data_c30521_6mk4


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

save_entry_information
   _Entry.Sf_category                   entry_information
   _Entry.Sf_framecode                  entry_information
   _Entry.ID                            c30521_6mk4
   _Entry.Title                       
;
Solution NMR structure of spider toxin analogue [E17K]ProTx-II
;
   _Entry.Type                          macromolecule
   _Entry.Version_type                  original
   _Entry.Submission_date               2018-09-25
   _Entry.Accession_date                2018-09-25
   _Entry.Last_release_date             2018-09-26
   _Entry.Original_release_date         2018-09-26
   _Entry.Origination                   author
   _Entry.Format_name                   .
   _Entry.NMR_STAR_version              3.2.0.16
   _Entry.Original_NMR_STAR_version     3.1
   _Entry.Experimental_method           NMR
   _Entry.Experimental_method_subtype   SOLUTION
   _Entry.Source_data_format            .
   _Entry.Source_data_format_version    .
   _Entry.Generated_software_name       .
   _Entry.Generated_software_version    .
   _Entry.Generated_software_ID         .
   _Entry.Generated_software_label      .
   _Entry.Generated_date                .
   _Entry.DOI                           .
   _Entry.UUID                          .
   _Entry.Related_coordinate_file_name  .
   _Entry.Details                       .
   _Entry.BMRB_internal_directory_name  .

   loop_
      _Entry_experimental_methods.ID
      _Entry_experimental_methods.Method
      _Entry_experimental_methods.Subtype
      _Entry_experimental_methods.Entry_ID

     1   'SOLUTION NMR'   'SOLUTION NMR'   c30521_6mk4    

   stop_

   loop_
      _Entry_author.Ordinal
      _Entry_author.Given_name
      _Entry_author.Family_name
      _Entry_author.First_initial
      _Entry_author.Middle_initials
      _Entry_author.Family_title
      _Entry_author.ORCID
      _Entry_author.Entry_ID

     1   C.   Schroeder   C.   I.   .   .   c30521_6mk4    

   stop_

   loop_
      _Struct_keywords.Keywords
      _Struct_keywords.Text
      _Struct_keywords.Entry_ID

     'ProTx-II analogue'                   .   c30521_6mk4    
     TOXIN                                 .   c30521_6mk4    
     'peptide-membrane interactions'       .   c30521_6mk4    
     'spider toxin'                        .   c30521_6mk4    
     'voltage-sensitive sodium channels'   .   c30521_6mk4    

   stop_

   loop_
      _Data_set.Type
      _Data_set.Count
      _Data_set.Entry_ID

     assigned_chemical_shifts   1   c30521_6mk4    

   stop_

   loop_
      _Datum.Type
      _Datum.Count
      _Datum.Entry_ID

     '13C chemical shifts'   86    c30521_6mk4    
     '15N chemical shifts'   28    c30521_6mk4    
     '1H chemical shifts'    219   c30521_6mk4    

   stop_

   loop_
      _Release.Release_number
      _Release.Format_type
      _Release.Format_version
      _Release.Date
      _Release.Submission_date
      _Release.Type
      _Release.Author
      _Release.Detail
      _Release.Entry_ID

     1   .   .   2018-12-13   .   original   BMRB   .   c30521_6mk4    

   stop_

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

     PDB   6MK4   .   c30521_6mk4    

   stop_

save_

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

save_citation_1
   _Citation.Sf_category                 citations
   _Citation.Sf_framecode                citation_1
   _Citation.Entry_ID                    c30521_6mk4
   _Citation.ID                          1
   _Citation.Class                       'entry citation'
   _Citation.CAS_abstract_code           .
   _Citation.MEDLINE_UI_code             .
   _Citation.DOI                         .
   _Citation.PubMed_ID                   .
   _Citation.Full_citation               .
   _Citation.Title                     
;
Peptide-membrane interactions affect the access of spider toxins ProTx-II and GpTx-1 to key NaV1.7 residues
;
   _Citation.Status                      'in preparation'
   _Citation.Type                        journal
   _Citation.Journal_abbrev              .
   _Citation.Journal_name_full           .
   _Citation.Journal_volume              .
   _Citation.Journal_issue               .
   _Citation.Journal_ASTM                .
   _Citation.Journal_ISSN                .
   _Citation.Journal_CSD                 0353
   _Citation.Book_title                  .
   _Citation.Book_chapter_title          .
   _Citation.Book_volume                 .
   _Citation.Book_series                 .
   _Citation.Book_publisher              .
   _Citation.Book_publisher_city         .
   _Citation.Book_ISBN                   .
   _Citation.Conference_title            .
   _Citation.Conference_site             .
   _Citation.Conference_state_province   .
   _Citation.Conference_country          .
   _Citation.Conference_start_date       .
   _Citation.Conference_end_date         .
   _Citation.Conference_abstract_number  .
   _Citation.Thesis_institution          .
   _Citation.Thesis_institution_city     .
   _Citation.Thesis_institution_country  .
   _Citation.WWW_URL                     .
   _Citation.Page_first                  .
   _Citation.Page_last                   .
   _Citation.Year                        .
   _Citation.Details                     .

   loop_
      _Citation_author.Ordinal
      _Citation_author.Given_name
      _Citation_author.Family_name
      _Citation_author.First_initial
      _Citation_author.Middle_initials
      _Citation_author.Family_title
      _Citation_author.ORCID
      _Citation_author.Entry_ID
      _Citation_author.Citation_ID

     1    N.   Lawrence    N.   .    .   .   c30521_6mk4   1    
     2    B.   Wu          B.   .    .   .   c30521_6mk4   1    
     3    J.   Ligutti     J.   .    .   .   c30521_6mk4   1    
     4    O.   Cheneval    O.   .    .   .   c30521_6mk4   1    
     5    A.   Agwa        A.   J.   .   .   c30521_6mk4   1    
     6    A.   Benfield    A.   H.   .   .   c30521_6mk4   1    
     7    K.   Biswas      K.   .    .   .   c30521_6mk4   1    
     8    D.   Craik       D.   J.   .   .   c30521_6mk4   1    
     9    L.   Miranda     L.   P.   .   .   c30521_6mk4   1    
     10   S.   Henriques   S.   T.   .   .   c30521_6mk4   1    
     11   C.   Schroeder   C.   I.   .   .   c30521_6mk4   1    

   stop_

save_

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

save_assembly
   _Assembly.Sf_category                      assembly
   _Assembly.Sf_framecode                     assembly
   _Assembly.Entry_ID                         c30521_6mk4
   _Assembly.ID                               1
   _Assembly.Name                             Beta/omega-theraphotoxin-Tp2a
   _Assembly.BMRB_code                        .
   _Assembly.Number_of_components             .
   _Assembly.Organic_ligands                  .
   _Assembly.Metal_ions                       .
   _Assembly.Non_standard_bonds               .
   _Assembly.Ambiguous_conformational_states  .
   _Assembly.Ambiguous_chem_comp_sites        .
   _Assembly.Molecules_in_chemical_exchange   .
   _Assembly.Paramagnetic                     no
   _Assembly.Thiol_state                      .
   _Assembly.Molecular_mass                   .
   _Assembly.Enzyme_commission_number         .
   _Assembly.Details                          .
   _Assembly.DB_query_date                    .
   _Assembly.DB_query_revised_last_date       .

   loop_
      _Entity_assembly.ID
      _Entity_assembly.Entity_assembly_name
      _Entity_assembly.Entity_ID
      _Entity_assembly.Entity_label
      _Entity_assembly.Asym_ID
      _Entity_assembly.PDB_chain_ID
      _Entity_assembly.Experimental_data_reported
      _Entity_assembly.Physical_state
      _Entity_assembly.Conformational_isomer
      _Entity_assembly.Chemical_exchange_state
      _Entity_assembly.Magnetic_equivalence_group_code
      _Entity_assembly.Role
      _Entity_assembly.Details
      _Entity_assembly.Entry_ID
      _Entity_assembly.Assembly_ID

     1   entity_1   1   $entity_1   A   A   yes   .   .   .   .   .   .   c30521_6mk4   1    

   stop_

   loop_
      _Bond.ID
      _Bond.Type
      _Bond.Value_order
      _Bond.Assembly_atom_ID_1
      _Bond.Entity_assembly_ID_1
      _Bond.Entity_assembly_name_1
      _Bond.Entity_ID_1
      _Bond.Comp_ID_1
      _Bond.Comp_index_ID_1
      _Bond.Seq_ID_1
      _Bond.Atom_ID_1
      _Bond.Assembly_atom_ID_2
      _Bond.Entity_assembly_ID_2
      _Bond.Entity_assembly_name_2
      _Bond.Entity_ID_2
      _Bond.Comp_ID_2
      _Bond.Comp_index_ID_2
      _Bond.Seq_ID_2
      _Bond.Atom_ID_2
      _Bond.Auth_entity_assembly_ID_1
      _Bond.Auth_entity_assembly_name_1
      _Bond.Auth_asym_ID_1
      _Bond.Auth_seq_ID_1
      _Bond.Auth_comp_ID_1
      _Bond.Auth_atom_ID_1
      _Bond.Auth_entity_assembly_ID_2
      _Bond.Auth_entity_assembly_name_2
      _Bond.Auth_asym_ID_2
      _Bond.Auth_seq_ID_2
      _Bond.Auth_comp_ID_2
      _Bond.Auth_atom_ID_2
      _Bond.Entry_ID
      _Bond.Assembly_ID

     1   disulfide   single   .   1   .   1   CYS   2    2    SG   .   1   .   1   CYS   16   16   SG   .   .   .   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     2   disulfide   single   .   1   .   1   CYS   9    9    SG   .   1   .   1   CYS   21   21   SG   .   .   .   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     3   disulfide   single   .   1   .   1   CYS   15   15   SG   .   1   .   1   CYS   25   25   SG   .   .   .   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    

   stop_

save_

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

save_entity_1
   _Entity.Sf_category                      entity
   _Entity.Sf_framecode                     entity_1
   _Entity.Entry_ID                         c30521_6mk4
   _Entity.ID                               1
   _Entity.BMRB_code                        .
   _Entity.Name                             entity_1
   _Entity.Type                             polymer
   _Entity.Polymer_common_type              .
   _Entity.Polymer_type                     polypeptide(L)
   _Entity.Polymer_type_details             .
   _Entity.Polymer_strand_ID                A
   _Entity.Polymer_seq_one_letter_code_can  .
   _Entity.Polymer_seq_one_letter_code    
;
YCQKWMWTCDSERKCCKGMV
CRLWCKKKLW
;
   _Entity.Target_identifier                .
   _Entity.Polymer_author_defined_seq       .
   _Entity.Polymer_author_seq_details       .
   _Entity.Ambiguous_conformational_states  .
   _Entity.Ambiguous_chem_comp_sites        .
   _Entity.Nstd_monomer                     no
   _Entity.Nstd_chirality                   .
   _Entity.Nstd_linkage                     no
   _Entity.Nonpolymer_comp_ID               .
   _Entity.Nonpolymer_comp_label            .
   _Entity.Number_of_monomers               30
   _Entity.Number_of_nonpolymer_components  .
   _Entity.Paramagnetic                     no
   _Entity.Thiol_state                      'all disulfide bound'
   _Entity.Src_method                       syn
   _Entity.Parent_entity_ID                 1
   _Entity.Fragment                         .
   _Entity.Mutation                         E17K
   _Entity.EC_number                        .
   _Entity.Calc_isoelectric_point           .
   _Entity.Formula_weight                   3839.754
   _Entity.Formula_weight_exptl             .
   _Entity.Formula_weight_exptl_meth        .
   _Entity.Details                          .
   _Entity.DB_query_date                    .
   _Entity.DB_query_revised_last_date       .

   loop_
      _Entity_common_name.Name
      _Entity_common_name.Type
      _Entity_common_name.Entry_ID
      _Entity_common_name.Entity_ID

     Beta/omega-TRTX-Tp2a   na   c30521_6mk4   1    
     PT-II                  na   c30521_6mk4   1    
     ProTx-II               na   c30521_6mk4   1    
     ProTx2                 na   c30521_6mk4   1    
     Protoxin-2             na   c30521_6mk4   1    

   stop_

   loop_
      _Entity_comp_index.ID
      _Entity_comp_index.Auth_seq_ID
      _Entity_comp_index.Comp_ID
      _Entity_comp_index.Comp_label
      _Entity_comp_index.Entry_ID
      _Entity_comp_index.Entity_ID

     1    .   TYR   .   c30521_6mk4   1    
     2    .   CYS   .   c30521_6mk4   1    
     3    .   GLN   .   c30521_6mk4   1    
     4    .   LYS   .   c30521_6mk4   1    
     5    .   TRP   .   c30521_6mk4   1    
     6    .   MET   .   c30521_6mk4   1    
     7    .   TRP   .   c30521_6mk4   1    
     8    .   THR   .   c30521_6mk4   1    
     9    .   CYS   .   c30521_6mk4   1    
     10   .   ASP   .   c30521_6mk4   1    
     11   .   SER   .   c30521_6mk4   1    
     12   .   GLU   .   c30521_6mk4   1    
     13   .   ARG   .   c30521_6mk4   1    
     14   .   LYS   .   c30521_6mk4   1    
     15   .   CYS   .   c30521_6mk4   1    
     16   .   CYS   .   c30521_6mk4   1    
     17   .   LYS   .   c30521_6mk4   1    
     18   .   GLY   .   c30521_6mk4   1    
     19   .   MET   .   c30521_6mk4   1    
     20   .   VAL   .   c30521_6mk4   1    
     21   .   CYS   .   c30521_6mk4   1    
     22   .   ARG   .   c30521_6mk4   1    
     23   .   LEU   .   c30521_6mk4   1    
     24   .   TRP   .   c30521_6mk4   1    
     25   .   CYS   .   c30521_6mk4   1    
     26   .   LYS   .   c30521_6mk4   1    
     27   .   LYS   .   c30521_6mk4   1    
     28   .   LYS   .   c30521_6mk4   1    
     29   .   LEU   .   c30521_6mk4   1    
     30   .   TRP   .   c30521_6mk4   1    

   stop_

   loop_
      _Entity_poly_seq.Hetero
      _Entity_poly_seq.Mon_ID
      _Entity_poly_seq.Num
      _Entity_poly_seq.Comp_index_ID
      _Entity_poly_seq.Entry_ID
      _Entity_poly_seq.Entity_ID

     .   TYR   1    1    c30521_6mk4   1    
     .   CYS   2    2    c30521_6mk4   1    
     .   GLN   3    3    c30521_6mk4   1    
     .   LYS   4    4    c30521_6mk4   1    
     .   TRP   5    5    c30521_6mk4   1    
     .   MET   6    6    c30521_6mk4   1    
     .   TRP   7    7    c30521_6mk4   1    
     .   THR   8    8    c30521_6mk4   1    
     .   CYS   9    9    c30521_6mk4   1    
     .   ASP   10   10   c30521_6mk4   1    
     .   SER   11   11   c30521_6mk4   1    
     .   GLU   12   12   c30521_6mk4   1    
     .   ARG   13   13   c30521_6mk4   1    
     .   LYS   14   14   c30521_6mk4   1    
     .   CYS   15   15   c30521_6mk4   1    
     .   CYS   16   16   c30521_6mk4   1    
     .   LYS   17   17   c30521_6mk4   1    
     .   GLY   18   18   c30521_6mk4   1    
     .   MET   19   19   c30521_6mk4   1    
     .   VAL   20   20   c30521_6mk4   1    
     .   CYS   21   21   c30521_6mk4   1    
     .   ARG   22   22   c30521_6mk4   1    
     .   LEU   23   23   c30521_6mk4   1    
     .   TRP   24   24   c30521_6mk4   1    
     .   CYS   25   25   c30521_6mk4   1    
     .   LYS   26   26   c30521_6mk4   1    
     .   LYS   27   27   c30521_6mk4   1    
     .   LYS   28   28   c30521_6mk4   1    
     .   LEU   29   29   c30521_6mk4   1    
     .   TRP   30   30   c30521_6mk4   1    

   stop_

save_

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

save_natural_source
   _Entity_natural_src_list.Sf_category   natural_source
   _Entity_natural_src_list.Sf_framecode  natural_source
   _Entity_natural_src_list.Entry_ID      c30521_6mk4
   _Entity_natural_src_list.ID            1

   loop_
      _Entity_natural_src.ID
      _Entity_natural_src.Entity_ID
      _Entity_natural_src.Entity_label
      _Entity_natural_src.Entity_chimera_segment_ID
      _Entity_natural_src.NCBI_taxonomy_ID
      _Entity_natural_src.Type
      _Entity_natural_src.Common
      _Entity_natural_src.Organism_name_scientific
      _Entity_natural_src.Organism_name_common
      _Entity_natural_src.Organism_acronym
      _Entity_natural_src.ICTVdb_decimal_code
      _Entity_natural_src.Superkingdom
      _Entity_natural_src.Kingdom
      _Entity_natural_src.Genus
      _Entity_natural_src.Species
      _Entity_natural_src.Strain
      _Entity_natural_src.Variant
      _Entity_natural_src.Organ
      _Entity_natural_src.Tissue
      _Entity_natural_src.Tissue_fraction
      _Entity_natural_src.Cell_line
      _Entity_natural_src.Cell_type
      _Entity_natural_src.ATCC_number
      _Entity_natural_src.Organelle
      _Entity_natural_src.Secretion
      _Entity_natural_src.Plasmid
      _Entity_natural_src.Gene_mnemonic
      _Entity_natural_src.Details
      _Entity_natural_src.Entry_ID
      _Entity_natural_src.Entity_natural_src_list_ID

     1   1   $entity_1   .   213387   organism   .   'Thrixopelma pruriens'   'Peruvian green velvet tarantula'   .   .   Eukaryota   Metazoa   Thrixopelma   pruriens   .   .   .   .   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    

   stop_

save_

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

save_experimental_source
   _Entity_experimental_src_list.Sf_category   experimental_source
   _Entity_experimental_src_list.Sf_framecode  experimental_source
   _Entity_experimental_src_list.Entry_ID      c30521_6mk4
   _Entity_experimental_src_list.ID            1

   loop_
      _Entity_experimental_src.ID
      _Entity_experimental_src.Entity_ID
      _Entity_experimental_src.Entity_label
      _Entity_experimental_src.Entity_chimera_segment_ID
      _Entity_experimental_src.Production_method
      _Entity_experimental_src.Host_org_scientific_name
      _Entity_experimental_src.Host_org_name_common
      _Entity_experimental_src.Host_org_details
      _Entity_experimental_src.Host_org_NCBI_taxonomy_ID
      _Entity_experimental_src.Host_org_genus
      _Entity_experimental_src.Host_org_species
      _Entity_experimental_src.Host_org_strain
      _Entity_experimental_src.Host_org_variant
      _Entity_experimental_src.Host_org_ATCC_number
      _Entity_experimental_src.Vector_type
      _Entity_experimental_src.PDBview_host_org_vector_name
      _Entity_experimental_src.PDBview_plasmid_name
      _Entity_experimental_src.Vector_name
      _Entity_experimental_src.Vector_details
      _Entity_experimental_src.Vendor_name
      _Entity_experimental_src.Details
      _Entity_experimental_src.Entry_ID
      _Entity_experimental_src.Entity_experimental_src_list_ID

