 
       910  84  84 LEU CB   C  42.683 0.300 1 
       911  84  84 LEU CG   C  27.528 0.300 1 
       912  84  84 LEU CD1  C  26.131 0.300 2 
       913  84  84 LEU CD2  C  23.691 0.300 2 
       914  84  84 LEU N    N 117.192 0.300 1 
       915  85  85 ARG H    H   8.802 0.030 1 
       916  85  85 ARG HA   H   4.899 0.030 1 
       917  85  85 ARG HB2  H   1.728 0.030 2 
       918  85  85 ARG HB3  H   1.657 0.030 2 
       919  85  85 ARG HG2  H   1.683 0.030 2 
       920  85  85 ARG HG3  H   1.535 0.030 2 
       921  85  85 ARG HD2  H   3.094 0.030 2 
       922  85  85 ARG HD3  H   3.000 0.030 2 
       923  85  85 ARG HE   H   7.186 0.030 1 
       924  85  85 ARG C    C 172.783 0.300 1 
       925  85  85 ARG CA   C  53.247 0.300 1 
       926  85  85 ARG CB   C  32.945 0.300 1 
       927  85  85 ARG CG   C  26.458 0.300 1 
       928  85  85 ARG CD   C  44.103 0.300 1 
       929  85  85 ARG N    N 118.809 0.300 1 
       930  86  86 PRO HA   H   4.020 0.030 1 
       931  86  86 PRO HB2  H   2.085 0.030 2 
       932  86  86 PRO HB3  H   1.888 0.030 2 
       933  86  86 PRO HG2  H   2.269 0.030 2 
       934  86  86 PRO HG3  H   1.655 0.030 2 
       935  86  86 PRO HD2  H   3.650 0.030 2 
       936  86  86 PRO HD3  H   3.611 0.030 2 
       937  86  86 PRO C    C 177.433 0.300 1 
       938  86  86 PRO CA   C  63.221 0.300 1 
       939  86  86 PRO CB   C  31.267 0.300 1 
       940  86  86 PRO CG   C  28.942 0.300 1 
       941  86  86 PRO CD   C  50.933 0.300 1 
       942  87  87 GLY H    H   9.276 0.030 1 
       943  87  87 GLY HA2  H   4.571 0.030 2 
       944  87  87 GLY HA3  H   3.617 0.030 2 
       945  87  87 GLY C    C 175.052 0.300 1 
       946  87  87 GLY CA   C  44.805 0.300 1 
       947  87  87 GLY N    N 114.260 0.300 1 
       948  88  88 ASP H    H   8.014 0.030 1 
       949  88  88 ASP HA   H   4.849 0.030 1 
       950  88  88 ASP HB2  H   2.928 0.030 2 
       951  88  88 ASP HB3  H   2.521 0.030 2 
       952  88  88 ASP C    C 175.194 0.300 1 
       953  88  88 ASP CA   C  56.441 0.300 1 
       954  88  88 ASP CB   C  41.203 0.300 1 
       955  88  88 ASP N    N 123.596 0.300 1 
       956  89  89 GLU H    H   9.047 0.030 1 
       957  89  89 GLU HA   H   4.708 0.030 1 
       958  89  89 GLU HB2  H   2.152 0.030 2 
       959  89  89 GLU HB3  H   1.930 0.030 2 
       960  89  89 GLU HG2  H   1.973 0.030 2 
       961  89  89 GLU HG3  H   1.723 0.030 2 
       962  89  89 GLU C    C 176.500 0.300 1 
       963  89  89 GLU CA   C  54.717 0.300 1 
       964  89  89 GLU CB   C  31.178 0.300 1 
       965  89  89 GLU CG   C  35.733 0.300 1 
       966  89  89 GLU N    N 125.583 0.300 1 
       967  90  90 VAL H    H   8.672 0.030 1 
       968  90  90 VAL HA   H   4.387 0.030 1 
       969  90  90 VAL HB   H   1.885 0.030 1 
       970  90  90 VAL HG1  H   1.045 0.030 1 
       971  90  90 VAL HG2  H   0.922 0.030 1 
       972  90  90 VAL C    C 174.704 0.300 1 
       973  90  90 VAL CA   C  61.982 0.300 1 
       974  90  90 VAL CB   C  31.509 0.300 1 
       975  90  90 VAL CG1  C  24.190 0.300 2 
       976  90  90 VAL CG2  C  22.059 0.300 2 
       977  90  90 VAL N    N 126.661 0.300 1 