     1   1   $entity_1   .   'chemical synthesis'   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    

   stop_

save_

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

save_sample_1
   _Sample.Sf_category                     sample
   _Sample.Sf_framecode                    sample_1
   _Sample.Entry_ID                        c30521_6mk4
   _Sample.ID                              1
   _Sample.Type                            solution
   _Sample.Sub_type                        .
   _Sample.Details                         '2 mg/mL [E17K]ProTx-II, 90% H2O/10% D2O'
   _Sample.Aggregate_sample_number         .
   _Sample.Solvent_system                  '90% H2O/10% D2O'
   _Sample.Preparation_date                .
   _Sample.Preparation_expiration_date     .
   _Sample.Polycrystallization_protocol    .
   _Sample.Single_crystal_protocol         .
   _Sample.Crystal_grow_apparatus          .
   _Sample.Crystal_grow_atmosphere         .
   _Sample.Crystal_grow_details            .
   _Sample.Crystal_grow_method             .
   _Sample.Crystal_grow_method_cit_ID      .
   _Sample.Crystal_grow_pH                 .
   _Sample.Crystal_grow_pH_range           .
   _Sample.Crystal_grow_pressure           .
   _Sample.Crystal_grow_pressure_esd       .
   _Sample.Crystal_grow_seeding            .
   _Sample.Crystal_grow_seeding_cit_ID     .
   _Sample.Crystal_grow_temp               .
   _Sample.Crystal_grow_temp_details       .
   _Sample.Crystal_grow_temp_esd           .
   _Sample.Crystal_grow_time               .
   _Sample.Oriented_sample_prep_protocol   .
   _Sample.Lyophilization_cryo_protectant  .
   _Sample.Storage_protocol                .

   loop_
      _Sample_component.ID
      _Sample_component.Mol_common_name
      _Sample_component.Isotopic_labeling
      _Sample_component.Assembly_ID
      _Sample_component.Assembly_label
      _Sample_component.Entity_ID
      _Sample_component.Entity_label
      _Sample_component.Product_ID
      _Sample_component.Type
      _Sample_component.Concentration_val
      _Sample_component.Concentration_val_min
      _Sample_component.Concentration_val_max
      _Sample_component.Concentration_val_units
      _Sample_component.Concentration_val_err
      _Sample_component.Vendor
      _Sample_component.Vendor_product_name
      _Sample_component.Vendor_product_code
      _Sample_component.Entry_ID
      _Sample_component.Sample_ID

     1   [E17K]ProTx-II   'natural abundance'   .   .   1   $entity_1   .   .   2   .   .   mg/mL   .   .   .   .   c30521_6mk4   1    

   stop_

save_

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

save_sample_conditions_1
   _Sample_condition_list.Sf_category   sample_conditions
   _Sample_condition_list.Sf_framecode  sample_conditions_1
   _Sample_condition_list.Entry_ID      c30521_6mk4
   _Sample_condition_list.ID            1
   _Sample_condition_list.Details       .

   loop_
      _Sample_condition_variable.Type
      _Sample_condition_variable.Val
      _Sample_condition_variable.Val_err
      _Sample_condition_variable.Val_units
      _Sample_condition_variable.Entry_ID
      _Sample_condition_variable.Sample_condition_list_ID

     'ionic strength'   0     .     mM   c30521_6mk4   1    
     pH                 3.5   0.5   pH   c30521_6mk4   1    
     pressure           1     .     Pa   c30521_6mk4   1    
     temperature        298   .     K    c30521_6mk4   1    

   stop_

save_

save_sample_conditions_2
   _Sample_condition_list.Sf_category   sample_conditions
   _Sample_condition_list.Sf_framecode  sample_conditions_2
   _Sample_condition_list.Entry_ID      c30521_6mk4
   _Sample_condition_list.ID            2
   _Sample_condition_list.Details       .

   loop_
      _Sample_condition_variable.Type
      _Sample_condition_variable.Val
      _Sample_condition_variable.Val_err
      _Sample_condition_variable.Val_units
      _Sample_condition_variable.Entry_ID
      _Sample_condition_variable.Sample_condition_list_ID

     'ionic strength'   0     .     mM   c30521_6mk4   2    
     pH                 3.5   0.5   pH   c30521_6mk4   2    
     pressure           1     .     Pa   c30521_6mk4   2    
     temperature        298   .     K    c30521_6mk4   2    

   stop_

save_

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

save_software_1
   _Software.Sf_category   software
   _Software.Sf_framecode  software_1
   _Software.Entry_ID      c30521_6mk4
   _Software.ID            1
   _Software.Type          .
   _Software.Name          CNS
   _Software.Version       .
   _Software.DOI           .
   _Software.Details       .

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

     'Brunger, Adams, Clore, Gros, Nilges and Read'   .   .   c30521_6mk4   1    

   stop_

   loop_
      _Task.Task
      _Task.Entry_ID
      _Task.Software_ID

     refinement   c30521_6mk4   1    

   stop_

save_

save_software_2
   _Software.Sf_category   software
   _Software.Sf_framecode  software_2
   _Software.Entry_ID      c30521_6mk4
   _Software.ID            2
   _Software.Type          .
   _Software.Name          CYANA
   _Software.Version       .
   _Software.DOI           .
   _Software.Details       .

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

     'Guntert, Mumenthaler and Wuthrich'   .   .   c30521_6mk4   2    

   stop_

   loop_
      _Task.Task
      _Task.Entry_ID
      _Task.Software_ID

     'chemical shift assignment'   c30521_6mk4   2    
     'peak picking'                c30521_6mk4   2    
     'structure calculation'       c30521_6mk4   2    

   stop_

save_

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

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

save_NMR_spectrometer_1
   _NMR_spectrometer.Sf_category     NMR_spectrometer
   _NMR_spectrometer.Sf_framecode    NMR_spectrometer_1
   _NMR_spectrometer.Entry_ID        c30521_6mk4
   _NMR_spectrometer.ID              1
   _NMR_spectrometer.Details         'equipped with a cryoprobe'
   _NMR_spectrometer.Manufacturer    Bruker
   _NMR_spectrometer.Model           AvanceIII
   _NMR_spectrometer.Serial_number   .
   _NMR_spectrometer.Field_strength  600

save_

save_NMR_spectrometer_list
   _NMR_spectrometer_list.Sf_category   NMR_spectrometer_list
   _NMR_spectrometer_list.Sf_framecode  NMR_spectrometer_list
   _NMR_spectrometer_list.Entry_ID      c30521_6mk4
   _NMR_spectrometer_list.ID            1

   loop_
      _NMR_spectrometer_view.ID
      _NMR_spectrometer_view.Name
      _NMR_spectrometer_view.Manufacturer
      _NMR_spectrometer_view.Model
      _NMR_spectrometer_view.Serial_number
      _NMR_spectrometer_view.Field_strength
      _NMR_spectrometer_view.Details
      _NMR_spectrometer_view.Citation_ID
      _NMR_spectrometer_view.Citation_label
      _NMR_spectrometer_view.Entry_ID
      _NMR_spectrometer_view.NMR_spectrometer_list_ID

     1   NMR_spectrometer_1   Bruker   AvanceIII   .   600   .   .   .   c30521_6mk4   1    

   stop_

save_

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

save_experiment_list
   _Experiment_list.Sf_category   experiment_list
   _Experiment_list.Sf_framecode  experiment_list
   _Experiment_list.Entry_ID      c30521_6mk4
   _Experiment_list.ID            1
   _Experiment_list.Details       .

   loop_
      _Experiment.ID
      _Experiment.Name
      _Experiment.Raw_data_flag
      _Experiment.NMR_spec_expt_ID
      _Experiment.NMR_spec_expt_label
      _Experiment.MS_expt_ID
      _Experiment.MS_expt_label
      _Experiment.SAXS_expt_ID
      _Experiment.SAXS_expt_label
      _Experiment.FRET_expt_ID
      _Experiment.FRET_expt_label
      _Experiment.EMR_expt_ID
      _Experiment.EMR_expt_label
      _Experiment.Sample_ID
      _Experiment.Sample_label
      _Experiment.Sample_state
      _Experiment.Sample_volume
      _Experiment.Sample_volume_units
      _Experiment.Sample_condition_list_ID
      _Experiment.Sample_condition_list_label
      _Experiment.Sample_spinning_rate
      _Experiment.Sample_angle
      _Experiment.NMR_tube_type
      _Experiment.NMR_spectrometer_ID
      _Experiment.NMR_spectrometer_label
      _Experiment.NMR_spectrometer_probe_ID
      _Experiment.NMR_spectrometer_probe_label
      _Experiment.NMR_spectral_processing_ID
      _Experiment.NMR_spectral_processing_label
      _Experiment.Mass_spectrometer_ID
      _Experiment.Mass_spectrometer_label
      _Experiment.Xray_instrument_ID
      _Experiment.Xray_instrument_label
      _Experiment.Fluorescence_instrument_ID
      _Experiment.Fluorescence_instrument_label
      _Experiment.EMR_instrument_ID
      _Experiment.EMR_instrument_label
      _Experiment.Chromatographic_system_ID
      _Experiment.Chromatographic_system_label
      _Experiment.Chromatographic_column_ID
      _Experiment.Chromatographic_column_label
      _Experiment.Entry_ID
      _Experiment.Experiment_list_ID

     1   '1D 1H'            no   .   .   .   .   .   .   .   .   .   .   1   $sample_1   anisotropic   .   .   1   $sample_conditions_1   .   .   .   1   $NMR_spectrometer_1   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     2   '2D TOCSY'         no   .   .   .   .   .   .   .   .   .   .   1   $sample_1   anisotropic   .   .   1   $sample_conditions_1   .   .   .   1   $NMR_spectrometer_1   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     3   '2D NOESY'         no   .   .   .   .   .   .   .   .   .   .   1   $sample_1   anisotropic   .   .   1   $sample_conditions_1   .   .   .   1   $NMR_spectrometer_1   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     4   '2D 1H-15N HSQC'   no   .   .   .   .   .   .   .   .   .   .   1   $sample_1   anisotropic   .   .   1   $sample_conditions_1   .   .   .   1   $NMR_spectrometer_1   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     5   '2D 1H-13C HSQC'   no   .   .   .   .   .   .   .   .   .   .   1   $sample_1   anisotropic   .   .   2   $sample_conditions_2   .   .   .   1   $NMR_spectrometer_1   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     6   'E. COSY'          no   .   .   .   .   .   .   .   .   .   .   1   $sample_1   anisotropic   .   .   2   $sample_conditions_2   .   .   .   1   $NMR_spectrometer_1   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    

   stop_

save_

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

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

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

save_chem_shift_reference_1
   _Chem_shift_reference.Sf_category   chem_shift_reference
   _Chem_shift_reference.Sf_framecode  chem_shift_reference_1
   _Chem_shift_reference.Entry_ID      c30521_6mk4
   _Chem_shift_reference.ID            1
   _Chem_shift_reference.Details       .

   loop_
      _Chem_shift_ref.Atom_type
      _Chem_shift_ref.Atom_isotope_number
      _Chem_shift_ref.Mol_common_name
      _Chem_shift_ref.Atom_group
      _Chem_shift_ref.Concentration_val
      _Chem_shift_ref.Concentration_units
      _Chem_shift_ref.Solvent
      _Chem_shift_ref.Rank
      _Chem_shift_ref.Chem_shift_units
      _Chem_shift_ref.Chem_shift_val
      _Chem_shift_ref.Ref_method
      _Chem_shift_ref.Ref_type
      _Chem_shift_ref.Indirect_shift_ratio
      _Chem_shift_ref.External_ref_loc
      _Chem_shift_ref.External_ref_sample_geometry
      _Chem_shift_ref.External_ref_axis
      _Chem_shift_ref.Ref_correction_type
      _Chem_shift_ref.Correction_val
      _Chem_shift_ref.Entry_ID
      _Chem_shift_ref.Chem_shift_reference_ID

     H   1   DSS   'methyl protons'   .   .   .   .   ppm   0   internal   direct   1.0   .   .   .   .   .   c30521_6mk4   1    

   stop_

save_

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

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

save_assigned_chemical_shifts_1
   _Assigned_chem_shift_list.Sf_category                  assigned_chemical_shifts
   _Assigned_chem_shift_list.Sf_framecode                 assigned_chemical_shifts_1
   _Assigned_chem_shift_list.Entry_ID                     c30521_6mk4
   _Assigned_chem_shift_list.ID                           1
   _Assigned_chem_shift_list.Sample_condition_list_ID     1
   _Assigned_chem_shift_list.Sample_condition_list_label  $sample_conditions_1
   _Assigned_chem_shift_list.Chem_shift_reference_ID      1
   _Assigned_chem_shift_list.Chem_shift_reference_label   $chem_shift_reference_1
   _Assigned_chem_shift_list.Chem_shift_1H_err            .
   _Assigned_chem_shift_list.Chem_shift_13C_err           .
   _Assigned_chem_shift_list.Chem_shift_15N_err           .
   _Assigned_chem_shift_list.Chem_shift_31P_err           .
   _Assigned_chem_shift_list.Chem_shift_2H_err            .
   _Assigned_chem_shift_list.Chem_shift_19F_err           .
   _Assigned_chem_shift_list.Error_derivation_method      .
   _Assigned_chem_shift_list.Details                      .
   _Assigned_chem_shift_list.Text_data_format             .
   _Assigned_chem_shift_list.Text_data                    .

   loop_
      _Chem_shift_experiment.Experiment_ID
      _Chem_shift_experiment.Experiment_name
      _Chem_shift_experiment.Sample_ID
      _Chem_shift_experiment.Sample_label
      _Chem_shift_experiment.Sample_state
      _Chem_shift_experiment.Entry_ID
      _Chem_shift_experiment.Assigned_chem_shift_list_ID

     1   '1D 1H'            .   .   .   c30521_6mk4   1    
     2   '2D TOCSY'         .   .   .   c30521_6mk4   1    
     3   '2D NOESY'         .   .   .   c30521_6mk4   1    
     4   '2D 1H-15N HSQC'   .   .   .   c30521_6mk4   1    
     5   '2D 1H-13C HSQC'   .   .   .   c30521_6mk4   1    
     6   'E. COSY'          .   .   .   c30521_6mk4   1    

   stop_

   loop_
      _Atom_chem_shift.ID
      _Atom_chem_shift.Assembly_atom_ID
      _Atom_chem_shift.Entity_assembly_ID
      _Atom_chem_shift.Entity_ID
      _Atom_chem_shift.Comp_index_ID
      _Atom_chem_shift.Seq_ID
      _Atom_chem_shift.Comp_ID
      _Atom_chem_shift.Atom_ID
      _Atom_chem_shift.Atom_type
      _Atom_chem_shift.Atom_isotope_number
      _Atom_chem_shift.Val
      _Atom_chem_shift.Val_err
      _Atom_chem_shift.Assign_fig_of_merit
      _Atom_chem_shift.Ambiguity_code
      _Atom_chem_shift.Ambiguity_set_ID
      _Atom_chem_shift.Occupancy
      _Atom_chem_shift.Resonance_ID
      _Atom_chem_shift.Auth_entity_assembly_ID
      _Atom_chem_shift.Auth_asym_ID
      _Atom_chem_shift.Auth_seq_ID
      _Atom_chem_shift.Auth_comp_ID
      _Atom_chem_shift.Auth_atom_ID
      _Atom_chem_shift.Details
      _Atom_chem_shift.Entry_ID
      _Atom_chem_shift.Assigned_chem_shift_list_ID