       978  91  91 LEU H    H   9.245 0.030 1 
       979  91  91 LEU HA   H   4.354 0.030 1 
       980  91  91 LEU HB2  H   1.527 0.030 1 
       981  91  91 LEU HB3  H   1.527 0.030 1 
       982  91  91 LEU HG   H   1.474 0.030 1 
       983  91  91 LEU HD1  H   0.814 0.030 1 
       984  91  91 LEU HD2  H   0.744 0.030 1 
       985  91  91 LEU C    C 178.409 0.300 1 
       986  91  91 LEU CA   C  56.800 0.300 1 
       987  91  91 LEU CB   C  42.760 0.300 1 
       988  91  91 LEU CG   C  27.683 0.300 1 
       989  91  91 LEU CD1  C  25.707 0.300 2 
       990  91  91 LEU CD2  C  23.145 0.300 2 
       991  91  91 LEU N    N 126.956 0.300 1 
       992  92  92 GLU H    H   7.793 0.030 1 
       993  92  92 GLU HA   H   5.308 0.030 1 
       994  92  92 GLU HB2  H   1.756 0.030 1 
       995  92  92 GLU HB3  H   1.756 0.030 1 
       996  92  92 GLU HG2  H   2.038 0.030 2 
       997  92  92 GLU HG3  H   1.896 0.030 2 
       998  92  92 GLU C    C 173.803 0.300 1 
       999  92  92 GLU CA   C  54.958 0.300 1 
      1000  92  92 GLU CB   C  35.471 0.300 1 
      1001  92  92 GLU CG   C  36.200 0.300 1 
      1002  92  92 GLU N    N 116.233 0.300 1 
      1003  93  93 TRP H    H   8.769 0.030 1 
      1004  93  93 TRP HA   H   4.683 0.030 1 
      1005  93  93 TRP HB2  H   3.224 0.030 2 
      1006  93  93 TRP HB3  H   2.722 0.030 2 
      1007  93  93 TRP HD1  H   6.840 0.030 1 
      1008  93  93 TRP HE1  H   9.899 0.030 1 
      1009  93  93 TRP HE3  H   7.235 0.030 1 
      1010  93  93 TRP HZ2  H   7.337 0.030 1 
      1011  93  93 TRP HZ3  H   6.694 0.030 1 
      1012  93  93 TRP HH2  H   6.949 0.030 1 
      1013  93  93 TRP C    C 175.439 0.300 1 
      1014  93  93 TRP CA   C  56.173 0.300 1 
      1015  93  93 TRP CB   C  31.424 0.300 1 
      1016  93  93 TRP CD1  C 125.623 0.300 1 
      1017  93  93 TRP CE3  C 119.791 0.300 1 
      1018  93  93 TRP CZ2  C 114.844 0.300 1 
      1019  93  93 TRP CZ3  C 121.032 0.300 1 
      1020  93  93 TRP CH2  C 123.623 0.300 1 
      1021  93  93 TRP N    N 123.686 0.300 1 
      1022  93  93 TRP NE1  N 127.549 0.300 1 
      1023  94  94 ASN H    H   9.438 0.030 1 
      1024  94  94 ASN HA   H   4.565 0.030 1 
      1025  94  94 ASN HB2  H   3.485 0.030 2 
      1026  94  94 ASN HB3  H   2.698 0.030 2 
      1027  94  94 ASN HD21 H   8.244 0.030 2 
      1028  94  94 ASN HD22 H   6.909 0.030 2 
      1029  94  94 ASN C    C 175.704 0.300 1 
      1030  94  94 ASN CA   C  53.858 0.300 1 
      1031  94  94 ASN CB   C  37.748 0.300 1 
      1032  94  94 ASN N    N 128.827 0.300 1 
      1033  94  94 ASN ND2  N 109.808 0.300 1 
      1034  95  95 GLY H    H   9.216 0.030 1 
      1035  95  95 GLY HA2  H   4.057 0.030 2 
      1036  95  95 GLY HA3  H   3.732 0.030 2 
      1037  95  95 GLY C    C 174.048 0.300 1 
      1038  95  95 GLY CA   C  45.418 0.300 1 
      1039  95  95 GLY N    N 104.028 0.300 1 
      1040  96  96 ARG H    H   7.808 0.030 1 
      1041  96  96 ARG HA   H   4.575 0.030 1 
      1042  96  96 ARG HB2  H   2.118 0.030 2 
      1043  96  96 ARG HB3  H   1.801 0.030 2 
      1044  96  96 ARG HG2  H   1.833 0.030 2 
      1045  96  96 ARG HG3  H   1.681 0.030 2 
      1046  96  96 ARG HD2  H   3.271 0.030 1 
      1047  96  96 ARG HD3  H   3.271 0.030 1 
      1048  96  96 ARG HE   H   7.363 0.030 1 
      1049  96  96 ARG C    C 175.529 0.300 1 
      1050  96  96 ARG CA   C  54.275 0.300 1 
      1051  96  96 ARG CB   C  30.620 0.300 1 
      1052  96  96 ARG CG   C  27.058 0.300 1 
      1053  96  96 ARG CD   C  42.997 0.300 1 
      1054  96  96 ARG N    N 120.573 0.300 1 
      1055  96  96 ARG NE   N  84.396 0.300 1 
      1056  97  97 LEU H    H   8.551 0.030 1 
      1057  97  97 LEU HA   H   4.506 0.030 1 
      1058  97  97 LEU HB2  H   1.818 0.030 2 
      1059  97  97 LEU HB3  H   1.694 0.030 2 
      1060  97  97 LEU HG   H   1.786 0.030 1 
      1061  97  97 LEU HD1  H   0.928 0.030 1 
      1062  97  97 LEU HD2  H   1.031 0.030 1 
      1063  97  97 LEU C    C 177.458 0.300 1 
      1064  97  97 LEU CA   C  55.892 0.300 1 
      1065  97  97 LEU CB   C  42.244 0.300 1 
      1066  97  97 LEU CG   C  27.523 0.300 1 
      1067  97  97 LEU CD1  C  24.672 0.300 2 
      1068  97  97 LEU CD2  C  24.272 0.300 2 
      1069  97  97 LEU N    N 125.556 0.300 1 
      1070  98  98 LEU H    H   8.429 0.030 1 
      1071  98  98 LEU HA   H   4.326 0.030 1 
      1072  98  98 LEU HB2  H   1.930 0.030 2 
      1073  98  98 LEU HB3  H   1.351 0.030 2 
      1074  98  98 LEU HG   H   1.585 0.030 1 
      1075  98  98 LEU HD1  H   0.750 0.030 1 
      1076  98  98 LEU HD2  H   0.680 0.030 1 
      1077  98  98 LEU C    C 177.982 0.300 1 
      1078  98  98 LEU CA   C  54.480 0.300 1 
      1079  98  98 LEU CB   C  41.122 0.300 1 
      1080  98  98 LEU CG   C  27.293 0.300 1 
      1081  98  98 LEU CD1  C  25.867 0.300 2 
      1082  98  98 LEU CD2  C  22.824 0.300 2 
      1083  98  98 LEU N    N 120.956 0.300 1 
      1084  99  99 GLN H    H   7.571 0.030 1 
      1085  99  99 GLN HA   H   4.567 0.030 1 
      1086  99  99 GLN HB2  H   2.092 0.030 2 
      1087  99  99 GLN HB3  H   2.008 0.030 2 
      1088  99  99 GLN HG2  H   2.731 0.030 2 
      1089  99  99 GLN HG3  H   2.444 0.030 2 
      1090  99  99 GLN HE21 H   8.629 0.030 2 
      1091  99  99 GLN HE22 H   6.704 0.030 2 
      1092  99  99 GLN C    C 177.947 0.300 1 
      1093  99  99 GLN CA   C  58.171 0.300 1 
      1094  99  99 GLN CB   C  29.529 0.300 1 
      1095  99  99 GLN CG   C  35.487 0.300 1 
      1096  99  99 GLN N    N 120.740 0.300 1 
      1097  99  99 GLN NE2  N 115.631 0.300 1 
      1098 100 100 GLY H    H   9.596 0.030 1 
      1099 100 100 GLY HA2  H   4.339 0.030 2 
      1100 100 100 GLY HA3  H   3.907 0.030 2 
      1101 100 100 GLY C    C 172.853 0.300 1 
      1102 100 100 GLY CA   C  45.497 0.300 1 
      1103 100 100 GLY N    N 115.785 0.300 1 
      1104 101 101 ALA H    H   7.370 0.030 1 
      1105 101 101 ALA HA   H   4.632 0.030 1 
      1106 101 101 ALA HB   H   1.376 0.030 1 
      1107 101 101 ALA C    C 177.108 0.300 1 
      1108 101 101 ALA CA   C  50.952 0.300 1 
      1109 101 101 ALA CB   C  20.087 0.300 1 
      1110 101 101 ALA N    N 123.505 0.300 1 
      1111 102 102 THR H    H   8.577 0.030 1 
      1112 102 102 THR HA   H   4.278 0.030 1 
      1113 102 102 THR HB   H   4.797 0.030 1 