     1     .   1   1   1    1    TYR   HA     H   1    4.398     0.002   .   .   .   .   .   .   A   1    TYR   HA     .   c30521_6mk4   1    
     2     .   1   1   1    1    TYR   HB2    H   1    3.250     0.003   .   .   .   .   .   .   A   1    TYR   HB2    .   c30521_6mk4   1    
     3     .   1   1   1    1    TYR   HB3    H   1    3.292     0.001   .   .   .   .   .   .   A   1    TYR   HB3    .   c30521_6mk4   1    
     4     .   1   1   1    1    TYR   HD1    H   1    7.253     0.003   .   .   .   .   .   .   A   1    TYR   HD1    .   c30521_6mk4   1    
     5     .   1   1   1    1    TYR   HD2    H   1    7.253     0.003   .   .   .   .   .   .   A   1    TYR   HD2    .   c30521_6mk4   1    
     6     .   1   1   1    1    TYR   HE1    H   1    7.017     0.003   .   .   .   .   .   .   A   1    TYR   HE1    .   c30521_6mk4   1    
     7     .   1   1   1    1    TYR   HE2    H   1    7.017     0.003   .   .   .   .   .   .   A   1    TYR   HE2    .   c30521_6mk4   1    
     8     .   1   1   1    1    TYR   CA     C   13   56.975    0.000   .   .   .   .   .   .   A   1    TYR   CA     .   c30521_6mk4   1    
     9     .   1   1   1    1    TYR   CB     C   13   38.611    0.000   .   .   .   .   .   .   A   1    TYR   CB     .   c30521_6mk4   1    
     10    .   1   1   2    2    CYS   H      H   1    8.176     0.005   .   .   .   .   .   .   A   2    CYS   H      .   c30521_6mk4   1    
     11    .   1   1   2    2    CYS   HA     H   1    5.104     0.002   .   .   .   .   .   .   A   2    CYS   HA     .   c30521_6mk4   1    
     12    .   1   1   2    2    CYS   HB2    H   1    2.962     0.001   .   .   .   .   .   .   A   2    CYS   HB2    .   c30521_6mk4   1    
     13    .   1   1   2    2    CYS   HB3    H   1    3.206     0.001   .   .   .   .   .   .   A   2    CYS   HB3    .   c30521_6mk4   1    
     14    .   1   1   2    2    CYS   CA     C   13   53.896    0.000   .   .   .   .   .   .   A   2    CYS   CA     .   c30521_6mk4   1    
     15    .   1   1   2    2    CYS   CB     C   13   43.300    0.000   .   .   .   .   .   .   A   2    CYS   CB     .   c30521_6mk4   1    
     16    .   1   1   2    2    CYS   N      N   15   117.718   0.000   .   .   .   .   .   .   A   2    CYS   N      .   c30521_6mk4   1    
     17    .   1   1   3    3    GLN   H      H   1    9.208     0.002   .   .   .   .   .   .   A   3    GLN   H      .   c30521_6mk4   1    
     18    .   1   1   3    3    GLN   HA     H   1    4.521     0.004   .   .   .   .   .   .   A   3    GLN   HA     .   c30521_6mk4   1    
     19    .   1   1   3    3    GLN   HB2    H   1    2.197     0.003   .   .   .   .   .   .   A   3    GLN   HB2    .   c30521_6mk4   1    
     20    .   1   1   3    3    GLN   HB3    H   1    2.361     0.003   .   .   .   .   .   .   A   3    GLN   HB3    .   c30521_6mk4   1    
     21    .   1   1   3    3    GLN   HG2    H   1    2.778     0.004   .   .   .   .   .   .   A   3    GLN   HG2    .   c30521_6mk4   1    
     22    .   1   1   3    3    GLN   HG3    H   1    2.089     0.001   .   .   .   .   .   .   A   3    GLN   HG3    .   c30521_6mk4   1    
     23    .   1   1   3    3    GLN   HE21   H   1    8.818     0.002   .   .   .   .   .   .   A   3    GLN   HE21   .   c30521_6mk4   1    
     24    .   1   1   3    3    GLN   HE22   H   1    7.286     0.003   .   .   .   .   .   .   A   3    GLN   HE22   .   c30521_6mk4   1    
     25    .   1   1   3    3    GLN   CA     C   13   55.525    0.000   .   .   .   .   .   .   A   3    GLN   CA     .   c30521_6mk4   1    
     26    .   1   1   3    3    GLN   CB     C   13   31.871    0.000   .   .   .   .   .   .   A   3    GLN   CB     .   c30521_6mk4   1    
     27    .   1   1   3    3    GLN   CG     C   13   34.348    0.000   .   .   .   .   .   .   A   3    GLN   CG     .   c30521_6mk4   1    
     28    .   1   1   3    3    GLN   N      N   15   117.649   0.000   .   .   .   .   .   .   A   3    GLN   N      .   c30521_6mk4   1    
     29    .   1   1   4    4    LYS   H      H   1    5.270     0.002   .   .   .   .   .   .   A   4    LYS   H      .   c30521_6mk4   1    
     30    .   1   1   4    4    LYS   HA     H   1    3.716     0.005   .   .   .   .   .   .   A   4    LYS   HA     .   c30521_6mk4   1    
     31    .   1   1   4    4    LYS   HB2    H   1    1.443     0.003   .   .   .   .   .   .   A   4    LYS   HB2    .   c30521_6mk4   1    
     32    .   1   1   4    4    LYS   HB3    H   1    -0.442    0.002   .   .   .   .   .   .   A   4    LYS   HB3    .   c30521_6mk4   1    
     33    .   1   1   4    4    LYS   HG2    H   1    0.412     0.003   .   .   .   .   .   .   A   4    LYS   HG2    .   c30521_6mk4   1    
     34    .   1   1   4    4    LYS   HG3    H   1    0.693     0.003   .   .   .   .   .   .   A   4    LYS   HG3    .   c30521_6mk4   1    
     35    .   1   1   4    4    LYS   HE2    H   1    2.834     0.000   .   .   .   .   .   .   A   4    LYS   HE2    .   c30521_6mk4   1    
     36    .   1   1   4    4    LYS   HE3    H   1    2.834     0.000   .   .   .   .   .   .   A   4    LYS   HE3    .   c30521_6mk4   1    
     37    .   1   1   4    4    LYS   CA     C   13   55.411    0.000   .   .   .   .   .   .   A   4    LYS   CA     .   c30521_6mk4   1    
     38    .   1   1   4    4    LYS   CB     C   13   32.914    0.000   .   .   .   .   .   .   A   4    LYS   CB     .   c30521_6mk4   1    
     39    .   1   1   4    4    LYS   CG     C   13   25.611    0.000   .   .   .   .   .   .   A   4    LYS   CG     .   c30521_6mk4   1    
     40    .   1   1   4    4    LYS   CE     C   13   41.836    0.000   .   .   .   .   .   .   A   4    LYS   CE     .   c30521_6mk4   1    
     41    .   1   1   5    5    TRP   H      H   1    7.942     0.003   .   .   .   .   .   .   A   5    TRP   H      .   c30521_6mk4   1    
     42    .   1   1   5    5    TRP   HA     H   1    4.344     0.003   .   .   .   .   .   .   A   5    TRP   HA     .   c30521_6mk4   1    
     43    .   1   1   5    5    TRP   HB2    H   1    3.129     0.007   .   .   .   .   .   .   A   5    TRP   HB2    .   c30521_6mk4   1    
     44    .   1   1   5    5    TRP   HB3    H   1    3.129     0.007   .   .   .   .   .   .   A   5    TRP   HB3    .   c30521_6mk4   1    
     45    .   1   1   5    5    TRP   HD1    H   1    7.483     0.003   .   .   .   .   .   .   A   5    TRP   HD1    .   c30521_6mk4   1    
     46    .   1   1   5    5    TRP   HE1    H   1    10.776    0.001   .   .   .   .   .   .   A   5    TRP   HE1    .   c30521_6mk4   1    
     47    .   1   1   5    5    TRP   HE3    H   1    7.590     0.000   .   .   .   .   .   .   A   5    TRP   HE3    .   c30521_6mk4   1    
     48    .   1   1   5    5    TRP   HZ2    H   1    7.556     0.004   .   .   .   .   .   .   A   5    TRP   HZ2    .   c30521_6mk4   1    
     49    .   1   1   5    5    TRP   HZ3    H   1    7.179     0.003   .   .   .   .   .   .   A   5    TRP   HZ3    .   c30521_6mk4   1    
     50    .   1   1   5    5    TRP   HH2    H   1    7.286     0.001   .   .   .   .   .   .   A   5    TRP   HH2    .   c30521_6mk4   1    
     51    .   1   1   5    5    TRP   CA     C   13   59.436    0.000   .   .   .   .   .   .   A   5    TRP   CA     .   c30521_6mk4   1    
     52    .   1   1   5    5    TRP   CB     C   13   28.687    0.000   .   .   .   .   .   .   A   5    TRP   CB     .   c30521_6mk4   1    
     53    .   1   1   5    5    TRP   N      N   15   118.815   0.000   .   .   .   .   .   .   A   5    TRP   N      .   c30521_6mk4   1    
     54    .   1   1   6    6    MET   H      H   1    9.159     0.001   .   .   .   .   .   .   A   6    MET   H      .   c30521_6mk4   1    
     55    .   1   1   6    6    MET   HA     H   1    3.942     0.002   .   .   .   .   .   .   A   6    MET   HA     .   c30521_6mk4   1    
     56    .   1   1   6    6    MET   HB2    H   1    0.619     0.004   .   .   .   .   .   .   A   6    MET   HB2    .   c30521_6mk4   1    
     57    .   1   1   6    6    MET   HB3    H   1    1.392     0.004   .   .   .   .   .   .   A   6    MET   HB3    .   c30521_6mk4   1    
     58    .   1   1   6    6    MET   HG2    H   1    1.771     0.004   .   .   .   .   .   .   A   6    MET   HG2    .   c30521_6mk4   1    
     59    .   1   1   6    6    MET   HG3    H   1    1.977     0.004   .   .   .   .   .   .   A   6    MET   HG3    .   c30521_6mk4   1    
     60    .   1   1   6    6    MET   CA     C   13   56.810    0.000   .   .   .   .   .   .   A   6    MET   CA     .   c30521_6mk4   1    
     61    .   1   1   6    6    MET   CB     C   13   30.708    0.000   .   .   .   .   .   .   A   6    MET   CB     .   c30521_6mk4   1    
     62    .   1   1   6    6    MET   CG     C   13   27.416    0.000   .   .   .   .   .   .   A   6    MET   CG     .   c30521_6mk4   1    
     63    .   1   1   6    6    MET   N      N   15   118.218   0.000   .   .   .   .   .   .   A   6    MET   N      .   c30521_6mk4   1    
     64    .   1   1   7    7    TRP   H      H   1    8.689     0.004   .   .   .   .   .   .   A   7    TRP   H      .   c30521_6mk4   1    
     65    .   1   1   7    7    TRP   HA     H   1    5.074     0.002   .   .   .   .   .   .   A   7    TRP   HA     .   c30521_6mk4   1    
     66    .   1   1   7    7    TRP   HB2    H   1    3.474     0.003   .   .   .   .   .   .   A   7    TRP   HB2    .   c30521_6mk4   1    
     67    .   1   1   7    7    TRP   HB3    H   1    3.635     0.005   .   .   .   .   .   .   A   7    TRP   HB3    .   c30521_6mk4   1    
     68    .   1   1   7    7    TRP   HD1    H   1    7.131     0.003   .   .   .   .   .   .   A   7    TRP   HD1    .   c30521_6mk4   1    
     69    .   1   1   7    7    TRP   HE1    H   1    10.258    0.001   .   .   .   .   .   .   A   7    TRP   HE1    .   c30521_6mk4   1    
     70    .   1   1   7    7    TRP   HE3    H   1    7.764     0.001   .   .   .   .   .   .   A   7    TRP   HE3    .   c30521_6mk4   1    
     71    .   1   1   7    7    TRP   HZ2    H   1    7.635     0.003   .   .   .   .   .   .   A   7    TRP   HZ2    .   c30521_6mk4   1    
     72    .   1   1   7    7    TRP   HZ3    H   1    7.370     0.000   .   .   .   .   .   .   A   7    TRP   HZ3    .   c30521_6mk4   1    
     73    .   1   1   7    7    TRP   HH2    H   1    7.369     0.000   .   .   .   .   .   .   A   7    TRP   HH2    .   c30521_6mk4   1    
     74    .   1   1   7    7    TRP   CA     C   13   56.042    0.000   .   .   .   .   .   .   A   7    TRP   CA     .   c30521_6mk4   1    
     75    .   1   1   7    7    TRP   CB     C   13   29.800    0.000   .   .   .   .   .   .   A   7    TRP   CB     .   c30521_6mk4   1    
     76    .   1   1   7    7    TRP   N      N   15   122.122   0.000   .   .   .   .   .   .   A   7    TRP   N      .   c30521_6mk4   1    
     77    .   1   1   8    8    THR   H      H   1    8.556     0.003   .   .   .   .   .   .   A   8    THR   H      .   c30521_6mk4   1    
     78    .   1   1   8    8    THR   HA     H   1    4.579     0.004   .   .   .   .   .   .   A   8    THR   HA     .   c30521_6mk4   1    
     79    .   1   1   8    8    THR   HB     H   1    4.318     0.002   .   .   .   .   .   .   A   8    THR   HB     .   c30521_6mk4   1    
     80    .   1   1   8    8    THR   HG21   H   1    1.316     0.001   .   .   .   .   .   .   A   8    THR   HG21   .   c30521_6mk4   1    
     81    .   1   1   8    8    THR   HG22   H   1    1.316     0.001   .   .   .   .   .   .   A   8    THR   HG22   .   c30521_6mk4   1    
     82    .   1   1   8    8    THR   HG23   H   1    1.316     0.001   .   .   .   .   .   .   A   8    THR   HG23   .   c30521_6mk4   1    
     83    .   1   1   8    8    THR   CA     C   13   62.952    0.000   .   .   .   .   .   .   A   8    THR   CA     .   c30521_6mk4   1    
     84    .   1   1   8    8    THR   CB     C   13   69.951    0.000   .   .   .   .   .   .   A   8    THR   CB     .   c30521_6mk4   1    
     85    .   1   1   8    8    THR   CG2    C   13   22.095    0.000   .   .   .   .   .   .   A   8    THR   CG2    .   c30521_6mk4   1    
     86    .   1   1   8    8    THR   N      N   15   112.824   0.000   .   .   .   .   .   .   A   8    THR   N      .   c30521_6mk4   1    
     87    .   1   1   9    9    CYS   H      H   1    7.853     0.004   .   .   .   .   .   .   A   9    CYS   H      .   c30521_6mk4   1    
     88    .   1   1   9    9    CYS   HA     H   1    5.203     0.003   .   .   .   .   .   .   A   9    CYS   HA     .   c30521_6mk4   1    
     89    .   1   1   9    9    CYS   HB2    H   1    3.342     0.005   .   .   .   .   .   .   A   9    CYS   HB2    .   c30521_6mk4   1    
     90    .   1   1   9    9    CYS   HB3    H   1    3.441     0.004   .   .   .   .   .   .   A   9    CYS   HB3    .   c30521_6mk4   1    
     91    .   1   1   9    9    CYS   CA     C   13   53.819    0.000   .   .   .   .   .   .   A   9    CYS   CA     .   c30521_6mk4   1    
     92    .   1   1   9    9    CYS   CB     C   13   48.347    0.000   .   .   .   .   .   .   A   9    CYS   CB     .   c30521_6mk4   1    
     93    .   1   1   9    9    CYS   N      N   15   116.212   0.000   .   .   .   .   .   .   A   9    CYS   N      .   c30521_6mk4   1    
     94    .   1   1   10   10   ASP   H      H   1    8.763     0.002   .   .   .   .   .   .   A   10   ASP   H      .   c30521_6mk4   1    
     95    .   1   1   10   10   ASP   HA     H   1    4.445     0.002   .   .   .   .   .   .   A   10   ASP   HA     .   c30521_6mk4   1    
     96    .   1   1   10   10   ASP   HB2    H   1    3.234     0.004   .   .   .   .   .   .   A   10   ASP   HB2    .   c30521_6mk4   1    
     97    .   1   1   10   10   ASP   HB3    H   1    3.234     0.004   .   .   .   .   .   .   A   10   ASP   HB3    .   c30521_6mk4   1    
     98    .   1   1   10   10   ASP   CA     C   13   53.979    0.000   .   .   .   .   .   .   A   10   ASP   CA     .   c30521_6mk4   1    
     99    .   1   1   10   10   ASP   CB     C   13   39.765    0.000   .   .   .   .   .   .   A   10   ASP   CB     .   c30521_6mk4   1    
     100   .   1   1   10   10   ASP   N      N   15   118.625   0.000   .   .   .   .   .   .   A   10   ASP   N      .   c30521_6mk4   1    
     101   .   1   1   11   11   SER   H      H   1    8.457     0.002   .   .   .   .   .   .   A   11   SER   H      .   c30521_6mk4   1    
     102   .   1   1   11   11   SER   HA     H   1    4.127     0.005   .   .   .   .   .   .   A   11   SER   HA     .   c30521_6mk4   1    
     103   .   1   1   11   11   SER   HB2    H   1    3.947     0.003   .   .   .   .   .   .   A   11   SER   HB2    .   c30521_6mk4   1    
     104   .   1   1   11   11   SER   HB3    H   1    3.947     0.003   .   .   .   .   .   .   A   11   SER   HB3    .   c30521_6mk4   1    
     105   .   1   1   11   11   SER   CA     C   13   61.794    0.000   .   .   .   .   .   .   A   11   SER   CA     .   c30521_6mk4   1    
     106   .   1   1   11   11   SER   CB     C   13   62.759    0.000   .   .   .   .   .   .   A   11   SER   CB     .   c30521_6mk4   1    
     107   .   1   1   11   11   SER   N      N   15   112.498   0.000   .   .   .   .   .   .   A   11   SER   N      .   c30521_6mk4   1    
     108   .   1   1   12   12   GLU   H      H   1    8.209     0.004   .   .   .   .   .   .   A   12   GLU   H      .   c30521_6mk4   1    
     109   .   1   1   12   12   GLU   HA     H   1    4.493     0.001   .   .   .   .   .   .   A   12   GLU   HA     .   c30521_6mk4   1    
     110   .   1   1   12   12   GLU   HB2    H   1    2.065     0.002   .   .   .   .   .   .   A   12   GLU   HB2    .   c30521_6mk4   1    
     111   .   1   1   12   12   GLU   HB3    H   1    2.173     0.003   .   .   .   .   .   .   A   12   GLU   HB3    .   c30521_6mk4   1    
     112   .   1   1   12   12   GLU   HG2    H   1    2.434     0.003   .   .   .   .   .   .   A   12   GLU   HG2    .   c30521_6mk4   1    
     113   .   1   1   12   12   GLU   HG3    H   1    2.434     0.003   .   .   .   .   .   .   A   12   GLU   HG3    .   c30521_6mk4   1    
     114   .   1   1   12   12   GLU   CA     C   13   56.684    0.000   .   .   .   .   .   .   A   12   GLU   CA     .   c30521_6mk4   1    
     115   .   1   1   12   12   GLU   CB     C   13   29.601    0.000   .   .   .   .   .   .   A   12   GLU   CB     .   c30521_6mk4   1    
     116   .   1   1   12   12   GLU   CG     C   13   33.516    0.000   .   .   .   .   .   .   A   12   GLU   CG     .   c30521_6mk4   1    
     117   .   1   1   12   12   GLU   N      N   15   118.069   0.000   .   .   .   .   .   .   A   12   GLU   N      .   c30521_6mk4   1    
     118   .   1   1   13   13   ARG   H      H   1    8.191     0.003   .   .   .   .   .   .   A   13   ARG   H      .   c30521_6mk4   1    
     119   .   1   1   13   13   ARG   HA     H   1    4.561     0.003   .   .   .   .   .   .   A   13   ARG   HA     .   c30521_6mk4   1    
     120   .   1   1   13   13   ARG   HB2    H   1    1.446     0.004   .   .   .   .   .   .   A   13   ARG   HB2    .   c30521_6mk4   1    
     121   .   1   1   13   13   ARG   HB3    H   1    1.819     0.004   .   .   .   .   .   .   A   13   ARG   HB3    .   c30521_6mk4   1    
     122   .   1   1   13   13   ARG   HG2    H   1    1.635     0.003   .   .   .   .   .   .   A   13   ARG   HG2    .   c30521_6mk4   1    
     123   .   1   1   13   13   ARG   HG3    H   1    1.635     0.003   .   .   .   .   .   .   A   13   ARG   HG3    .   c30521_6mk4   1    
     124   .   1   1   13   13   ARG   HD2    H   1    3.088     0.001   .   .   .   .   .   .   A   13   ARG   HD2    .   c30521_6mk4   1    
     125   .   1   1   13   13   ARG   HD3    H   1    3.227     0.003   .   .   .   .   .   .   A   13   ARG   HD3    .   c30521_6mk4   1    
     126   .   1   1   13   13   ARG   HE     H   1    7.048     0.003   .   .   .   .   .   .   A   13   ARG   HE     .   c30521_6mk4   1    
     127   .   1   1   13   13   ARG   CA     C   13   54.845    0.000   .   .   .   .   .   .   A   13   ARG   CA     .   c30521_6mk4   1    
     128   .   1   1   13   13   ARG   CB     C   13   29.531    0.000   .   .   .   .   .   .   A   13   ARG   CB     .   c30521_6mk4   1    
     129   .   1   1   13   13   ARG   CG     C   13   26.902    0.000   .   .   .   .   .   .   A   13   ARG   CG     .   c30521_6mk4   1    
     130   .   1   1   13   13   ARG   CD     C   13   43.751    0.000   .   .   .   .   .   .   A   13   ARG   CD     .   c30521_6mk4   1    
     131   .   1   1   13   13   ARG   N      N   15   124.627   0.000   .   .   .   .   .   .   A   13   ARG   N      .   c30521_6mk4   1    
     132   .   1   1   14   14   LYS   H      H   1    8.001     0.004   .   .   .   .   .   .   A   14   LYS   H      .   c30521_6mk4   1    
     133   .   1   1   14   14   LYS   HA     H   1    4.419     0.003   .   .   .   .   .   .   A   14   LYS   HA     .   c30521_6mk4   1    
     134   .   1   1   14   14   LYS   HB2    H   1    1.764     0.001   .   .   .   .   .   .   A   14   LYS   HB2    .   c30521_6mk4   1    
     135   .   1   1   14   14   LYS   HB3    H   1    1.937     0.003   .   .   .   .   .   .   A   14   LYS   HB3    .   c30521_6mk4   1    
     136   .   1   1   14   14   LYS   HG2    H   1    1.474     0.002   .   .   .   .   .   .   A   14   LYS   HG2    .   c30521_6mk4   1    
     137   .   1   1   14   14   LYS   HG3    H   1    1.474     0.002   .   .   .   .   .   .   A   14   LYS   HG3    .   c30521_6mk4   1    
     138   .   1   1   14   14   LYS   HE2    H   1    3.092     0.000   .   .   .   .   .   .   A   14   LYS   HE2    .   c30521_6mk4   1    
     139   .   1   1   14   14   LYS   HE3    H   1    3.092     0.000   .   .   .   .   .   .   A   14   LYS   HE3    .   c30521_6mk4   1    
     140   .   1   1   14   14   LYS   CA     C   13   55.989    0.000   .   .   .   .   .   .   A   14   LYS   CA     .   c30521_6mk4   1    
     141   .   1   1   14   14   LYS   CB     C   13   33.848    0.000   .   .   .   .   .   .   A   14   LYS   CB     .   c30521_6mk4   1    
     142   .   1   1   14   14   LYS   CG     C   13   25.213    0.000   .   .   .   .   .   .   A   14   LYS   CG     .   c30521_6mk4   1    
     143   .   1   1   14   14   LYS   CE     C   13   42.082    0.000   .   .   .   .   .   .   A   14   LYS   CE     .   c30521_6mk4   1    
     144   .   1   1   14   14   LYS   N      N   15   121.262   0.000   .   .   .   .   .   .   A   14   LYS   N      .   c30521_6mk4   1    
     145   .   1   1   15   15   CYS   H      H   1    9.199     0.003   .   .   .   .   .   .   A   15   CYS   H      .   c30521_6mk4   1    
     146   .   1   1   15   15   CYS   HA     H   1    4.936     0.004   .   .   .   .   .   .   A   15   CYS   HA     .   c30521_6mk4   1    
     147   .   1   1   15   15   CYS   HB2    H   1    2.535     0.003   .   .   .   .   .   .   A   15   CYS   HB2    .   c30521_6mk4   1    
     148   .   1   1   15   15   CYS   HB3    H   1    3.011     0.004   .   .   .   .   .   .   A   15   CYS   HB3    .   c30521_6mk4   1    
     149   .   1   1   15   15   CYS   CA     C   13   55.903    0.000   .   .   .   .   .   .   A   15   CYS   CA     .   c30521_6mk4   1    
     150   .   1   1   15   15   CYS   CB     C   13   40.719    0.000   .   .   .   .   .   .   A   15   CYS   CB     .   c30521_6mk4   1    
     151   .   1   1   15   15   CYS   N      N   15   119.628   0.000   .   .   .   .   .   .   A   15   CYS   N      .   c30521_6mk4   1    
     152   .   1   1   16   16   CYS   H      H   1    9.119     0.003   .   .   .   .   .   .   A   16   CYS   H      .   c30521_6mk4   1    
     153   .   1   1   16   16   CYS   HA     H   1    4.539     0.002   .   .   .   .   .   .   A   16   CYS   HA     .   c30521_6mk4   1    
     154   .   1   1   16   16   CYS   HB2    H   1    2.387     0.002   .   .   .   .   .   .   A   16   CYS   HB2    .   c30521_6mk4   1    
     155   .   1   1   16   16   CYS   HB3    H   1    3.362     0.004   .   .   .   .   .   .   A   16   CYS   HB3    .   c30521_6mk4   1    
     156   .   1   1   16   16   CYS   CA     C   13   54.218    0.000   .   .   .   .   .   .   A   16   CYS   CA     .   c30521_6mk4   1    
     157   .   1   1   16   16   CYS   CB     C   13   40.030    0.000   .   .   .   .   .   .   A   16   CYS   CB     .   c30521_6mk4   1    
     158   .   1   1   16   16   CYS   N      N   15   121.227   0.000   .   .   .   .   .   .   A   16   CYS   N      .   c30521_6mk4   1    
     159   .   1   1   17   17   LYS   H      H   1    8.143     0.004   .   .   .   .   .   .   A   17   LYS   H      .   c30521_6mk4   1    
     160   .   1   1   17   17   LYS   HA     H   1    4.063     0.001   .   .   .   .   .   .   A   17   LYS   HA     .   c30521_6mk4   1    
     161   .   1   1   17   17   LYS   HB2    H   1    1.735     0.003   .   .   .   .   .   .   A   17   LYS   HB2    .   c30521_6mk4   1    
     162   .   1   1   17   17   LYS   HB3    H   1    1.835     0.004   .   .   .   .   .   .   A   17   LYS   HB3    .   c30521_6mk4   1    
     163   .   1   1   17   17   LYS   HG2    H   1    1.409     0.004   .   .   .   .   .   .   A   17   LYS   HG2    .   c30521_6mk4   1    
     164   .   1   1   17   17   LYS   HG3    H   1    1.481     0.005   .   .   .   .   .   .   A   17   LYS   HG3    .   c30521_6mk4   1    
     165   .   1   1   17   17   LYS   HE2    H   1    2.988     0.003   .   .   .   .   .   .   A   17   LYS   HE2    .   c30521_6mk4   1    
     166   .   1   1   17   17   LYS   HE3    H   1    2.988     0.003   .   .   .   .   .   .   A   17   LYS   HE3    .   c30521_6mk4   1    
     167   .   1   1   17   17   LYS   HZ1    H   1    7.541     0.001   .   .   .   .   .   .   A   17   LYS   HZ1    .   c30521_6mk4   1    