      1114 102 102 THR HG2  H   1.346 0.030 1 
      1115 102 102 THR C    C 174.781 0.300 1 
      1116 102 102 THR CA   C  61.123 0.300 1 
      1117 102 102 THR CB   C  71.651 0.300 1 
      1118 102 102 THR CG2  C  22.133 0.300 1 
      1119 102 102 THR N    N 109.760 0.300 1 
      1120 103 103 PHE H    H   9.112 0.030 1 
      1121 103 103 PHE HA   H   3.612 0.030 1 
      1122 103 103 PHE HB2  H   3.379 0.030 2 
      1123 103 103 PHE HB3  H   2.996 0.030 2 
      1124 103 103 PHE HD1  H   7.379 0.030 1 
      1125 103 103 PHE HD2  H   7.379 0.030 1 
      1126 103 103 PHE HE1  H   7.323 0.030 1 
      1127 103 103 PHE HE2  H   7.323 0.030 1 
      1128 103 103 PHE HZ   H   7.305 0.030 1 
      1129 103 103 PHE C    C 177.912 0.300 1 
      1130 103 103 PHE CA   C  62.252 0.300 1 
      1131 103 103 PHE CB   C  39.115 0.300 1 
      1132 103 103 PHE CD1  C 132.449 0.300 1 
      1133 103 103 PHE CD2  C 132.449 0.300 1 
      1134 103 103 PHE CE1  C 131.193 0.300 1 
      1135 103 103 PHE CE2  C 131.193 0.300 1 
      1136 103 103 PHE CZ   C 130.102 0.300 1 
      1137 103 103 PHE N    N 119.954 0.300 1 
      1138 104 104 GLU H    H   9.085 0.030 1 
      1139 104 104 GLU HA   H   3.762 0.030 1 
      1140 104 104 GLU HB2  H   2.087 0.030 2 
      1141 104 104 GLU HB3  H   1.942 0.030 2 
      1142 104 104 GLU HG2  H   2.450 0.030 2 
      1143 104 104 GLU HG3  H   2.325 0.030 2 
      1144 104 104 GLU C    C 178.401 0.300 1 
      1145 104 104 GLU CA   C  60.023 0.300 1 
      1146 104 104 GLU CB   C  29.360 0.300 1 
      1147 104 104 GLU CG   C  37.088 0.300 1 
      1148 104 104 GLU N    N 119.453 0.300 1 
      1149 105 105 GLU H    H   7.664 0.030 1 
      1150 105 105 GLU HA   H   3.977 0.030 1 
      1151 105 105 GLU HB2  H   2.314 0.030 2 
      1152 105 105 GLU HB3  H   1.874 0.030 2 
      1153 105 105 GLU HG2  H   2.370 0.030 2 
      1154 105 105 GLU HG3  H   2.257 0.030 2 
      1155 105 105 GLU C    C 179.806 0.300 1 
      1156 105 105 GLU CA   C  59.183 0.300 1 
      1157 105 105 GLU CB   C  30.165 0.300 1 
      1158 105 105 GLU CG   C  37.288 0.300 1 
      1159 105 105 GLU N    N 119.974 0.300 1 
      1160 106 106 VAL H    H   8.234 0.030 1 
      1161 106 106 VAL HA   H   3.246 0.030 1 
      1162 106 106 VAL HB   H   1.907 0.030 1 
      1163 106 106 VAL HG1  H   1.055 0.030 1 
      1164 106 106 VAL HG2  H   0.561 0.030 1 
      1165 106 106 VAL C    C 176.137 0.300 1 
      1166 106 106 VAL CA   C  67.403 0.300 1 
      1167 106 106 VAL CB   C  31.087 0.300 1 
      1168 106 106 VAL CG1  C  25.316 0.300 2 
      1169 106 106 VAL CG2  C  21.705 0.300 2 
      1170 106 106 VAL N    N 119.199 0.300 1 
      1171 107 107 TYR H    H   7.976 0.030 1 
      1172 107 107 TYR HA   H   3.578 0.030 1 
      1173 107 107 TYR HB2  H   2.877 0.030 2 
      1174 107 107 TYR HB3  H   2.369 0.030 2 
      1175 107 107 TYR HD1  H   6.994 0.030 1 
      1176 107 107 TYR HD2  H   6.994 0.030 1 
      1177 107 107 TYR HE1  H   6.832 0.030 1 
      1178 107 107 TYR HE2  H   6.832 0.030 1 
      1179 107 107 TYR C    C 178.024 0.300 1 
      1180 107 107 TYR CA   C  61.573 0.300 1 
      1181 107 107 TYR CB   C  38.150 0.300 1 
      1182 107 107 TYR CD1  C 133.303 0.300 1 
      1183 107 107 TYR CD2  C 133.303 0.300 1 
      1184 107 107 TYR CE1  C 118.176 0.300 1 
      1185 107 107 TYR CE2  C 118.176 0.300 1 
      1186 107 107 TYR N    N 119.471 0.300 1 
      1187 108 108 ASN H    H   8.071 0.030 1 
      1188 108 108 ASN HA   H   4.348 0.030 1 
      1189 108 108 ASN HB2  H   2.838 0.030 2 
      1190 108 108 ASN HB3  H   2.751 0.030 2 
      1191 108 108 ASN HD21 H   7.583 0.030 2 
      1192 108 108 ASN HD22 H   6.958 0.030 2 
      1193 108 108 ASN C    C 177.318 0.300 1 
      1194 108 108 ASN CA   C  56.396 0.300 1 
      1195 108 108 ASN CB   C  38.322 0.300 1 
      1196 108 108 ASN N    N 117.291 0.300 1 
      1197 108 108 ASN ND2  N 112.319 0.300 1 
      1198 109 109 ILE H    H   8.004 0.030 1 
      1199 109 109 ILE HA   H   3.511 0.030 1 
      1200 109 109 ILE HB   H   1.663 0.030 1 
      1201 109 109 ILE HG12 H   1.760 0.030 2 
      1202 109 109 ILE HG13 H   0.820 0.030 2 
      1203 109 109 ILE HG2  H   0.723 0.030 1 
      1204 109 109 ILE HD1  H   0.642 0.030 1 
      1205 109 109 ILE C    C 178.639 0.300 1 
      1206 109 109 ILE CA   C  65.577 0.300 1 
      1207 109 109 ILE CB   C  38.412 0.300 1 
      1208 109 109 ILE CG1  C  30.352 0.300 1 
      1209 109 109 ILE CG2  C  17.059 0.300 1 
      1210 109 109 ILE CD1  C  14.037 0.300 1 
      1211 109 109 ILE N    N 123.232 0.300 1 
      1212 110 110 ILE H    H   7.782 0.030 1 
      1213 110 110 ILE HA   H   2.765 0.030 1 
      1214 110 110 ILE HB   H   1.269 0.030 1 
      1215 110 110 ILE HG12 H   0.680 0.030 2 
      1216 110 110 ILE HG13 H  -1.260 0.030 2 
      1217 110 110 ILE HG2  H   0.357 0.030 1 
      1218 110 110 ILE HD1  H  -0.147 0.030 1 
      1219 110 110 ILE C    C 180.875 0.300 1 
      1220 110 110 ILE CA   C  65.365 0.300 1 
      1221 110 110 ILE CB   C  36.826 0.300 1 
      1222 110 110 ILE CG1  C  27.145 0.300 1 
      1223 110 110 ILE CG2  C  16.293 0.300 1 
      1224 110 110 ILE CD1  C  12.847 0.300 1 
      1225 110 110 ILE N    N 120.577 0.300 1 
      1226 111 111 LEU H    H   8.234 0.030 1 
      1227 111 111 LEU HA   H   3.876 0.030 1 
      1228 111 111 LEU HB2  H   1.687 0.030 2 
      1229 111 111 LEU HB3  H   1.339 0.030 2 
      1230 111 111 LEU HG   H   1.440 0.030 1 
      1231 111 111 LEU HD1  H   0.861 0.030 1 
      1232 111 111 LEU HD2  H   0.818 0.030 1 
      1233 111 111 LEU C    C 180.477 0.300 1 
      1234 111 111 LEU CA   C  58.545 0.300 1 
      1235 111 111 LEU CB   C  42.098 0.300 1 
      1236 111 111 LEU CG   C  26.873 0.300 1 
      1237 111 111 LEU CD1  C  25.026 0.300 2 
      1238 111 111 LEU CD2  C  23.969 0.300 2 
      1239 111 111 LEU N    N 124.938 0.300 1 
      1240 112 112 GLU H    H   8.440 0.030 1 
      1241 112 112 GLU HA   H   4.008 0.030 1 
      1242 112 112 GLU HB2  H   2.112 0.030 1 
      1243 112 112 GLU HB3  H   2.112 0.030 1 
      1244 112 112 GLU HG2  H   2.485 0.030 2 
      1245 112 112 GLU HG3  H   2.315 0.030 2 
      1246 112 112 GLU C    C 177.034 0.300 1 
      1247 112 112 GLU CA   C  58.685 0.300 1 
      1248 112 112 GLU CB   C  29.401 0.300 1 
      1249 112 112 GLU CG   C  36.819 0.300 1 
      1250 112 112 GLU N    N 119.440 0.300 1 