     168   .   1   1   17   17   LYS   HZ2    H   1    7.541     0.001   .   .   .   .   .   .   A   17   LYS   HZ2    .   c30521_6mk4   1    
     169   .   1   1   17   17   LYS   HZ3    H   1    7.541     0.001   .   .   .   .   .   .   A   17   LYS   HZ3    .   c30521_6mk4   1    
     170   .   1   1   17   17   LYS   CA     C   13   58.232    0.000   .   .   .   .   .   .   A   17   LYS   CA     .   c30521_6mk4   1    
     171   .   1   1   17   17   LYS   CB     C   13   32.719    0.000   .   .   .   .   .   .   A   17   LYS   CB     .   c30521_6mk4   1    
     172   .   1   1   17   17   LYS   CG     C   13   24.676    0.000   .   .   .   .   .   .   A   17   LYS   CG     .   c30521_6mk4   1    
     173   .   1   1   17   17   LYS   CE     C   13   41.839    0.000   .   .   .   .   .   .   A   17   LYS   CE     .   c30521_6mk4   1    
     174   .   1   1   17   17   LYS   N      N   15   119.010   0.000   .   .   .   .   .   .   A   17   LYS   N      .   c30521_6mk4   1    
     175   .   1   1   18   18   GLY   H      H   1    8.890     0.002   .   .   .   .   .   .   A   18   GLY   H      .   c30521_6mk4   1    
     176   .   1   1   18   18   GLY   HA2    H   1    4.321     0.002   .   .   .   .   .   .   A   18   GLY   HA2    .   c30521_6mk4   1    
     177   .   1   1   18   18   GLY   HA3    H   1    3.670     0.003   .   .   .   .   .   .   A   18   GLY   HA3    .   c30521_6mk4   1    
     178   .   1   1   18   18   GLY   CA     C   13   44.712    0.000   .   .   .   .   .   .   A   18   GLY   CA     .   c30521_6mk4   1    
     179   .   1   1   18   18   GLY   N      N   15   112.011   0.000   .   .   .   .   .   .   A   18   GLY   N      .   c30521_6mk4   1    
     180   .   1   1   19   19   MET   H      H   1    7.524     0.003   .   .   .   .   .   .   A   19   MET   H      .   c30521_6mk4   1    
     181   .   1   1   19   19   MET   HA     H   1    5.105     0.004   .   .   .   .   .   .   A   19   MET   HA     .   c30521_6mk4   1    
     182   .   1   1   19   19   MET   HB2    H   1    1.933     0.004   .   .   .   .   .   .   A   19   MET   HB2    .   c30521_6mk4   1    
     183   .   1   1   19   19   MET   HB3    H   1    2.158     0.006   .   .   .   .   .   .   A   19   MET   HB3    .   c30521_6mk4   1    
     184   .   1   1   19   19   MET   HG2    H   1    2.359     0.003   .   .   .   .   .   .   A   19   MET   HG2    .   c30521_6mk4   1    
     185   .   1   1   19   19   MET   HG3    H   1    2.167     0.006   .   .   .   .   .   .   A   19   MET   HG3    .   c30521_6mk4   1    
     186   .   1   1   19   19   MET   CA     C   13   54.511    0.000   .   .   .   .   .   .   A   19   MET   CA     .   c30521_6mk4   1    
     187   .   1   1   19   19   MET   CB     C   13   37.752    0.000   .   .   .   .   .   .   A   19   MET   CB     .   c30521_6mk4   1    
     188   .   1   1   19   19   MET   CG     C   13   33.141    0.000   .   .   .   .   .   .   A   19   MET   CG     .   c30521_6mk4   1    
     189   .   1   1   19   19   MET   N      N   15   118.063   0.000   .   .   .   .   .   .   A   19   MET   N      .   c30521_6mk4   1    
     190   .   1   1   20   20   VAL   H      H   1    9.100     0.002   .   .   .   .   .   .   A   20   VAL   H      .   c30521_6mk4   1    
     191   .   1   1   20   20   VAL   HA     H   1    4.498     0.001   .   .   .   .   .   .   A   20   VAL   HA     .   c30521_6mk4   1    
     192   .   1   1   20   20   VAL   HB     H   1    1.929     0.002   .   .   .   .   .   .   A   20   VAL   HB     .   c30521_6mk4   1    
     193   .   1   1   20   20   VAL   HG21   H   1    0.840     0.006   .   .   .   .   .   .   A   20   VAL   HG21   .   c30521_6mk4   1    
     194   .   1   1   20   20   VAL   HG22   H   1    0.840     0.006   .   .   .   .   .   .   A   20   VAL   HG22   .   c30521_6mk4   1    
     195   .   1   1   20   20   VAL   HG23   H   1    0.840     0.006   .   .   .   .   .   .   A   20   VAL   HG23   .   c30521_6mk4   1    
     196   .   1   1   20   20   VAL   CA     C   13   59.322    0.000   .   .   .   .   .   .   A   20   VAL   CA     .   c30521_6mk4   1    
     197   .   1   1   20   20   VAL   CB     C   13   35.095    0.000   .   .   .   .   .   .   A   20   VAL   CB     .   c30521_6mk4   1    
     198   .   1   1   20   20   VAL   CG2    C   13   24.929    0.000   .   .   .   .   .   .   A   20   VAL   CG2    .   c30521_6mk4   1    
     199   .   1   1   20   20   VAL   N      N   15   116.809   0.000   .   .   .   .   .   .   A   20   VAL   N      .   c30521_6mk4   1    
     200   .   1   1   21   21   CYS   H      H   1    8.947     0.002   .   .   .   .   .   .   A   21   CYS   H      .   c30521_6mk4   1    
     201   .   1   1   21   21   CYS   HA     H   1    4.818     0.004   .   .   .   .   .   .   A   21   CYS   HA     .   c30521_6mk4   1    
     202   .   1   1   21   21   CYS   HB2    H   1    2.845     0.008   .   .   .   .   .   .   A   21   CYS   HB2    .   c30521_6mk4   1    
     203   .   1   1   21   21   CYS   HB3    H   1    3.341     0.002   .   .   .   .   .   .   A   21   CYS   HB3    .   c30521_6mk4   1    
     204   .   1   1   21   21   CYS   CA     C   13   55.357    0.000   .   .   .   .   .   .   A   21   CYS   CA     .   c30521_6mk4   1    
     205   .   1   1   21   21   CYS   CB     C   13   39.988    0.000   .   .   .   .   .   .   A   21   CYS   CB     .   c30521_6mk4   1    
     206   .   1   1   21   21   CYS   N      N   15   122.745   0.000   .   .   .   .   .   .   A   21   CYS   N      .   c30521_6mk4   1    
     207   .   1   1   22   22   ARG   H      H   1    8.248     0.003   .   .   .   .   .   .   A   22   ARG   H      .   c30521_6mk4   1    
     208   .   1   1   22   22   ARG   HA     H   1    4.520     0.002   .   .   .   .   .   .   A   22   ARG   HA     .   c30521_6mk4   1    
     209   .   1   1   22   22   ARG   HB2    H   1    1.585     0.005   .   .   .   .   .   .   A   22   ARG   HB2    .   c30521_6mk4   1    
     210   .   1   1   22   22   ARG   HB3    H   1    1.727     0.005   .   .   .   .   .   .   A   22   ARG   HB3    .   c30521_6mk4   1    
     211   .   1   1   22   22   ARG   HG2    H   1    1.471     0.003   .   .   .   .   .   .   A   22   ARG   HG2    .   c30521_6mk4   1    
     212   .   1   1   22   22   ARG   HG3    H   1    1.471     0.003   .   .   .   .   .   .   A   22   ARG   HG3    .   c30521_6mk4   1    
     213   .   1   1   22   22   ARG   HD2    H   1    3.126     0.003   .   .   .   .   .   .   A   22   ARG   HD2    .   c30521_6mk4   1    
     214   .   1   1   22   22   ARG   HD3    H   1    3.268     0.002   .   .   .   .   .   .   A   22   ARG   HD3    .   c30521_6mk4   1    
     215   .   1   1   22   22   ARG   HE     H   1    7.247     0.003   .   .   .   .   .   .   A   22   ARG   HE     .   c30521_6mk4   1    
     216   .   1   1   22   22   ARG   CA     C   13   54.815    0.000   .   .   .   .   .   .   A   22   ARG   CA     .   c30521_6mk4   1    
     217   .   1   1   22   22   ARG   CB     C   13   30.086    0.000   .   .   .   .   .   .   A   22   ARG   CB     .   c30521_6mk4   1    
     218   .   1   1   22   22   ARG   CG     C   13   26.878    0.000   .   .   .   .   .   .   A   22   ARG   CG     .   c30521_6mk4   1    
     219   .   1   1   22   22   ARG   CD     C   13   43.173    0.000   .   .   .   .   .   .   A   22   ARG   CD     .   c30521_6mk4   1    
     220   .   1   1   22   22   ARG   N      N   15   119.040   0.000   .   .   .   .   .   .   A   22   ARG   N      .   c30521_6mk4   1    
     221   .   1   1   23   23   LEU   H      H   1    8.144     0.003   .   .   .   .   .   .   A   23   LEU   H      .   c30521_6mk4   1    
     222   .   1   1   23   23   LEU   HA     H   1    3.732     0.002   .   .   .   .   .   .   A   23   LEU   HA     .   c30521_6mk4   1    
     223   .   1   1   23   23   LEU   HB2    H   1    1.044     0.003   .   .   .   .   .   .   A   23   LEU   HB2    .   c30521_6mk4   1    
     224   .   1   1   23   23   LEU   HB3    H   1    2.174     0.005   .   .   .   .   .   .   A   23   LEU   HB3    .   c30521_6mk4   1    
     225   .   1   1   23   23   LEU   HG     H   1    1.406     0.005   .   .   .   .   .   .   A   23   LEU   HG     .   c30521_6mk4   1    
     226   .   1   1   23   23   LEU   HD11   H   1    0.843     0.002   .   .   .   .   .   .   A   23   LEU   HD11   .   c30521_6mk4   1    
     227   .   1   1   23   23   LEU   HD12   H   1    0.843     0.002   .   .   .   .   .   .   A   23   LEU   HD12   .   c30521_6mk4   1    
     228   .   1   1   23   23   LEU   HD13   H   1    0.843     0.002   .   .   .   .   .   .   A   23   LEU   HD13   .   c30521_6mk4   1    
     229   .   1   1   23   23   LEU   HD21   H   1    0.804     0.003   .   .   .   .   .   .   A   23   LEU   HD21   .   c30521_6mk4   1    
     230   .   1   1   23   23   LEU   HD22   H   1    0.804     0.003   .   .   .   .   .   .   A   23   LEU   HD22   .   c30521_6mk4   1    
     231   .   1   1   23   23   LEU   HD23   H   1    0.804     0.003   .   .   .   .   .   .   A   23   LEU   HD23   .   c30521_6mk4   1    
     232   .   1   1   23   23   LEU   CA     C   13   61.608    0.000   .   .   .   .   .   .   A   23   LEU   CA     .   c30521_6mk4   1    
     233   .   1   1   23   23   LEU   CB     C   13   40.264    0.000   .   .   .   .   .   .   A   23   LEU   CB     .   c30521_6mk4   1    
     234   .   1   1   23   23   LEU   CG     C   13   27.573    0.000   .   .   .   .   .   .   A   23   LEU   CG     .   c30521_6mk4   1    
     235   .   1   1   23   23   LEU   CD1    C   13   24.964    0.000   .   .   .   .   .   .   A   23   LEU   CD1    .   c30521_6mk4   1    
     236   .   1   1   23   23   LEU   CD2    C   13   22.817    0.000   .   .   .   .   .   .   A   23   LEU   CD2    .   c30521_6mk4   1    
     237   .   1   1   23   23   LEU   N      N   15   124.099   0.000   .   .   .   .   .   .   A   23   LEU   N      .   c30521_6mk4   1    
     238   .   1   1   24   24   TRP   H      H   1    8.130     0.005   .   .   .   .   .   .   A   24   TRP   H      .   c30521_6mk4   1    
     239   .   1   1   24   24   TRP   HA     H   1    5.327     0.004   .   .   .   .   .   .   A   24   TRP   HA     .   c30521_6mk4   1    
     240   .   1   1   24   24   TRP   HB2    H   1    3.016     0.004   .   .   .   .   .   .   A   24   TRP   HB2    .   c30521_6mk4   1    
     241   .   1   1   24   24   TRP   HB3    H   1    2.714     0.003   .   .   .   .   .   .   A   24   TRP   HB3    .   c30521_6mk4   1    
     242   .   1   1   24   24   TRP   HD1    H   1    7.065     0.002   .   .   .   .   .   .   A   24   TRP   HD1    .   c30521_6mk4   1    
     243   .   1   1   24   24   TRP   HE1    H   1    10.258    0.000   .   .   .   .   .   .   A   24   TRP   HE1    .   c30521_6mk4   1    
     244   .   1   1   24   24   TRP   HE3    H   1    7.520     0.003   .   .   .   .   .   .   A   24   TRP   HE3    .   c30521_6mk4   1    
     245   .   1   1   24   24   TRP   HZ2    H   1    7.462     0.005   .   .   .   .   .   .   A   24   TRP   HZ2    .   c30521_6mk4   1    
     246   .   1   1   24   24   TRP   HZ3    H   1    7.179     0.002   .   .   .   .   .   .   A   24   TRP   HZ3    .   c30521_6mk4   1    
     247   .   1   1   24   24   TRP   HH2    H   1    7.236     0.000   .   .   .   .   .   .   A   24   TRP   HH2    .   c30521_6mk4   1    
     248   .   1   1   24   24   TRP   CA     C   13   56.524    0.000   .   .   .   .   .   .   A   24   TRP   CA     .   c30521_6mk4   1    
     249   .   1   1   24   24   TRP   CB     C   13   32.323    0.000   .   .   .   .   .   .   A   24   TRP   CB     .   c30521_6mk4   1    
     250   .   1   1   24   24   TRP   N      N   15   116.531   0.000   .   .   .   .   .   .   A   24   TRP   N      .   c30521_6mk4   1    
     251   .   1   1   25   25   CYS   H      H   1    8.673     0.001   .   .   .   .   .   .   A   25   CYS   H      .   c30521_6mk4   1    
     252   .   1   1   25   25   CYS   HA     H   1    4.909     0.005   .   .   .   .   .   .   A   25   CYS   HA     .   c30521_6mk4   1    
     253   .   1   1   25   25   CYS   HB2    H   1    3.175     0.004   .   .   .   .   .   .   A   25   CYS   HB2    .   c30521_6mk4   1    
     254   .   1   1   25   25   CYS   HB3    H   1    3.391     0.003   .   .   .   .   .   .   A   25   CYS   HB3    .   c30521_6mk4   1    
     255   .   1   1   25   25   CYS   CA     C   13   56.594    0.000   .   .   .   .   .   .   A   25   CYS   CA     .   c30521_6mk4   1    
     256   .   1   1   25   25   CYS   CB     C   13   40.165    0.000   .   .   .   .   .   .   A   25   CYS   CB     .   c30521_6mk4   1    
     257   .   1   1   25   25   CYS   N      N   15   118.788   0.000   .   .   .   .   .   .   A   25   CYS   N      .   c30521_6mk4   1    
     258   .   1   1   26   26   LYS   H      H   1    9.326     0.002   .   .   .   .   .   .   A   26   LYS   H      .   c30521_6mk4   1    
     259   .   1   1   26   26   LYS   HA     H   1    4.984     0.003   .   .   .   .   .   .   A   26   LYS   HA     .   c30521_6mk4   1    
     260   .   1   1   26   26   LYS   HB2    H   1    2.056     0.002   .   .   .   .   .   .   A   26   LYS   HB2    .   c30521_6mk4   1    
     261   .   1   1   26   26   LYS   HB3    H   1    1.732     0.004   .   .   .   .   .   .   A   26   LYS   HB3    .   c30521_6mk4   1    
     262   .   1   1   26   26   LYS   HG2    H   1    1.595     0.001   .   .   .   .   .   .   A   26   LYS   HG2    .   c30521_6mk4   1    
     263   .   1   1   26   26   LYS   HG3    H   1    1.481     0.003   .   .   .   .   .   .   A   26   LYS   HG3    .   c30521_6mk4   1    
     264   .   1   1   26   26   LYS   HE2    H   1    2.827     0.002   .   .   .   .   .   .   A   26   LYS   HE2    .   c30521_6mk4   1    
     265   .   1   1   26   26   LYS   HE3    H   1    2.827     0.002   .   .   .   .   .   .   A   26   LYS   HE3    .   c30521_6mk4   1    
     266   .   1   1   26   26   LYS   HZ1    H   1    7.622     0.002   .   .   .   .   .   .   A   26   LYS   HZ1    .   c30521_6mk4   1    
     267   .   1   1   26   26   LYS   HZ2    H   1    7.622     0.002   .   .   .   .   .   .   A   26   LYS   HZ2    .   c30521_6mk4   1    
     268   .   1   1   26   26   LYS   HZ3    H   1    7.622     0.002   .   .   .   .   .   .   A   26   LYS   HZ3    .   c30521_6mk4   1    
     269   .   1   1   26   26   LYS   CA     C   13   55.108    0.000   .   .   .   .   .   .   A   26   LYS   CA     .   c30521_6mk4   1    
     270   .   1   1   26   26   LYS   CB     C   13   35.898    0.000   .   .   .   .   .   .   A   26   LYS   CB     .   c30521_6mk4   1    
     271   .   1   1   26   26   LYS   CG     C   13   25.165    0.000   .   .   .   .   .   .   A   26   LYS   CG     .   c30521_6mk4   1    
     272   .   1   1   26   26   LYS   CE     C   13   41.828    0.000   .   .   .   .   .   .   A   26   LYS   CE     .   c30521_6mk4   1    
     273   .   1   1   26   26   LYS   N      N   15   124.995   0.000   .   .   .   .   .   .   A   26   LYS   N      .   c30521_6mk4   1    
     274   .   1   1   27   27   LYS   H      H   1    8.536     0.003   .   .   .   .   .   .   A   27   LYS   H      .   c30521_6mk4   1    
     275   .   1   1   27   27   LYS   HA     H   1    4.316     0.002   .   .   .   .   .   .   A   27   LYS   HA     .   c30521_6mk4   1    
     276   .   1   1   27   27   LYS   HB2    H   1    1.622     0.002   .   .   .   .   .   .   A   27   LYS   HB2    .   c30521_6mk4   1    
     277   .   1   1   27   27   LYS   HB3    H   1    1.761     0.004   .   .   .   .   .   .   A   27   LYS   HB3    .   c30521_6mk4   1    
     278   .   1   1   27   27   LYS   HG2    H   1    1.151     0.002   .   .   .   .   .   .   A   27   LYS   HG2    .   c30521_6mk4   1    
     279   .   1   1   27   27   LYS   HG3    H   1    1.203     0.002   .   .   .   .   .   .   A   27   LYS   HG3    .   c30521_6mk4   1    
     280   .   1   1   27   27   LYS   HE2    H   1    2.003     0.014   .   .   .   .   .   .   A   27   LYS   HE2    .   c30521_6mk4   1    
     281   .   1   1   27   27   LYS   HE3    H   1    2.334     0.007   .   .   .   .   .   .   A   27   LYS   HE3    .   c30521_6mk4   1    
     282   .   1   1   27   27   LYS   HZ1    H   1    7.072     0.003   .   .   .   .   .   .   A   27   LYS   HZ1    .   c30521_6mk4   1    
     283   .   1   1   27   27   LYS   HZ2    H   1    7.072     0.003   .   .   .   .   .   .   A   27   LYS   HZ2    .   c30521_6mk4   1    
     284   .   1   1   27   27   LYS   HZ3    H   1    7.072     0.003   .   .   .   .   .   .   A   27   LYS   HZ3    .   c30521_6mk4   1    
     285   .   1   1   27   27   LYS   CA     C   13   57.328    0.000   .   .   .   .   .   .   A   27   LYS   CA     .   c30521_6mk4   1    
     286   .   1   1   27   27   LYS   CB     C   13   33.339    0.000   .   .   .   .   .   .   A   27   LYS   CB     .   c30521_6mk4   1    
     287   .   1   1   27   27   LYS   CG     C   13   25.717    0.000   .   .   .   .   .   .   A   27   LYS   CG     .   c30521_6mk4   1    
     288   .   1   1   27   27   LYS   CE     C   13   41.335    0.000   .   .   .   .   .   .   A   27   LYS   CE     .   c30521_6mk4   1    
     289   .   1   1   27   27   LYS   N      N   15   119.872   0.000   .   .   .   .   .   .   A   27   LYS   N      .   c30521_6mk4   1    
     290   .   1   1   28   28   LYS   H      H   1    8.102     0.004   .   .   .   .   .   .   A   28   LYS   H      .   c30521_6mk4   1    
     291   .   1   1   28   28   LYS   HA     H   1    4.126     0.004   .   .   .   .   .   .   A   28   LYS   HA     .   c30521_6mk4   1    
     292   .   1   1   28   28   LYS   HB2    H   1    1.480     0.002   .   .   .   .   .   .   A   28   LYS   HB2    .   c30521_6mk4   1    
     293   .   1   1   28   28   LYS   HB3    H   1    1.667     0.003   .   .   .   .   .   .   A   28   LYS   HB3    .   c30521_6mk4   1    
     294   .   1   1   28   28   LYS   HG2    H   1    1.121     0.003   .   .   .   .   .   .   A   28   LYS   HG2    .   c30521_6mk4   1    
     295   .   1   1   28   28   LYS   HG3    H   1    1.121     0.003   .   .   .   .   .   .   A   28   LYS   HG3    .   c30521_6mk4   1    
     296   .   1   1   28   28   LYS   HE2    H   1    2.724     0.006   .   .   .   .   .   .   A   28   LYS   HE2    .   c30521_6mk4   1    
     297   .   1   1   28   28   LYS   HE3    H   1    2.724     0.006   .   .   .   .   .   .   A   28   LYS   HE3    .   c30521_6mk4   1    
     298   .   1   1   28   28   LYS   HZ1    H   1    7.435     0.003   .   .   .   .   .   .   A   28   LYS   HZ1    .   c30521_6mk4   1    
     299   .   1   1   28   28   LYS   HZ2    H   1    7.435     0.003   .   .   .   .   .   .   A   28   LYS   HZ2    .   c30521_6mk4   1    
     300   .   1   1   28   28   LYS   HZ3    H   1    7.435     0.003   .   .   .   .   .   .   A   28   LYS   HZ3    .   c30521_6mk4   1    
     301   .   1   1   28   28   LYS   CA     C   13   56.269    0.000   .   .   .   .   .   .   A   28   LYS   CA     .   c30521_6mk4   1    
     302   .   1   1   28   28   LYS   CB     C   13   33.517    0.000   .   .   .   .   .   .   A   28   LYS   CB     .   c30521_6mk4   1    
     303   .   1   1   28   28   LYS   CG     C   13   24.789    0.000   .   .   .   .   .   .   A   28   LYS   CG     .   c30521_6mk4   1    
     304   .   1   1   28   28   LYS   CE     C   13   41.641    0.000   .   .   .   .   .   .   A   28   LYS   CE     .   c30521_6mk4   1    
     305   .   1   1   28   28   LYS   N      N   15   122.046   0.000   .   .   .   .   .   .   A   28   LYS   N      .   c30521_6mk4   1    
     306   .   1   1   29   29   LEU   H      H   1    8.148     0.006   .   .   .   .   .   .   A   29   LEU   H      .   c30521_6mk4   1    
     307   .   1   1   29   29   LEU   HA     H   1    4.277     0.002   .   .   .   .   .   .   A   29   LEU   HA     .   c30521_6mk4   1    
     308   .   1   1   29   29   LEU   HB2    H   1    1.478     0.004   .   .   .   .   .   .   A   29   LEU   HB2    .   c30521_6mk4   1    
     309   .   1   1   29   29   LEU   HB3    H   1    1.478     0.004   .   .   .   .   .   .   A   29   LEU   HB3    .   c30521_6mk4   1    
     310   .   1   1   29   29   LEU   HD11   H   1    0.884     0.001   .   .   .   .   .   .   A   29   LEU   HD11   .   c30521_6mk4   1    
     311   .   1   1   29   29   LEU   HD12   H   1    0.884     0.001   .   .   .   .   .   .   A   29   LEU   HD12   .   c30521_6mk4   1    
     312   .   1   1   29   29   LEU   HD13   H   1    0.884     0.001   .   .   .   .   .   .   A   29   LEU   HD13   .   c30521_6mk4   1    
     313   .   1   1   29   29   LEU   HD21   H   1    0.794     0.001   .   .   .   .   .   .   A   29   LEU   HD21   .   c30521_6mk4   1    
     314   .   1   1   29   29   LEU   HD22   H   1    0.794     0.001   .   .   .   .   .   .   A   29   LEU   HD22   .   c30521_6mk4   1    
     315   .   1   1   29   29   LEU   HD23   H   1    0.794     0.001   .   .   .   .   .   .   A   29   LEU   HD23   .   c30521_6mk4   1    
     316   .   1   1   29   29   LEU   CA     C   13   55.170    0.000   .   .   .   .   .   .   A   29   LEU   CA     .   c30521_6mk4   1    
     317   .   1   1   29   29   LEU   CB     C   13   42.436    0.000   .   .   .   .   .   .   A   29   LEU   CB     .   c30521_6mk4   1    
     318   .   1   1   29   29   LEU   CD1    C   13   24.916    0.000   .   .   .   .   .   .   A   29   LEU   CD1    .   c30521_6mk4   1    
     319   .   1   1   29   29   LEU   CD2    C   13   23.307    0.000   .   .   .   .   .   .   A   29   LEU   CD2    .   c30521_6mk4   1    
     320   .   1   1   29   29   LEU   N      N   15   124.785   0.000   .   .   .   .   .   .   A   29   LEU   N      .   c30521_6mk4   1    
     321   .   1   1   30   30   TRP   H      H   1    7.569     0.007   .   .   .   .   .   .   A   30   TRP   H      .   c30521_6mk4   1    
     322   .   1   1   30   30   TRP   HA     H   1    4.548     0.009   .   .   .   .   .   .   A   30   TRP   HA     .   c30521_6mk4   1    
     323   .   1   1   30   30   TRP   HB2    H   1    3.237     0.002   .   .   .   .   .   .   A   30   TRP   HB2    .   c30521_6mk4   1    
     324   .   1   1   30   30   TRP   HB3    H   1    3.367     0.003   .   .   .   .   .   .   A   30   TRP   HB3    .   c30521_6mk4   1    
     325   .   1   1   30   30   TRP   HD1    H   1    7.212     0.004   .   .   .   .   .   .   A   30   TRP   HD1    .   c30521_6mk4   1    
     326   .   1   1   30   30   TRP   HE1    H   1    10.130    0.002   .   .   .   .   .   .   A   30   TRP   HE1    .   c30521_6mk4   1    
     327   .   1   1   30   30   TRP   HE3    H   1    7.664     0.005   .   .   .   .   .   .   A   30   TRP   HE3    .   c30521_6mk4   1    
     328   .   1   1   30   30   TRP   HZ2    H   1    7.492     0.002   .   .   .   .   .   .   A   30   TRP   HZ2    .   c30521_6mk4   1    
     329   .   1   1   30   30   TRP   HZ3    H   1    7.177     0.000   .   .   .   .   .   .   A   30   TRP   HZ3    .   c30521_6mk4   1    
     330   .   1   1   30   30   TRP   HH2    H   1    7.235     0.000   .   .   .   .   .   .   A   30   TRP   HH2    .   c30521_6mk4   1    
     331   .   1   1   30   30   TRP   CA     C   13   57.680    0.000   .   .   .   .   .   .   A   30   TRP   CA     .   c30521_6mk4   1    
     332   .   1   1   30   30   TRP   CB     C   13   29.788    0.000   .   .   .   .   .   .   A   30   TRP   CB     .   c30521_6mk4   1    
     333   .   1   1   30   30   TRP   N      N   15   123.911   0.000   .   .   .   .   .   .   A   30   TRP   N      .   c30521_6mk4   1    

   stop_

save_


##############################
#  Structure determinations  #
##############################

    ##########################
    #  Conformer statistics  #
    ##########################

save_conformer_statistics
   _Conformer_stat_list.Sf_category                    conformer_statistics
   _Conformer_stat_list.Sf_framecode                   conformer_statistics
   _Conformer_stat_list.Entry_ID                       c30521_6mk4
   _Conformer_stat_list.ID                             1
   _Conformer_stat_list.Conf_family_coord_set_ID       1
   _Conformer_stat_list.Conf_family_coord_set_label    $Original_constraints_and_structures
   _Conformer_stat_list.Conformer_submitted_total_num  20

save_

    #####################################
    #  Conformer family coordinate set  #
    #####################################

save_ensemble_of_conformers
   _Conformer_family_coord_set.Sf_category   conformer_family_coord_set
   _Conformer_family_coord_set.Sf_framecode  ensemble_of_conformers
   _Conformer_family_coord_set.Entry_ID      c30521_6mk4
   _Conformer_family_coord_set.ID            1

   loop_
      _Conformer_family_refinement.Refine_method
      _Conformer_family_refinement.Refine_details
      _Conformer_family_refinement.Software_ID
      _Conformer_family_refinement.Software_label
      _Conformer_family_refinement.Entry_ID
      _Conformer_family_refinement.Conformer_family_coord_set_ID

     1   .   .   .   c30521_6mk4   1    

   stop_

   loop_
      _Conformer_family_software.Software_ID
      _Conformer_family_software.Software_label
      _Conformer_family_software.Method_ID
      _Conformer_family_software.Method_label
      _Conformer_family_software.Entry_ID
      _Conformer_family_software.Conformer_family_coord_set_ID

     .   .   .   .   c30521_6mk4   1    

   stop_

   loop_
      _Atom_site.Assembly_ID
      _Atom_site.Model_ID
      _Atom_site.Model_site_ID
      _Atom_site.ID
      _Atom_site.Assembly_atom_ID
      _Atom_site.Label_entity_assembly_ID
      _Atom_site.Label_entity_ID
      _Atom_site.Label_comp_index_ID
      _Atom_site.Label_comp_ID
      _Atom_site.Label_atom_ID
      _Atom_site.Type_symbol
      _Atom_site.Cartn_x
      _Atom_site.Cartn_y
      _Atom_site.Cartn_z
      _Atom_site.Cartn_x_esd
      _Atom_site.Cartn_y_esd
      _Atom_site.Cartn_z_esd
      _Atom_site.Occupancy
      _Atom_site.Occupancy_esd
      _Atom_site.Uncertainty
      _Atom_site.Ordered_flag
      _Atom_site.Footnote_ID
      _Atom_site.PDBX_label_asym_ID
      _Atom_site.PDBX_label_seq_ID
      _Atom_site.PDBX_label_comp_ID
      _Atom_site.PDBX_label_atom_ID
      _Atom_site.PDBX_formal_charge
      _Atom_site.PDBX_label_entity_ID
      _Atom_site.PDB_record_ID
      _Atom_site.PDB_model_num
      _Atom_site.PDB_strand_ID
      _Atom_site.PDB_ins_code
      _Atom_site.PDB_residue_no
      _Atom_site.PDB_residue_name
      _Atom_site.PDB_atom_name
      _Atom_site.Auth_entity_assembly_ID
      _Atom_site.Auth_asym_ID
      _Atom_site.Auth_chain_ID
      _Atom_site.Auth_seq_ID
      _Atom_site.Auth_comp_ID
      _Atom_site.Auth_atom_ID
      _Atom_site.Auth_alt_ID
      _Atom_site.Auth_atom_name
      _Atom_site.Details
      _Atom_site.Entry_ID
      _Atom_site.Conformer_family_coord_set_ID