      1251 113 113 SER H    H   7.588 0.030 1 
      1252 113 113 SER HA   H   4.714 0.030 1 
      1253 113 113 SER HB2  H   4.310 0.030 2 
      1254 113 113 SER HB3  H   4.284 0.030 2 
      1255 113 113 SER C    C 175.024 0.300 1 
      1256 113 113 SER CA   C  58.531 0.300 1 
      1257 113 113 SER CB   C  65.082 0.300 1 
      1258 113 113 SER N    N 111.273 0.300 1 
      1259 114 114 LYS H    H   7.738 0.030 1 
      1260 114 114 LYS HA   H   4.154 0.030 1 
      1261 114 114 LYS HB2  H   2.116 0.030 2 
      1262 114 114 LYS HB3  H   1.968 0.030 2 
      1263 114 114 LYS HG2  H   1.698 0.030 2 
      1264 114 114 LYS HG3  H   1.459 0.030 2 
      1265 114 114 LYS HD2  H   1.762 0.030 1 
      1266 114 114 LYS HD3  H   1.762 0.030 1 
      1267 114 114 LYS HE2  H   3.006 0.030 1 
      1268 114 114 LYS HE3  H   3.006 0.030 1 
      1269 114 114 LYS C    C 171.521 0.300 1 
      1270 114 114 LYS CA   C  62.130 0.300 1 
      1271 114 114 LYS CB   C  30.493 0.300 1 
      1272 114 114 LYS CG   C  25.654 0.300 1 
      1273 114 114 LYS CD   C  29.708 0.300 1 
      1274 114 114 LYS CE   C  42.161 0.300 1 
      1275 114 114 LYS N    N 125.867 0.300 1 
      1276 115 115 PRO HA   H   4.561 0.030 1 
      1277 115 115 PRO HB2  H   2.285 0.030 2 
      1278 115 115 PRO HB3  H   1.929 0.030 2 
      1279 115 115 PRO HG2  H   1.982 0.030 1 
      1280 115 115 PRO HG3  H   1.982 0.030 1 
      1281 115 115 PRO HD2  H   3.742 0.030 2 
      1282 115 115 PRO HD3  H   3.618 0.030 2 
      1283 115 115 PRO C    C 177.252 0.300 1 
      1284 115 115 PRO CA   C  64.419 0.300 1 
      1285 115 115 PRO CB   C  31.677 0.300 1 
      1286 115 115 PRO CG   C  27.578 0.300 1 
      1287 115 115 PRO CD   C  50.186 0.300 1 
      1288 116 116 GLU H    H   7.752 0.030 1 
      1289 116 116 GLU HA   H   4.460 0.030 1 
      1290 116 116 GLU HB2  H   2.251 0.030 2 
      1291 116 116 GLU HB3  H   2.119 0.030 2 
      1292 116 116 GLU HG2  H   2.468 0.030 2 
      1293 116 116 GLU HG3  H   2.319 0.030 2 
      1294 116 116 GLU C    C 176.992 0.300 1 
      1295 116 116 GLU CA   C  54.687 0.300 1 
      1296 116 116 GLU CB   C  29.012 0.300 1 
      1297 116 116 GLU CG   C  36.436 0.300 1 
      1298 116 116 GLU N    N 118.790 0.300 1 
      1299 117 117 PRO HA   H   4.304 0.030 1 
      1300 117 117 PRO HB2  H   2.160 0.030 2 
      1301 117 117 PRO HB3  H   2.003 0.030 2 
      1302 117 117 PRO HG2  H   2.089 0.030 2 
      1303 117 117 PRO HG3  H   2.005 0.030 2 
      1304 117 117 PRO HD2  H   3.962 0.030 2 
      1305 117 117 PRO HD3  H   3.828 0.030 2 
      1306 117 117 PRO C    C 174.314 0.300 1 
      1307 117 117 PRO CA   C  64.544 0.300 1 
      1308 117 117 PRO CB   C  32.059 0.300 1 
      1309 117 117 PRO CG   C  27.310 0.300 1 
      1310 117 117 PRO CD   C  50.687 0.300 1 
      1311 118 118 GLN H    H   7.280 0.030 1 
      1312 118 118 GLN HA   H   5.052 0.030 1 
      1313 118 118 GLN HB2  H   2.105 0.030 2 
      1314 118 118 GLN HB3  H   1.734 0.030 2 
      1315 118 118 GLN HG2  H   2.100 0.030 2 
      1316 118 118 GLN HG3  H   2.022 0.030 2 
      1317 118 118 GLN HE21 H   7.568 0.030 2 
      1318 118 118 GLN HE22 H   6.849 0.030 2 