     .   1    .   1       .   1   1   1    TYR   C      C   -9.810    0.484     2.468     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   2       .   1   1   1    TYR   CA     C   -10.919   1.084     3.275     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   3       .   1   1   1    TYR   CB     C   -10.291   1.534     4.604     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   4       .   1   1   1    TYR   CD1    C   -11.748   1.267     6.641     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   5       .   1   1   1    TYR   CD2    C   -11.545   3.431     5.680     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   6       .   1   1   1    TYR   CE1    C   -12.561   1.774     7.623     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   7       .   1   1   1    TYR   CE2    C   -12.367   3.943     6.656     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   8       .   1   1   1    TYR   CG     C   -11.224   2.086     5.651     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   9       .   1   1   1    TYR   CZ     C   -12.870   3.111     7.625     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   10      .   1   1   1    TYR   H1     H   -12.299   -0.238    2.567     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   H1     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   11      .   1   1   1    TYR   H2     H   -12.731   0.415     4.061     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   H2     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   12      .   1   1   1    TYR   H3     H   -11.506   -0.760    3.944     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   H3     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   13      .   1   1   1    TYR   HA     H   -11.350   1.936     2.773     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   14      .   1   1   1    TYR   HB2    H   -9.788    0.686     5.044     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   15      .   1   1   1    TYR   HB3    H   -9.549    2.288     4.387     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   16      .   1   1   1    TYR   HD1    H   -11.510   0.213     6.641     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   17      .   1   1   1    TYR   HD2    H   -11.152   4.086     4.917     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   18      .   1   1   1    TYR   HE1    H   -12.959   1.121     8.386     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   19      .   1   1   1    TYR   HE2    H   -12.606   4.996     6.653     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   20      .   1   1   1    TYR   HH     H   -14.296   4.261     8.273     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HH     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   21      .   1   1   1    TYR   N      N   -11.937   0.069     3.490     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   22      .   1   1   1    TYR   O      O   -9.569    -0.724    2.552     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   23      .   1   1   1    TYR   OH     O   -13.664   3.616     8.615     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   OH     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   24      .   1   1   2    CYS   C      C   -6.821    1.213     2.024     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   25      .   1   1   2    CYS   CA     C   -7.938    0.854     1.059     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   26      .   1   1   2    CYS   CB     C   -7.731    1.515     -0.315    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   27      .   1   1   2    CYS   H      H   -9.481    2.195     1.518     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   28      .   1   1   2    CYS   HA     H   -7.980    -0.221    0.962     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   29      .   1   1   2    CYS   HB2    H   -6.780    1.191     -0.708    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   30      .   1   1   2    CYS   HB3    H   -8.511    1.193     -0.988    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   31      .   1   1   2    CYS   N      N   -9.153    1.283     1.682     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   32      .   1   1   2    CYS   O      O   -6.995    2.123     2.867     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   33      .   1   1   2    CYS   SG     S   -7.712    3.344     -0.309    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   34      .   1   1   3    GLN   C      C   -3.830    1.994     2.509     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   35      .   1   1   3    GLN   CA     C   -4.656    0.780     2.882     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   36      .   1   1   3    GLN   CB     C   -3.789    -0.458    3.055     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   37      .   1   1   3    GLN   CD     C   -5.226    -1.552    4.803     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   38      .   1   1   3    GLN   CG     C   -4.544    -1.707    3.471     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   39      .   1   1   3    GLN   H      H   -5.586    -0.121    1.226     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   40      .   1   1   3    GLN   HA     H   -5.144    0.994     3.818     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   41      .   1   1   3    GLN   HB2    H   -3.251    -0.673    2.145     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   42      .   1   1   3    GLN   HB3    H   -3.062    -0.247    3.826     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   43      .   1   1   3    GLN   HE21   H   -3.587    -2.120    5.690     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HE21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   44      .   1   1   3    GLN   HE22   H   -4.913    -1.729    6.743     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HE22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   45      .   1   1   3    GLN   HG2    H   -5.295    -1.924    2.725     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   46      .   1   1   3    GLN   HG3    H   -3.848    -2.530    3.529     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   47      .   1   1   3    GLN   N      N   -5.706    0.555     1.931     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   48      .   1   1   3    GLN   NE2    N   -4.514    -1.830    5.851     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   NE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   49      .   1   1   3    GLN   O      O   -3.321    2.113     1.383     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   50      .   1   1   3    GLN   OE1    O   -6.375    -1.156    4.887     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   OE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   51      .   1   1   4    LYS   C      C   -1.561    4.023     3.420     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   52      .   1   1   4    LYS   CA     C   -3.078    4.176     3.330     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   53      .   1   1   4    LYS   CB     C   -3.610    5.118     4.418     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   54      .   1   1   4    LYS   CD     C   -5.667    6.260     5.399     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   55      .   1   1   4    LYS   CE     C   -5.073    7.659     5.366     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   56      .   1   1   4    LYS   CG     C   -5.112    5.368     4.297     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   57      .   1   1   4    LYS   H      H   -4.165    2.680     4.319     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   58      .   1   1   4    LYS   HA     H   -3.337    4.590     2.368     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   59      .   1   1   4    LYS   HB2    H   -3.417    4.666     5.382     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   60      .   1   1   4    LYS   HB3    H   -3.095    6.064     4.366     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   61      .   1   1   4    LYS   HD2    H   -6.739    6.336     5.285     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   62      .   1   1   4    LYS   HD3    H   -5.441    5.803     6.351     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   63      .   1   1   4    LYS   HE2    H   -4.018    7.589     5.585     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   64      .   1   1   4    LYS   HE3    H   -5.204    8.069     4.376     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   65      .   1   1   4    LYS   HG2    H   -5.307    5.839     3.344     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   66      .   1   1   4    LYS   HG3    H   -5.617    4.413     4.327     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   67      .   1   1   4    LYS   HZ1    H   -5.592    8.172     7.319     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   68      .   1   1   4    LYS   HZ2    H   -6.717    8.693     6.178     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   69      .   1   1   4    LYS   HZ3    H   -5.251    9.495     6.348     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   70      .   1   1   4    LYS   N      N   -3.748    2.898     3.463     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   71      .   1   1   4    LYS   NZ     N   -5.703    8.559     6.359     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   72      .   1   1   4    LYS   O      O   -1.063    2.946     3.734     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   73      .   1   1   5    TRP   C      C   1.244     4.630     4.479     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   74      .   1   1   5    TRP   CA     C   0.646     5.073     3.143     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   75      .   1   1   5    TRP   CB     C   1.244     6.445     2.741     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   76      .   1   1   5    TRP   CD1    C   0.181     8.141     4.328     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   77      .   1   1   5    TRP   CD2    C   2.372     7.903     4.603     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   78      .   1   1   5    TRP   CE2    C   1.908     8.854     5.519     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   79      .   1   1   5    TRP   CE3    C   3.728     7.582     4.593     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   80      .   1   1   5    TRP   CG     C   1.243     7.466     3.841     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   81      .   1   1   5    TRP   CH2    C   4.064     9.154     6.389     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   82      .   1   1   5    TRP   CZ2    C   2.745     9.487     6.418     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   83      .   1   1   5    TRP   CZ3    C   4.560     8.211     5.489     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   84      .   1   1   5    TRP   H      H   -1.299    5.955     2.996     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   85      .   1   1   5    TRP   HA     H   0.923     4.347     2.394     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   86      .   1   1   5    TRP   HB2    H   2.268     6.305     2.434     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   87      .   1   1   5    TRP   HB3    H   0.677     6.843     1.911     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   88      .   1   1   5    TRP   HD1    H   -0.822    8.010     3.961     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   89      .   1   1   5    TRP   HE1    H   -0.040    9.577     5.825     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   90      .   1   1   5    TRP   HE3    H   4.129     6.854     3.902     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   91      .   1   1   5    TRP   HH2    H   4.749     9.627     7.075     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   92      .   1   1   5    TRP   HZ2    H   2.386     10.221    7.125     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   93      .   1   1   5    TRP   HZ3    H   5.616     7.977     5.500     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   94      .   1   1   5    TRP   N      N   -0.831    5.109     3.183     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   95      .   1   1   5    TRP   NE1    N   0.566     8.982     5.328     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   NE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   96      .   1   1   5    TRP   O      O   2.293     3.989     4.518     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   97      .   1   1   6    MET   C      C   0.512     3.272     7.336     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   98      .   1   1   6    MET   CA     C   1.084     4.612     6.872     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   99      .   1   1   6    MET   CB     C   0.850     5.726     7.923     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   100     .   1   1   6    MET   CE     C   -0.011    8.711     8.845     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   101     .   1   1   6    MET   CG     C   -0.604    6.048     8.231     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   102     .   1   1   6    MET   H      H   -0.268    5.449     5.472     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   103     .   1   1   6    MET   HA     H   2.144     4.521     6.692     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   104     .   1   1   6    MET   HB2    H   1.323     5.432     8.848     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   105     .   1   1   6    MET   HB3    H   1.329     6.626     7.567     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   106     .   1   1   6    MET   HE1    H   -0.078    9.536     9.538     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   107     .   1   1   6    MET   HE2    H   -0.510    8.971     7.922     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   108     .   1   1   6    MET   HE3    H   1.029     8.498     8.643     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   109     .   1   1   6    MET   HG2    H   -1.076    6.433     7.340     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   110     .   1   1   6    MET   HG3    H   -1.100    5.139     8.533     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   111     .   1   1   6    MET   N      N   0.575     4.959     5.568     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   112     .   1   1   6    MET   O      O   0.701     2.851     8.478     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   113     .   1   1   6    MET   SD     S   -0.793    7.266     9.558     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   SD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   114     .   1   1   7    TRP   C      C   0.017     0.235     5.952     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   115     .   1   1   7    TRP   CA     C   -0.786    1.311     6.687     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   116     .   1   1   7    TRP   CB     C   -2.277    1.294     6.234     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   117     .   1   1   7    TRP   CD1    C   -2.852    3.159     7.919     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   118     .   1   1   7    TRP   CD2    C   -4.647    2.202     7.013     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   119     .   1   1   7    TRP   CE2    C   -5.073    3.199     7.905     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   120     .   1   1   7    TRP   CE3    C   -5.609    1.470     6.333     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   121     .   1   1   7    TRP   CG     C   -3.205    2.194     7.034     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   122     .   1   1   7    TRP   CH2    C   -7.336    2.739     7.440     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   123     .   1   1   7    TRP   CZ2    C   -6.419    3.476     8.125     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   124     .   1   1   7    TRP   CZ3    C   -6.942    1.742     6.551     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   125     .   1   1   7    TRP   H      H   -0.275    2.961     5.520     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   126     .   1   1   7    TRP   HA     H   -0.729    1.126     7.748     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   127     .   1   1   7    TRP   HB2    H   -2.326    1.623     5.206     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   128     .   1   1   7    TRP   HB3    H   -2.655    0.283     6.290     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   129     .   1   1   7    TRP   HD1    H   -1.824    3.388     8.159     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   130     .   1   1   7    TRP   HE1    H   -3.968    4.493     9.101     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   131     .   1   1   7    TRP   HE3    H   -5.334    0.681     5.650     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   132     .   1   1   7    TRP   HH2    H   -8.392    2.920     7.583     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   133     .   1   1   7    TRP   HZ2    H   -6.747    4.242     8.813     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   134     .   1   1   7    TRP   HZ3    H   -7.694    1.175     6.024     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   135     .   1   1   7    TRP   N      N   -0.178    2.605     6.430     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   136     .   1   1   7    TRP   NE1    N   -3.961    3.764     8.440     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   NE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   137     .   1   1   7    TRP   O      O   1.055     0.536     5.314     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   138     .   1   1   8    THR   C      C   -0.781    -2.923    4.650     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   139     .   1   1   8    THR   CA     C   0.258     -2.112    5.426     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   140     .   1   1   8    THR   CB     C   0.877     -3.004    6.526     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   141     .   1   1   8    THR   CG2    C   1.933     -2.237    7.319     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   CG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   142     .   1   1   8    THR   H      H   -1.230    -1.189    6.567     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   143     .   1   1   8    THR   HA     H   1.034     -1.723    4.784     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   144     .   1   1   8    THR   HB     H   1.331     -3.868    6.063     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   145     .   1   1   8    THR   HG1    H   0.117     -3.216    8.332     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HG1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   146     .   1   1   8    THR   HG21   H   1.472     -1.387    7.798     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HG21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   147     .   1   1   8    THR   HG22   H   2.712     -1.885    6.656     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HG22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   148     .   1   1   8    THR   HG23   H   2.359     -2.886    8.069     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HG23   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   149     .   1   1   8    THR   N      N   -0.418    -0.991    6.052     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   150     .   1   1   8    THR   O      O   -1.981    -2.719    4.877     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   151     .   1   1   8    THR   OG1    O   -0.164    -3.436    7.435     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   OG1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   152     .   1   1   9    CYS   C      C   -1.213    -6.101    3.283     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   153     .   1   1   9    CYS   CA     C   -1.429    -4.604    3.102     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   154     .   1   1   9    CYS   CB     C   -1.609    -4.229    1.637     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   155     .   1   1   9    CYS   H      H   0.547     -4.001    3.483     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   156     .   1   1   9    CYS   HA     H   -2.339    -4.361    3.632     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   157     .   1   1   9    CYS   HB2    H   -2.480    -4.733    1.247     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   158     .   1   1   9    CYS   HB3    H   -1.763    -3.162    1.568     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   159     .   1   1   9    CYS   N      N   -0.389    -3.828    3.746     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   160     .   1   1   9    CYS   O      O   -0.238    -6.538    3.928     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   161     .   1   1   9    CYS   SG     S   -0.226    -4.654    0.575     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   162     .   1   1   10   ASP   C      C   -2.770    -8.864    1.560     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   163     .   1   1   10   ASP   CA     C   -2.141    -8.324    2.847     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   164     .   1   1   10   ASP   CB     C   -2.993    -8.698    4.092     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   165     .   1   1   10   ASP   CG     C   -3.071    -10.182   4.384     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   166     .   1   1   10   ASP   H      H   -2.798    -6.488    2.128     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   167     .   1   1   10   ASP   HA     H   -1.131    -8.687    2.958     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   168     .   1   1   10   ASP   HB2    H   -2.598    -8.205    4.967     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   169     .   1   1   10   ASP   HB3    H   -3.996    -8.345    3.908     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   170     .   1   1   10   ASP   N      N   -2.114    -6.880    2.720     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   171     .   1   1   10   ASP   O      O   -2.922    -8.113    0.615     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   172     .   1   1   10   ASP   OD1    O   -2.106    -10.755   4.901     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   OD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   173     .   1   1   10   ASP   OD2    O   -4.116    -10.793   4.068     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   OD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   174     .   1   1   11   SER   C      C   -5.216    -10.160   0.271     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   175     .   1   1   11   SER   CA     C   -3.781    -10.695   0.368     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   176     .   1   1   11   SER   CB     C   -3.788    -12.212   0.521     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   177     .   1   1   11   SER   H      H   -3.019    -10.686   2.311     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   178     .   1   1   11   SER   HA     H   -3.224    -10.422   -0.515    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   179     .   1   1   11   SER   HB2    H   -4.469    -12.492   1.310     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   180     .   1   1   11   SER   HB3    H   -4.101    -12.669   -0.407    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   181     .   1   1   11   SER   HG     H   -1.853    -12.081   0.430     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   HG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   182     .   1   1   11   SER   N      N   -3.146    -10.115   1.523     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   183     .   1   1   11   SER   O      O   -5.785    -10.039   -0.812    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   184     .   1   1   11   SER   OG     O   -2.483    -12.683   0.846     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   OG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   185     .   1   1   12   GLU   C      C   -7.046    -7.751    1.464     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   186     .   1   1   12   GLU   CA     C   -7.120    -9.271    1.469     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   187     .   1   1   12   GLU   CB     C   -7.858    -9.735    2.709     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   188     .   1   1   12   GLU   CD     C   -8.716    -11.636   4.079     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   189     .   1   1   12   GLU   CG     C   -7.927    -11.242   2.867     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   190     .   1   1   12   GLU   H      H   -5.285    -9.993    2.250     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   191     .   1   1   12   GLU   HA     H   -7.654    -9.602    0.592     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   192     .   1   1   12   GLU   HB2    H   -7.371    -9.315    3.573     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   193     .   1   1   12   GLU   HB3    H   -8.868    -9.354    2.667     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   194     .   1   1   12   GLU   HG2    H   -8.391    -11.671   1.992     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   195     .   1   1   12   GLU   HG3    H   -6.923    -11.627   2.966     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   196     .   1   1   12   GLU   N      N   -5.787    -9.831    1.423     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   197     .   1   1   12   GLU   O      O   -7.660    -7.097    0.634     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   198     .   1   1   12   GLU   OE1    O   -9.950    -11.747   3.980     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   OE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   199     .   1   1   12   GLU   OE2    O   -8.113    -11.832   5.169     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   OE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   200     .   1   1   13   ARG   C      C   -5.298    -5.225    1.342     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   201     .   1   1   13   ARG   CA     C   -6.133    -5.749    2.506     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   202     .   1   1   13   ARG   CB     C   -5.444    -5.363    3.833     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   203     .   1   1   13   ARG   CD     C   -5.453    -5.287    6.361     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   204     .   1   1   13   ARG   CG     C   -6.191    -5.767    5.103     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   205     .   1   1   13   ARG   CZ     C   -2.996    -5.262    6.919     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   CZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   206     .   1   1   13   ARG   H      H   -5.805    -7.788    3.015     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   207     .   1   1   13   ARG   HA     H   -7.117    -5.304    2.474     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   208     .   1   1   13   ARG   HB2    H   -4.470    -5.829    3.862     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   209     .   1   1   13   ARG   HB3    H   -5.310    -4.292    3.847     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   210     .   1   1   13   ARG   HD2    H   -5.333    -4.216    6.294     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   211     .   1   1   13   ARG   HD3    H   -6.051    -5.523    7.228     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   212     .   1   1   13   ARG   HE     H   -4.071    -6.868    6.310     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   213     .   1   1   13   ARG   HG2    H   -7.179    -5.332    5.085     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   214     .   1   1   13   ARG   HG3    H   -6.270    -6.845    5.132     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   215     .   1   1   13   ARG   HH11   H   -3.920    -3.491    7.351     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HH11   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   216     .   1   1   13   ARG   HH12   H   -2.241    -3.497    7.602     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HH12   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   217     .   1   1   13   ARG   HH21   H   -1.719    -6.879    6.766     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HH21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   218     .   1   1   13   ARG   HH22   H   -0.995    -5.425    7.268     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HH22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   219     .   1   1   13   ARG   N      N   -6.283    -7.201    2.397     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   220     .   1   1   13   ARG   NE     N   -4.110    -5.906    6.515     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   NE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   221     .   1   1   13   ARG   NH1    N   -3.061    -4.008    7.319     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   NH1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   222     .   1   1   13   ARG   NH2    N   -1.833    -5.907    6.990     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   NH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   223     .   1   1   13   ARG   O      O   -4.161    -5.629    1.187     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   224     .   1   1   14   LYS   C      C   -4.775    -2.340    -0.315    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   225     .   1   1   14   LYS   CA     C   -5.143    -3.785    -0.603    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   226     .   1   1   14   LYS   CB     C   -5.977    -3.821    -1.883    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   227     .   1   1   14   LYS   CD     C   -7.075    -5.092    -3.712    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   228     .   1   1   14   LYS   CE     C   -7.332    -6.452    -4.324    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   229     .   1   1   14   LYS   CG     C   -6.295    -5.198    -2.417    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   230     .   1   1   14   LYS   H      H   -6.800    -4.103    0.667     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   231     .   1   1   14   LYS   HA     H   -4.242    -4.357    -0.760    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   232     .   1   1   14   LYS   HB2    H   -6.913    -3.317    -1.697    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   233     .   1   1   14   LYS   HB3    H   -5.441    -3.278    -2.647    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   234     .   1   1   14   LYS   HD2    H   -8.023    -4.613    -3.512    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   235     .   1   1   14   LYS   HD3    H   -6.512    -4.491    -4.410    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   236     .   1   1   14   LYS   HE2    H   -6.385    -6.935    -4.508    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   237     .   1   1   14   LYS   HE3    H   -7.914    -7.048    -3.638    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   238     .   1   1   14   LYS   HG2    H   -5.371    -5.721    -2.610    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   239     .   1   1   14   LYS   HG3    H   -6.884    -5.739    -1.691    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   240     .   1   1   14   LYS   HZ1    H   -7.521    -5.770    -6.283    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   241     .   1   1   14   LYS   HZ2    H   -8.969    -5.850    -5.463    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   242     .   1   1   14   LYS   HZ3    H   -8.249    -7.270    -6.017    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   243     .   1   1   14   LYS   N      N   -5.866    -4.370    0.522     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   244     .   1   1   14   LYS   NZ     N   -8.061    -6.338    -5.600    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   245     .   1   1   14   LYS   O      O   -5.547    -1.614    0.309     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   246     .   1   1   15   CYS   C      C   -3.912    0.315     -1.627    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   247     .   1   1   15   CYS   CA     C   -3.185    -0.535    -0.622    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   248     .   1   1   15   CYS   CB     C   -1.675    -0.387    -0.826    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   249     .   1   1   15   CYS   H      H   -3.013    -2.560    -1.206    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   250     .   1   1   15   CYS   HA     H   -3.450    -0.178    0.359     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   251     .   1   1   15   CYS   HB2    H   -1.420    -0.725    -1.820    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   252     .   1   1   15   CYS   HB3    H   -1.408    0.656     -0.729    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   253     .   1   1   15   CYS   N      N   -3.608    -1.925    -0.763    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   254     .   1   1   15   CYS   O      O   -4.312    -0.182    -2.682    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   255     .   1   1   15   CYS   SG     S   -0.661    -1.332    0.347     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   256     .   1   1   16   CYS   C      C   -3.929    2.645     -3.479    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   257     .   1   1   16   CYS   CA     C   -4.764    2.495     -2.197    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   258     .   1   1   16   CYS   CB     C   -4.935    3.854     -1.520    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   259     .   1   1   16   CYS   H      H   -3.825    1.880     -0.410    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   260     .   1   1   16   CYS   HA     H   -5.734    2.093     -2.447    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   261     .   1   1   16   CYS   HB2    H   -3.957    4.280     -1.355    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   262     .   1   1   16   CYS   HB3    H   -5.500    4.502     -2.173    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   263     .   1   1   16   CYS   N      N   -4.114    1.565     -1.297    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   264     .   1   1   16   CYS   O      O   -2.684    2.610     -3.427    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   265     .   1   1   16   CYS   SG     S   -5.780    3.813     0.104     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   266     .   1   1   17   LYS   C      C   -3.039    4.103     -5.946    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   267     .   1   1   17   LYS   CA     C   -3.965    2.894     -5.914    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   268     .   1   1   17   LYS   CB     C   -5.005    2.994     -7.026    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   269     .   1   1   17   LYS   CD     C   -6.940    1.989     -8.258    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   270     .   1   1   17   LYS   CE     C   -7.891    0.812     -8.359    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   271     .   1   1   17   LYS   CG     C   -5.930    1.793     -7.138    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   272     .   1   1   17   LYS   H      H   -5.590    2.810     -4.568    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   273     .   1   1   17   LYS   HA     H   -3.374    2.003     -6.066    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   274     .   1   1   17   LYS   HB2    H   -5.618    3.862     -6.836    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   275     .   1   1   17   LYS   HB3    H   -4.496    3.122     -7.969    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   276     .   1   1   17   LYS   HD2    H   -7.510    2.886     -8.068    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   277     .   1   1   17   LYS   HD3    H   -6.409    2.092     -9.192    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   278     .   1   1   17   LYS   HE2    H   -7.325    -0.086    -8.557    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   279     .   1   1   17   LYS   HE3    H   -8.406    0.706     -7.417    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   280     .   1   1   17   LYS   HG2    H   -5.338    0.913     -7.345    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   281     .   1   1   17   LYS   HG3    H   -6.457    1.665     -6.204    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   282     .   1   1   17   LYS   HZ1    H   -9.529    1.795     -9.219    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   283     .   1   1   17   LYS   HZ2    H   -9.467    0.145     -9.556    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   284     .   1   1   17   LYS   HZ3    H   -8.430    1.192     -10.345   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   285     .   1   1   17   LYS   N      N   -4.609    2.775     -4.613    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   286     .   1   1   17   LYS   NZ     N   -8.892    1.003     -9.433    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   287     .   1   1   17   LYS   O      O   -3.391    5.190     -5.462    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   288     .   1   1   18   GLY   C      C   0.273     4.509     -5.594    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   289     .   1   1   18   GLY   CA     C   -0.861    4.949     -6.480    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   290     .   1   1   18   GLY   H      H   -1.677    3.052     -6.929    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   291     .   1   1   18   GLY   HA2    H   -0.500    5.117     -7.484    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   HA2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   292     .   1   1   18   GLY   HA3    H   -1.282    5.861     -6.085    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   HA3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   293     .   1   1   18   GLY   N      N   -1.871    3.913     -6.495    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   294     .   1   1   18   GLY   O      O   1.382     5.059     -5.620    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   295     .   1   1   19   MET   C      C   0.917     1.404     -4.312    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   296     .   1   1   19   MET   CA     C   0.916     2.861     -3.942    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   297     .   1   1   19   MET   CB     C   0.541     3.041     -2.461    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   298     .   1   1   19   MET   CE     C   -1.503    4.351     -0.315    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   299     .   1   1   19   MET   CG     C   0.723     4.461     -1.953    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   300     .   1   1   19   MET   H      H   -0.949    3.177     -4.787    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   301     .   1   1   19   MET   HA     H   1.894     3.278     -4.126    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   302     .   1   1   19   MET   HB2    H   -0.496    2.765     -2.334    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   303     .   1   1   19   MET   HB3    H   1.154     2.383     -1.864    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   304     .   1   1   19   MET   HE1    H   -1.933    4.464     0.668     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   305     .   1   1   19   MET   HE2    H   -1.664    3.340     -0.660    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   306     .   1   1   19   MET   HE3    H   -1.968    5.048     -0.995    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   307     .   1   1   19   MET   HG2    H   1.776     4.682     -1.995    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   308     .   1   1   19   MET   HG3    H   0.165     5.149     -2.571    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   309     .   1   1   19   MET   N      N   -0.026    3.516     -4.799    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   310     .   1   1   19   MET   O      O   -0.022    0.935     -4.961    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   311     .   1   1   19   MET   SD     S   0.251     4.692     -0.235    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   SD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   312     .   1   1   20   VAL   C      C   1.784     -1.524    -3.016    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   313     .   1   1   20   VAL   CA     C   2.021     -0.693    -4.259    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   314     .   1   1   20   VAL   CB     C   3.379     -1.074    -4.922    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   315     .   1   1   20   VAL   CG1    C   3.536     -0.374    -6.261    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   CG1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   316     .   1   1   20   VAL   CG2    C   4.559     -0.747    -4.013    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   CG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   317     .   1   1   20   VAL   H      H   2.660     1.120     -3.415    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   318     .   1   1   20   VAL   HA     H   1.226     -0.907    -4.958    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   319     .   1   1   20   VAL   HB     H   3.368     -2.138    -5.105    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   320     .   1   1   20   VAL   HG11   H   3.523     0.695     -6.111    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG11   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   321     .   1   1   20   VAL   HG12   H   2.723     -0.656    -6.913    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG12   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   322     .   1   1   20   VAL   HG13   H   4.475     -0.664    -6.710    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG13   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   323     .   1   1   20   VAL   HG21   H   5.480     -1.014    -4.507    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   324     .   1   1   20   VAL   HG22   H   4.469     -1.304    -3.093    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   325     .   1   1   20   VAL   HG23   H   4.561     0.311     -3.794    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG23   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   326     .   1   1   20   VAL   N      N   1.935     0.700     -3.943    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   327     .   1   1   20   VAL   O      O   2.152     -1.115    -1.897    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   328     .   1   1   21   CYS   C      C   2.089     -4.359    -1.792    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   329     .   1   1   21   CYS   CA     C   0.843     -3.534    -2.110    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   330     .   1   1   21   CYS   CB     C   -0.356    -4.429    -2.472    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   331     .   1   1   21   CYS   H      H   0.842     -2.889    -4.102    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   332     .   1   1   21   CYS   HA     H   0.593     -2.931    -1.249    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   333     .   1   1   21   CYS   HB2    H   -1.155    -3.806    -2.846    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   334     .   1   1   21   CYS   HB3    H   -0.050    -5.109    -3.253    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   335     .   1   1   21   CYS   N      N   1.138     -2.644    -3.198    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   336     .   1   1   21   CYS   O      O   2.693     -4.985    -2.689    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   337     .   1   1   21   CYS   SG     S   -1.051    -5.427    -1.103    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   338     .   1   1   22   ARG   C      C   3.425     -5.139    1.491     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   339     .   1   1   22   ARG   CA     C   3.641     -4.970    -0.033    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   340     .   1   1   22   ARG   CB     C   4.859     -4.040    -0.372    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   341     .   1   1   22   ARG   CD     C   6.499     -5.937    -0.693    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   342     .   1   1   22   ARG   CG     C   6.266     -4.572    -0.071    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   343     .   1   1   22   ARG   CZ     C   5.623     -7.045    -2.737    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   CZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   344     .   1   1   22   ARG   H      H   1.919     -3.864    0.129     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   345     .   1   1   22   ARG   HA     H   3.762     -5.931    -0.508    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   346     .   1   1   22   ARG   HB2    H   4.824     -3.818    -1.427    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   347     .   1   1   22   ARG   HB3    H   4.724     -3.114    0.168     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   348     .   1   1   22   ARG   HD2    H   7.538     -6.197    -0.569    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   349     .   1   1   22   ARG   HD3    H   5.889     -6.654    -0.169    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   350     .   1   1   22   ARG   HE     H   6.387     -5.158    -2.621    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   351     .   1   1   22   ARG   HG2    H   6.993     -3.881    -0.472    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   352     .   1   1   22   ARG   HG3    H   6.393     -4.641    1.000     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   353     .   1   1   22   ARG   HH11   H   5.545     -8.227    -1.067    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HH11   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   354     .   1   1   22   ARG   HH12   H   4.940     -8.951    -2.493    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HH12   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   355     .   1   1   22   ARG   HH21   H   5.535     -6.178    -4.577    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HH21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   356     .   1   1   22   ARG   HH22   H   4.937     -7.773    -4.517    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HH22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   357     .   1   1   22   ARG   N      N   2.471     -4.330    -0.540    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   358     .   1   1   22   ARG   NE     N   6.173     -5.981    -2.120    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   NE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   359     .   1   1   22   ARG   NH1    N   5.353     -8.151    -2.049    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   NH1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   360     .   1   1   22   ARG   NH2    N   5.346     -6.996    -4.029    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   NH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   361     .   1   1   22   ARG   O      O   2.298     -4.835    2.012     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   362     .   1   1   23   LEU   C      C   3.922     -4.466    4.306     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   363     .   1   1   23   LEU   CA     C   4.454     -5.741    3.669     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   364     .   1   1   23   LEU   CB     C   5.872     -6.024    4.185     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   365     .   1   1   23   LEU   CD1    C   7.942     -7.428    4.256     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   366     .   1   1   23   LEU   CD2    C   5.705     -8.523    4.343     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   367     .   1   1   23   LEU   CG     C   6.502     -7.358    3.774     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   368     .   1   1   23   LEU   H      H   5.236     -5.961    1.716     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   369     .   1   1   23   LEU   HA     H   3.810     -6.565    3.936     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   370     .   1   1   23   LEU   HB2    H   6.515     -5.238    3.821     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   371     .   1   1   23   LEU   HB3    H   5.852     -5.978    5.263     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   372     .   1   1   23   LEU   HD11   H   7.965     -7.344    5.332     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD11   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   373     .   1   1   23   LEU   HD12   H   8.510     -6.620    3.819     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD12   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   374     .   1   1   23   LEU   HD13   H   8.374     -8.374    3.961     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD13   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   375     .   1   1   23   LEU   HD21   H   4.699     -8.505    3.951     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   376     .   1   1   23   LEU   HD22   H   5.673     -8.441    5.419     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   377     .   1   1   23   LEU   HD23   H   6.181     -9.452    4.070     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD23   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   378     .   1   1   23   LEU   HG     H   6.503     -7.438    2.697     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   379     .   1   1   23   LEU   N      N   4.458     -5.623    2.203     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   380     .   1   1   23   LEU   O      O   3.279     -4.502    5.348     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   381     .   1   1   24   TRP   C      C   3.247     -1.397    2.744     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   382     .   1   1   24   TRP   CA     C   3.654     -2.095    4.047     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   383     .   1   1   24   TRP   CB     C   4.689     -1.264    4.829     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   384     .   1   1   24   TRP   CD1    C   5.755     0.634     3.546     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   385     .   1   1   24   TRP   CD2    C   6.935     -1.251    3.462     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   386     .   1   1   24   TRP   CE2    C   7.609     -0.270    2.713     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   387     .   1   1   24   TRP   CE3    C   7.493     -2.526    3.555     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   388     .   1   1   24   TRP   CG     C   5.751     -0.640    3.983     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   389     .   1   1   24   TRP   CH2    C   9.328     -1.780    2.171     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   390     .   1   1   24   TRP   CZ2    C   8.807     -0.524    2.062     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   391     .   1   1   24   TRP   CZ3    C   8.683     -2.779    2.909     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   392     .   1   1   24   TRP   H      H   4.742     -3.365    2.855     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   393     .   1   1   24   TRP   HA     H   2.789     -2.299    4.657     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   394     .   1   1   24   TRP   HB2    H   4.178     -0.470    5.352     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   395     .   1   1   24   TRP   HB3    H   5.169     -1.904    5.554     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   396     .   1   1   24   TRP   HD1    H   4.953     1.314     3.798     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   397     .   1   1   24   TRP   HE1    H   7.093     1.724     2.346     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   398     .   1   1   24   TRP   HE3    H   7.004     -3.299    4.127     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   399     .   1   1   24   TRP   HH2    H   10.257    -2.019    1.678     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   400     .   1   1   24   TRP   HZ2    H   9.325     0.233     1.492     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   401     .   1   1   24   TRP   HZ3    H   9.132     -3.761    2.969     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   402     .   1   1   24   TRP   N      N   4.190     -3.353    3.666     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   403     .   1   1   24   TRP   NE1    N   6.864     0.871     2.776     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   NE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   404     .   1   1   24   TRP   O      O   3.708     -1.807    1.670     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   405     .   1   1   25   CYS   C      C   3.077     1.313     1.198     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   406     .   1   1   25   CYS   CA     C   2.014     0.312     1.602     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   407     .   1   1   25   CYS   CB     C   0.662     0.976     1.777     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   408     .   1   1   25   CYS   H      H   2.045     -0.095    3.668     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   409     .   1   1   25   CYS   HA     H   1.945     -0.428    0.818     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   410     .   1   1   25   CYS   HB2    H   0.697     1.635     2.632     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   411     .   1   1   25   CYS   HB3    H   0.425     1.546     0.891     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   412     .   1   1   25   CYS   N      N   2.411     -0.395    2.808     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   413     .   1   1   25   CYS   O      O   3.416     2.225     1.960     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   414     .   1   1   25   CYS   SG     S   -0.675    -0.220    2.044     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   415     .   1   1   26   LYS   C      C   4.287     2.699     -1.704    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   416     .   1   1   26   LYS   CA     C   4.694     1.952     -0.458    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   417     .   1   1   26   LYS   CB     C   5.909     1.057     -0.743    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   418     .   1   1   26   LYS   CD     C   8.359     0.924     -1.379    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   419     .   1   1   26   LYS   CE     C   8.253     -0.154    -2.458    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   420     .   1   1   26   LYS   CG     C   7.110     1.804     -1.293    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   421     .   1   1   26   LYS   H      H   3.227     0.456     -0.580    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   422     .   1   1   26   LYS   HA     H   4.960     2.656     0.316     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   423     .   1   1   26   LYS   HB2    H   6.204     0.571     0.174     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   424     .   1   1   26   LYS   HB3    H   5.617     0.304     -1.460    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   425     .   1   1   26   LYS   HD2    H   9.212     1.548     -1.599    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   426     .   1   1   26   LYS   HD3    H   8.508     0.447     -0.422    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   427     .   1   1   26   LYS   HE2    H   9.113     -0.804    -2.385    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   428     .   1   1   26   LYS   HE3    H   7.357     -0.732    -2.288    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   429     .   1   1   26   LYS   HG2    H   6.852     2.138     -2.288    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   430     .   1   1   26   LYS   HG3    H   7.283     2.663     -0.670    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   431     .   1   1   26   LYS   HZ1    H   8.195     -0.326    -4.542    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   432     .   1   1   26   LYS   HZ2    H   9.048     1.016     -3.988    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   433     .   1   1   26   LYS   HZ3    H   7.389     1.041     -3.975    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   434     .   1   1   26   LYS   N      N   3.602     1.143     0.014     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   435     .   1   1   26   LYS   NZ     N   8.209     0.423     -3.821    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   436     .   1   1   26   LYS   O      O   3.694     2.116     -2.584    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   437     .   1   1   27   LYS   C      C   4.942     4.254     -4.172    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   438     .   1   1   27   LYS   CA     C   4.281     4.808     -2.929    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   439     .   1   1   27   LYS   CB     C   4.661     6.274     -2.702    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   440     .   1   1   27   LYS   CD     C   6.394     7.983     -2.113    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   441     .   1   1   27   LYS   CE     C   7.863     8.232     -1.826    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   442     .   1   1   27   LYS   CG     C   6.122     6.512     -2.353    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   443     .   1   1   27   LYS   H      H   5.015     4.414     -0.985    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   444     .   1   1   27   LYS   HA     H   3.222     4.751     -3.120    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   445     .   1   1   27   LYS   HB2    H   4.443     6.821     -3.608    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   446     .   1   1   27   LYS   HB3    H   4.045     6.665     -1.908    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   447     .   1   1   27   LYS   HD2    H   6.102     8.544     -2.987    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   448     .   1   1   27   LYS   HD3    H   5.811     8.313     -1.267    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   449     .   1   1   27   LYS   HE2    H   8.148     7.664     -0.954    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   450     .   1   1   27   LYS   HE3    H   8.442     7.893     -2.671    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   451     .   1   1   27   LYS   HG2    H   6.365     5.956     -1.460    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   452     .   1   1   27   LYS   HG3    H   6.737     6.166     -3.171    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   453     .   1   1   27   LYS   HZ1    H   9.158     9.816     -1.410    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   454     .   1   1   27   LYS   HZ2    H   7.638     10.028    -0.758    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   455     .   1   1   27   LYS   HZ3    H   7.875     10.231    -2.420    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   456     .   1   1   27   LYS   N      N   4.584     3.989     -1.758    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   457     .   1   1   27   LYS   NZ     N   8.146     9.664     -1.591    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   458     .   1   1   27   LYS   O      O   6.083     3.766     -4.130    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   459     .   1   1   28   LYS   C      C   5.669     4.712     -7.145    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   460     .   1   1   28   LYS   CA     C   4.698     3.750     -6.485    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   461     .   1   1   28   LYS   CB     C   3.519     3.385     -7.394    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   462     .   1   1   28   LYS   CD     C   2.650     2.175     -9.385    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   463     .   1   1   28   LYS   CE     C   2.968     1.490     -10.708   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   464     .   1   1   28   LYS   CG     C   3.893     2.682     -8.681    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   465     .   1   1   28   LYS   H      H   3.343     4.735     -5.235    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   466     .   1   1   28   LYS   HA     H   5.236     2.847     -6.237    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   467     .   1   1   28   LYS   HB2    H   2.847     2.743     -6.845    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   468     .   1   1   28   LYS   HB3    H   2.992     4.294     -7.644    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   469     .   1   1   28   LYS   HD2    H   2.148     1.470     -8.740    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   470     .   1   1   28   LYS   HD3    H   1.998     3.014     -9.571    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   471     .   1   1   28   LYS   HE2    H   2.048     1.101     -11.118   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   472     .   1   1   28   LYS   HE3    H   3.379     2.219     -11.387   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   473     .   1   1   28   LYS   HG2    H   4.411     3.374     -9.327    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   474     .   1   1   28   LYS   HG3    H   4.536     1.844     -8.454    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   475     .   1   1   28   LYS   HZ1    H   4.867     0.703     -10.289   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   476     .   1   1   28   LYS   HZ2    H   4.020     -0.120    -11.483   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   477     .   1   1   28   LYS   HZ3    H   3.588     -0.335    -9.879    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   478     .   1   1   28   LYS   N      N   4.225     4.299     -5.257    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   479     .   1   1   28   LYS   NZ     N   3.917     0.368     -10.567   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   480     .   1   1   28   LYS   O      O   5.278     5.707     -7.762    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   481     .   1   1   29   LEU   C      C   8.294     4.730     -8.890    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   482     .   1   1   29   LEU   CA     C   8.003     5.236     -7.487    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   483     .   1   1   29   LEU   CB     C   9.238     5.101     -6.585    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   484     .   1   1   29   LEU   CD1    C   10.153    7.430     -6.809    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   485     .   1   1   29   LEU   CD2    C   11.628    5.572     -6.037    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   486     .   1   1   29   LEU   CG     C   10.463    5.946     -6.934    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   487     .   1   1   29   LEU   H      H   7.144     3.680     -6.362    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   488     .   1   1   29   LEU   HA     H   7.696     6.269     -7.532    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   489     .   1   1   29   LEU   HB2    H   8.939     5.363     -5.581    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   490     .   1   1   29   LEU   HB3    H   9.534     4.063     -6.586    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   491     .   1   1   29   LEU   HD11   H   9.354     7.685     -7.491    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD11   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   492     .   1   1   29   LEU   HD12   H   11.033    8.005     -7.054    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD12   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   493     .   1   1   29   LEU   HD13   H   9.846     7.651     -5.797    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD13   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   494     .   1   1   29   LEU   HD21   H   11.879    4.531     -6.185    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   495     .   1   1   29   LEU   HD22   H   11.352    5.732     -5.007    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   496     .   