      1319 118 118 GLN C    C 173.670 0.300 1 
      1320 118 118 GLN CA   C  53.956 0.300 1 
      1321 118 118 GLN CB   C  31.826 0.300 1 
      1322 118 118 GLN CG   C  32.802 0.300 1 
      1323 118 118 GLN N    N 112.508 0.300 1 
      1324 118 118 GLN NE2  N 112.837 0.300 1 
      1325 119 119 VAL H    H   8.523 0.030 1 
      1326 119 119 VAL HA   H   4.419 0.030 1 
      1327 119 119 VAL HB   H   1.339 0.030 1 
      1328 119 119 VAL HG1  H   0.569 0.030 1 
      1329 119 119 VAL HG2  H  -0.104 0.030 1 
      1330 119 119 VAL C    C 172.971 0.300 1 
      1331 119 119 VAL CA   C  60.495 0.300 1 
      1332 119 119 VAL CB   C  35.470 0.300 1 
      1333 119 119 VAL CG1  C  21.089 0.300 2 
      1334 119 119 VAL CG2  C  19.866 0.300 2 
      1335 119 119 VAL N    N 119.511 0.300 1 
      1336 120 120 GLU H    H   8.410 0.030 1 
      1337 120 120 GLU HA   H   5.066 0.030 1 
      1338 120 120 GLU HB2  H   1.913 0.030 2 
      1339 120 120 GLU HB3  H   1.673 0.030 2 
      1340 120 120 GLU HG2  H   1.912 0.030 2 
      1341 120 120 GLU HG3  H   1.808 0.030 2 
      1342 120 120 GLU C    C 174.900 0.300 1 
      1343 120 120 GLU CA   C  54.031 0.300 1 
      1344 120 120 GLU CB   C  31.822 0.300 1 
      1345 120 120 GLU CG   C  37.062 0.300 1 
      1346 120 120 GLU N    N 127.036 0.300 1 
      1347 121 121 LEU H    H   9.319 0.030 1 
      1348 121 121 LEU HA   H   5.064 0.030 1 
      1349 121 121 LEU HB2  H   1.499 0.030 2 
      1350 121 121 LEU HB3  H   1.260 0.030 2 
      1351 121 121 LEU HG   H   1.248 0.030 1 
      1352 121 121 LEU HD1  H   0.420 0.030 1 
      1353 121 121 LEU HD2  H   0.318 0.030 1 
      1354 121 121 LEU C    C 175.865 0.300 1 
      1355 121 121 LEU CA   C  53.708 0.300 1 
      1356 121 121 LEU CB   C  45.520 0.300 1 
      1357 121 121 LEU CG   C  27.528 0.300 1 
      1358 121 121 LEU CD1  C  26.162 0.300 2 
      1359 121 121 LEU CD2  C  25.890 0.300 2 
      1360 121 121 LEU N    N 127.153 0.300 1 
      1361 122 122 VAL H    H   8.034 0.030 1 
      1362 122 122 VAL HA   H   5.045 0.030 1 
      1363 122 122 VAL HB   H   1.724 0.030 1 
      1364 122 122 VAL HG1  H   0.830 0.030 1 
      1365 122 122 VAL HG2  H   0.764 0.030 1 
      1366 122 122 VAL C    C 176.207 0.300 1 
      1367 122 122 VAL CA   C  61.763 0.300 1 
      1368 122 122 VAL CB   C  33.197 0.300 1 
      1369 122 122 VAL CG1  C  21.507 0.300 2 
      1370 122 122 VAL CG2  C  21.125 0.300 2 
      1371 122 122 VAL N    N 121.549 0.300 1 
      1372 123 123 VAL H    H   9.371 0.030 1 
      1373 123 123 VAL HA   H   5.495 0.030 1 
      1374 123 123 VAL HB   H   2.057 0.030 1 
      1375 123 123 VAL HG1  H   1.020 0.030 1 
      1376 123 123 VAL HG2  H   0.766 0.030 1 
      1377 123 123 VAL C    C 173.957 0.300 1 
      1378 123 123 VAL CA   C  59.017 0.300 1 
      1379 123 123 VAL CB   C  35.897 0.300 1 
      1380 123 123 VAL CG1  C  22.080 0.300 2 
      1381 123 123 VAL CG2  C  20.629 0.300 2 
      1382 123 123 VAL N    N 123.941 0.300 1 
      1383 124 124 SER H    H   9.431 0.030 1 
      1384 124 124 SER HA   H   5.744 0.030 1 
      1385 124 124 SER HB2  H   3.719 0.030 2 
      1386 124 124 SER HB3  H   3.600 0.030 2 
      1387 124 124 SER C    C 173.334 0.300 1 
      1388 124 124 SER CA   C  55.924 0.300 1 
      1389 124 124 SER CB   C  65.066 0.300 1 
      1390 124 124 SER N    N 116.213 0.300 1 
      1391 125 125 ARG H    H   9.442 0.030 1 
      1392 125 125 ARG HA   H   5.050 0.030 1 
      1393 125 125 ARG HB2  H   1.891 0.030 1 
      1394 125 125 ARG HB3  H   1.891 0.030 1 
      1395 125 125 ARG HG2  H   1.670 0.030 1 
      1396 125 125 ARG HG3  H   1.670 0.030 1 
      1397 125 125 ARG HD2  H   2.980 0.030 2 
      1398 125 125 ARG HD3  H   2.370 0.030 2 
      1399 125 125 ARG HE   H   9.176 0.030 1 
      1400 125 125 ARG C    C 175.522 0.300 1 
      1401 125 125 ARG CA   C  54.872 0.300 1 
      1402 125 125 ARG CB   C  34.880 0.300 1 
      1403 125 125 ARG CG   C  26.045 0.300 1 
      1404 125 125 ARG CD   C  43.573 0.300 1 
      1405 125 125 ARG N    N 128.431 0.300 1 
      1406 125 125 ARG NE   N  85.101 0.300 1 
      1407 126 126 SER H    H   8.903 0.030 1 
      1408 126 126 SER HA   H   4.606 0.030 1 
      1409 126 126 SER HB2  H   3.957 0.030 1 
      1410 126 126 SER HB3  H   3.957 0.030 1 
      1411 126 126 SER C    C 174.376 0.300 1 
      1412 126 126 SER CA   C  59.108 0.300 1 
      1413 126 126 SER CB   C  64.170 0.300 1 
      1414 126 126 SER N    N 120.736 0.300 1 
      1415 127 127 GLY H    H   8.316 0.030 1 
      1416 127 127 GLY HA2  H   4.114 0.030 2 
      1417 127 127 GLY HA3  H   3.980 0.030 2 
      1418 127 127 GLY C    C 171.717 0.300 1 
      1419 127 127 GLY CA   C  44.675 0.300 1 
      1420 127 127 GLY N    N 110.880 0.300 1 
      1421 128 128 PRO HA   H   4.444 0.030 1 
      1422 128 128 PRO HB2  H   2.251 0.030 2 
      1423 128 128 PRO HB3  H   1.962 0.030 2 
      1424 128 128 PRO HG2  H   1.989 0.030 1 
      1425 128 128 PRO HG3  H   1.989 0.030 1 
      1426 128 128 PRO HD2  H   3.626 0.030 2 
      1427 128 128 PRO HD3  H   3.546 0.030 2 
      1428 128 128 PRO C    C 177.377 0.300 1 
      1429 128 128 PRO CA   C  63.233 0.300 1 
      1430 128 128 PRO CB   C  32.217 0.300 1 
      1431 128 128 PRO CG   C  27.150 0.300 1 
      1432 128 128 PRO CD   C  49.801 0.300 1 
      1433 129 129 SER H    H   8.482 0.030 1 
      1434 129 129 SER HA   H   4.437 0.030 1 
      1435 129 129 SER HB2  H   3.869 0.030 2 
      1436 129 129 SER HB3  H   3.833 0.030 2 
      1437 129 129 SER C    C 174.656 0.300 1 
      1438 129 129 SER CA   C  58.491 0.300 1 
      1439 129 129 SER CB   C  63.751 0.300 1 
      1440 129 129 SER N    N 116.147 0.300 1 
      1441 130 130 SER H    H   8.245 0.030 1 
      1442 130 130 SER HA   H   4.450 0.030 1 
      1443 130 130 SER HB2  H   3.892 0.030 2 
      1444 130 130 SER HB3  H   3.843 0.030 2 
      1445 130 130 SER C    C 173.894 0.300 1 
      1446 130 130 SER CA   C  58.388 0.300 1 
      1447 130 130 SER CB   C  64.092 0.300 1 
      1448 130 130 SER N    N 117.716 0.300 1 
      1449 131 131 GLY H    H   8.016 0.030 1 
      1450 131 131 GLY HA2  H   3.761 0.030 2 
      1451 131 131 GLY HA3  H   3.725 0.030 2 
      1452 131 131 GLY C    C 178.956 0.300 1 
      1453 131 131 GLY CA   C  46.221 0.300 1 
      1454 131 131 GLY N    N 116.761 0.300 1 

   stop_

save_