1   1   29   LEU   HD23   H   12.484    6.185     -6.280    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD23   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   497     .   1   1   29   LEU   HG     H   10.747    5.749     -7.958    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   498     .   1   1   29   LEU   N      N   6.927     4.448     -6.934    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   499     .   1   1   29   LEU   O      O   8.741     5.477     -9.767    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   500     .   1   1   30   TRP   C      C   6.833     2.254     -10.753   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   501     .   1   1   30   TRP   CA     C   8.171     2.823     -10.358   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   502     .   1   1   30   TRP   CB     C   9.218     1.709     -10.251   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   503     .   1   1   30   TRP   CD1    C   10.756    1.539     -12.286   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   504     .   1   1   30   TRP   CD2    C   9.066     0.076     -12.326   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   505     .   1   1   30   TRP   CE2    C   9.850     -0.115    -13.477   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   506     .   1   1   30   TRP   CE3    C   7.946     -0.731    -12.138   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   507     .   1   1   30   TRP   CG     C   9.671     1.142     -11.570   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   508     .   1   1   30   TRP   CH2    C   8.440     -1.853    -14.217   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   509     .   1   1   30   TRP   CZ2    C   9.545     -1.079    -14.431   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   510     .   1   1   30   TRP   CZ3    C   7.642     -1.686    -13.086   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   511     .   1   1   30   TRP   H      H   7.605     2.946     -8.368    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   512     .   1   1   30   TRP   HA     H   8.486     3.559     -11.083   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   513     .   1   1   30   TRP   HB2    H   10.092    2.101     -9.754    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   514     .   1   1   30   TRP   HB3    H   8.810     0.902     -9.661    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   515     .   1   1   30   TRP   HD1    H   11.424    2.331     -11.978   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   516     .   1   1   30   TRP   HE1    H   11.584    0.873     -14.107   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   517     .   1   1   30   TRP   HE3    H   7.319     -0.607    -11.266   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   518     .   1   1   30   TRP   HH2    H   8.164     -2.613    -14.933   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   519     .   1   1   30   TRP   HZ2    H   10.152    -1.224    -15.314   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   520     .   1   1   30   TRP   HZ3    H   6.778     -2.321    -12.955   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   521     .   1   1   30   TRP   N      N   7.993     3.472     -9.098    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   522     .   1   1   30   TRP   NE1    N   10.877    0.784     -13.427   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   NE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   523     .   1   1   30   TRP   O      O   6.402     1.260     -10.141   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   1    .   524     .   1   1   30   TRP   OXT    O   6.183     2.806     -11.660   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   OXT    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   525     .   1   1   1    TYR   C      C   -10.184   -0.141    2.192     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   526     .   1   1   1    TYR   CA     C   -11.033   -0.494    3.392     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   527     .   1   1   1    TYR   CB     C   -10.271   -1.570    4.194     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   528     .   1   1   1    TYR   CD1    C   -11.944   -2.962    5.496     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   529     .   1   1   1    TYR   CD2    C   -10.374   -1.654    6.706     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   530     .   1   1   1    TYR   CE1    C   -12.457   -3.442    6.674     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   531     .   1   1   1    TYR   CE2    C   -10.891   -2.122    7.888     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   532     .   1   1   1    TYR   CG     C   -10.890   -2.055    5.489     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   533     .   1   1   1    TYR   CZ     C   -11.930   -3.017    7.867     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   534     .   1   1   1    TYR   H1     H   -12.940   -1.247    3.717     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   H1     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   535     .   1   1   1    TYR   H2     H   -12.183   -1.824    2.317     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   H2     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   536     .   1   1   1    TYR   H3     H   -12.778   -0.259    2.359     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   H3     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   537     .   1   1   1    TYR   HA     H   -11.186   0.376     4.013     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   538     .   1   1   1    TYR   HB2    H   -10.154   -2.444    3.573     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   539     .   1   1   1    TYR   HB3    H   -9.286    -1.185    4.421     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   540     .   1   1   1    TYR   HD1    H   -12.374   -3.298    4.564     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   541     .   1   1   1    TYR   HD2    H   -9.556    -0.947    6.724     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   542     .   1   1   1    TYR   HE1    H   -13.278   -4.147    6.653     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   543     .   1   1   1    TYR   HE2    H   -10.470   -1.783    8.825     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   544     .   1   1   1    TYR   HH     H   -12.398   -2.825    9.715     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HH     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   545     .   1   1   1    TYR   N      N   -12.318   -0.993    2.928     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   546     .   1   1   1    TYR   O      O   -10.437   -0.620    1.075     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   547     .   1   1   1    TYR   OH     O   -12.424   -3.513    9.038     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   OH     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   548     .   1   1   2    CYS   C      C   -7.015    1.345     2.270     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   549     .   1   1   2    CYS   CA     C   -8.199    0.994     1.453     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   550     .   1   1   2    CYS   CB     C   -8.566    2.164     0.560     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   551     .   1   1   2    CYS   H      H   -9.134    1.150     3.277     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   552     .   1   1   2    CYS   HA     H   -7.990    0.108     0.872     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   553     .   1   1   2    CYS   HB2    H   -9.579    2.056     0.210     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   554     .   1   1   2    CYS   HB3    H   -8.453    3.036     1.182     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   555     .   1   1   2    CYS   N      N   -9.211    0.689     2.413     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   556     .   1   1   2    CYS   O      O   -7.126    2.121     3.235     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   557     .   1   1   2    CYS   SG     S   -7.469    2.391     -0.894    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   558     .   1   1   3    GLN   C      C   -3.999    2.196     2.421     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   559     .   1   1   3    GLN   CA     C   -4.761    0.953     2.768     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   560     .   1   1   3    GLN   CB     C   -3.848    -0.272    2.764     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   561     .   1   1   3    GLN   CD     C   -5.138    -1.558    4.515     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   562     .   1   1   3    GLN   CG     C   -4.534    -1.575    3.130     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   563     .   1   1   3    GLN   H      H   -5.932    0.320     1.082     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   564     .   1   1   3    GLN   HA     H   -5.157    1.079     3.762     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   565     .   1   1   3    GLN   HB2    H   -3.352    -0.381    1.814     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   566     .   1   1   3    GLN   HB3    H   -3.082    -0.095    3.505     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   567     .   1   1   3    GLN   HE21   H   -3.426    -2.179    5.301     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HE21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   568     .   1   1   3    GLN   HE22   H   -4.738    -1.949    6.398     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HE22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   569     .   1   1   3    GLN   HG2    H   -5.324    -1.764    2.418     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   570     .   1   1   3    GLN   HG3    H   -3.810    -2.375    3.081     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   571     .   1   1   3    GLN   N      N   -5.921    0.796     1.938     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   572     .   1   1   3    GLN   NE2    N   -4.357    -1.923    5.495     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   NE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   573     .   1   1   3    GLN   O      O   -3.732    2.472     1.254     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   574     .   1   1   3    GLN   OE1    O   -6.291    -1.205    4.701     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   OE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   575     .   1   1   4    LYS   C      C   -1.469    3.868     3.396     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   576     .   1   1   4    LYS   CA     C   -2.948    4.170     3.310     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   577     .   1   1   4    LYS   CB     C   -3.332    5.123     4.442     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   578     .   1   1   4    LYS   CD     C   -5.263    6.313     3.300     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   579     .   1   1   4    LYS   CE     C   -4.639    7.703     3.299     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   580     .   1   1   4    LYS   CG     C   -4.808    5.477     4.493     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   581     .   1   1   4    LYS   H      H   -3.969    2.654     4.329     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   582     .   1   1   4    LYS   HA     H   -3.179    4.634     2.363     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   583     .   1   1   4    LYS   HB2    H   -3.072    4.647     5.376     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   584     .   1   1   4    LYS   HB3    H   -2.756    6.030     4.338     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   585     .   1   1   4    LYS   HD2    H   -4.991    5.809     2.387     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   586     .   1   1   4    LYS   HD3    H   -6.337    6.415     3.343     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   587     .   1   1   4    LYS   HE2    H   -3.566    7.597     3.293     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   588     .   1   1   4    LYS   HE3    H   -4.949    8.223     2.406     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   589     .   1   1   4    LYS   HG2    H   -5.339    4.538     4.463     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   590     .   1   1   4    LYS   HG3    H   -5.027    5.996     5.416     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   591     .   1   1   4    LYS   HZ1    H   -4.611    9.451     4.457     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   592     .   1   1   4    LYS   HZ2    H   -4.679    8.046     5.356     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   593     .   1   1   4    LYS   HZ3    H   -6.060    8.581     4.568     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   594     .   1   1   4    LYS   N      N   -3.688    2.948     3.439     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   595     .   1   1   4    LYS   NZ     N   -5.027    8.499     4.487     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   596     .   1   1   4    LYS   O      O   -1.075    2.776     3.817     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   597     .   1   1   5    TRP   C      C   1.338     4.561     4.518     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   598     .   1   1   5    TRP   CA     C   0.812     4.679     3.092     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   599     .   1   1   5    TRP   CB     C   1.533     5.839     2.364     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   600     .   1   1   5    TRP   CD1    C   0.679     8.010     3.463     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   601     .   1   1   5    TRP   CD2    C   2.864     7.638     3.755     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   602     .   1   1   5    TRP   CE2    C   2.530     8.839     4.395     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   603     .   1   1   5    TRP   CE3    C   4.189     7.199     3.805     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   604     .   1   1   5    TRP   CG     C   1.660     7.117     3.163     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   605     .   1   1   5    TRP   CH2    C   4.754     9.149     5.107     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   606     .   1   1   5    TRP   CZ2    C   3.471     9.605     5.076     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   607     .   1   1   5    TRP   CZ3    C   5.118     7.961     4.480     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   608     .   1   1   5    TRP   H      H   -1.056    5.722     2.875     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   609     .   1   1   5    TRP   HA     H   1.019     3.753     2.576     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   610     .   1   1   5    TRP   HB2    H   2.532     5.519     2.110     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   611     .   1   1   5    TRP   HB3    H   0.995     6.062     1.455     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   612     .   1   1   5    TRP   HD1    H   -0.353    7.905     3.165     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   613     .   1   1   5    TRP   HE1    H   0.678     9.812     4.548     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   614     .   1   1   5    TRP   HE3    H   4.491     6.281     3.323     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   615     .   1   1   5    TRP   HH2    H   5.514     9.716     5.626     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   616     .   1   1   5    TRP   HZ2    H   3.219     10.531    5.570     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   617     .   1   1   5    TRP   HZ3    H   6.147     7.637     4.533     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   618     .   1   1   5    TRP   N      N   -0.651    4.859     3.101     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   619     .   1   1   5    TRP   NE1    N   1.193     9.045     4.208     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   NE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   620     .   1   1   5    TRP   O      O   2.491     4.212     4.746     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   621     .   1   1   6    MET   C      C   0.549     3.384     7.391     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   622     .   1   1   6    MET   CA     C   0.839     4.790     6.861     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   623     .   1   1   6    MET   CB     C   0.068     5.835     7.682     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   624     .   1   1   6    MET   CE     C   -1.678    6.630     10.248    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   625     .   1   1   6    MET   CG     C   -1.441    5.635     7.672     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   626     .   1   1   6    MET   H      H   -0.404    5.178     5.195     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   627     .   1   1   6    MET   HA     H   1.895     5.001     6.925     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   628     .   1   1   6    MET   HB2    H   0.409     5.785     8.704     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   629     .   1   1   6    MET   HB3    H   0.284     6.817     7.288     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   630     .   1   1   6    MET   HE1    H   -0.623    6.858     10.236    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   631     .   1   1   6    MET   HE2    H   -1.818    5.600     10.540    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   632     .   1   1   6    MET   HE3    H   -2.181    7.279     10.950    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   633     .   1   1   6    MET   HG2    H   -1.779    5.667     6.647     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   634     .   1   1   6    MET   HG3    H   -1.660    4.660     8.083     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   635     .   1   1   6    MET   N      N   0.487     4.874     5.464     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   636     .   1   1   6    MET   O      O   0.868     3.059     8.529     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   637     .   1   1   6    MET   SD     S   -2.348    6.880     8.608     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   SD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   638     .   1   1   7    TRP   C      C   0.330     0.203     6.096     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   639     .   1   1   7    TRP   CA     C   -0.416    1.203     6.955     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   640     .   1   1   7    TRP   CB     C   -1.930    0.942     6.826     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   641     .   1   1   7    TRP   CD1    C   -2.512    2.517     8.766     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   642     .   1   1   7    TRP   CD2    C   -4.166    2.176     7.320     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   643     .   1   1   7    TRP   CE2    C   -4.617    3.067     8.301     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   644     .   1   1   7    TRP   CE3    C   -5.030    1.800     6.310     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   645     .   1   1   7    TRP   CG     C   -2.813    1.859     7.616     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   646     .   1   1   7    TRP   CH2    C   -6.732    3.198     7.279     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   647     .   1   1   7    TRP   CZ2    C   -5.903    3.589     8.291     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   648     .   1   1   7    TRP   CZ3    C   -6.305    2.310     6.296     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   649     .   1   1   7    TRP   H      H   -0.266    2.831     5.642     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   650     .   1   1   7    TRP   HA     H   -0.123    1.067     7.986     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   651     .   1   1   7    TRP   HB2    H   -2.211    1.047     5.788     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   652     .   1   1   7    TRP   HB3    H   -2.138    -0.072    7.135     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   653     .   1   1   7    TRP   HD1    H   -1.549    2.471     9.257     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   654     .   1   1   7    TRP   HE1    H   -3.615    3.847     9.963     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   655     .   1   1   7    TRP   HE3    H   -4.703    1.103     5.555     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   656     .   1   1   7    TRP   HH2    H   -7.743    3.574     7.228     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   657     .   1   1   7    TRP   HZ2    H   -6.254    4.281     9.043     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   658     .   1   1   7    TRP   HZ3    H   -6.990    2.024     5.509     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   659     .   1   1   7    TRP   N      N   -0.063    2.554     6.561     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   660     .   1   1   7    TRP   NE1    N   -3.587    3.267     9.169     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   NE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   661     .   1   1   7    TRP   O      O   1.192     0.570     5.282     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   662     .   1   1   8    THR   C      C   -0.506    -2.891    4.844     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   663     .   1   1   8    THR   CA     C   0.614     -2.123    5.555     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   664     .   1   1   8    THR   CB     C   1.327     -3.058    6.566     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   665     .   1   1   8    THR   CG2    C   2.447     -2.329    7.300     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   CG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   666     .   1   1   8    THR   H      H   -0.677    -1.285    6.935     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   667     .   1   1   8    THR   HA     H   1.332     -1.718    4.857     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   668     .   1   1   8    THR   HB     H   1.740     -3.901    6.033     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   669     .   1   1   8    THR   HG1    H   0.314     -4.489    7.434     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HG1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   670     .   1   1   8    THR   HG21   H   2.929     -3.010    7.984     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HG21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   671     .   1   1   8    THR   HG22   H   2.026     -1.502    7.853     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HG22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   672     .   1   1   8    THR   HG23   H   3.169     -1.953    6.592     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HG23   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   673     .   1   1   8    THR   N      N   0.010     -1.042    6.276     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   674     .   1   1   8    THR   O      O   -1.683    -2.731    5.226     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   675     .   1   1   8    THR   OG1    O   0.376     -3.531    7.539     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   OG1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   676     .   1   1   9    CYS   C      C   -1.056    -5.932    3.328     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   677     .   1   1   9    CYS   CA     C   -1.305    -4.455    3.264     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   678     .   1   1   9    CYS   CB     C   -1.722    -3.980    1.852     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   679     .   1   1   9    CYS   H      H   0.683     -3.843    3.455     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   680     .   1   1   9    CYS   HA     H   -2.137    -4.273    3.934     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   681     .   1   1   9    CYS   HB2    H   -2.410    -4.707    1.447     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   682     .   1   1   9    CYS   HB3    H   -2.235    -3.031    1.901     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   683     .   1   1   9    CYS   N      N   -0.220    -3.698    3.833     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   684     .   1   1   9    CYS   O      O   0.073     -6.403    3.198     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   685     .   1   1   9    CYS   SG     S   -0.379    -3.827    0.649     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   686     .   1   1   10   ASP   C      C   -2.559    -8.563    2.305     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   687     .   1   1   10   ASP   CA     C   -2.087    -8.079    3.660     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   688     .   1   1   10   ASP   CB     C   -3.015    -8.582    4.783     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   689     .   1   1   10   ASP   CG     C   -2.600    -8.085    6.163     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   690     .   1   1   10   ASP   H      H   -2.929    -6.192    3.863     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   691     .   1   1   10   ASP   HA     H   -1.075    -8.416    3.838     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   692     .   1   1   10   ASP   HB2    H   -4.022    -8.246    4.588     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   693     .   1   1   10   ASP   HB3    H   -3.000    -9.661    4.791     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   694     .   1   1   10   ASP   N      N   -2.096    -6.643    3.624     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   695     .   1   1   10   ASP   O      O   -2.731    -7.741    1.392     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   696     .   1   1   10   ASP   OD1    O   -2.003    -8.854    6.934     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   OD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   697     .   1   1   10   ASP   OD2    O   -2.835    -6.899    6.491     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   OD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   698     .   1   1   11   SER   C      C   -4.533    -9.853    0.403     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   699     .   1   1   11   SER   CA     C   -3.182    -10.406   0.888     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   700     .   1   1   11   SER   CB     C   -3.243    -11.915   1.017     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   701     .   1   1   11   SER   H      H   -2.748    -10.443   2.936     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   702     .   1   1   11   SER   HA     H   -2.417    -10.151   0.171     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   703     .   1   1   11   SER   HB2    H   -4.121    -12.201   1.576     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   704     .   1   1   11   SER   HB3    H   -3.292    -12.350   0.030     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   705     .   1   1   11   SER   HG     H   -2.401    -13.106   2.266     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   HG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   706     .   1   1   11   SER   N      N   -2.810    -9.838    2.168     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   707     .   1   1   11   SER   O      O   -4.670    -9.427    -0.755    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   708     .   1   1   11   SER   OG     O   -2.079    -12.414   1.675     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   OG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   709     .   1   1   12   GLU   C      C   -6.977    -7.831    1.179     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   710     .   1   1   12   GLU   CA     C   -6.827    -9.316    0.930     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   711     .   1   1   12   GLU   CB     C   -7.913    -10.094   1.652     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   712     .   1   1   12   GLU   CD     C   -8.297    -11.718   -0.199    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   713     .   1   1   12   GLU   CG     C   -7.984    -11.547   1.260     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   714     .   1   1   12   GLU   H      H   -5.344    -10.106   2.214     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   715     .   1   1   12   GLU   HA     H   -6.939    -9.485    -0.132    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   716     .   1   1   12   GLU   HB2    H   -7.721    -10.046   2.712     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   717     .   1   1   12   GLU   HB3    H   -8.870    -9.637    1.444     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   718     .   1   1   12   GLU   HG2    H   -7.018    -11.987   1.459     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   719     .   1   1   12   GLU   HG3    H   -8.741    -12.040   1.849     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   720     .   1   1   12   GLU   N      N   -5.507    -9.798    1.295     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   721     .   1   1   12   GLU   O      O   -8.030    -7.250    0.911     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   722     .   1   1   12   GLU   OE1    O   -9.471    -11.517   -0.601    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   OE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   723     .   1   1   12   GLU   OE2    O   -7.391    -12.060   -0.979    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   OE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   724     .   1   1   13   ARG   C      C   -5.609    -5.078    0.647     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   725     .   1   1   13   ARG   CA     C   -6.009    -5.785    1.900     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   726     .   1   1   13   ARG   CB     C   -5.166    -5.284    3.062     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   727     .   1   1   13   ARG   CD     C   -7.085    -5.362    4.719     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   728     .   1   1   13   ARG   CG     C   -5.618    -5.688    4.460     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   729     .   1   1   13   ARG   CZ     C   -9.276    -6.395    4.132     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   CZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   730     .   1   1   13   ARG   H      H   -5.141    -7.728    1.896     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   731     .   1   1   13   ARG   HA     H   -7.046    -5.550    2.091     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   732     .   1   1   13   ARG   HB2    H   -4.171    -5.671    2.916     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   733     .   1   1   13   ARG   HB3    H   -5.126    -4.206    3.013     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   734     .   1   1   13   ARG   HD2    H   -7.225    -5.188    5.773     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   735     .   1   1   13   ARG   HD3    H   -7.347    -4.471    4.169     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   736     .   1   1   13   ARG   HE     H   -7.484    -7.317    4.194     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   737     .   1   1   13   ARG   HG2    H   -5.489    -6.753    4.560     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   738     .   1   1   13   ARG   HG3    H   -5.006    -5.171    5.183     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   739     .   1   1   13   ARG   HH11   H   -9.394    -4.375    4.331     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HH11   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   740     .   1   1   13   ARG   HH12   H   -10.892   -5.164    4.065     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HH12   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   741     .   1   1   13   ARG   HH21   H   -9.543    -8.421    3.867     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HH21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   742     .   1   1   13   ARG   HH22   H   -10.969   -7.507    3.784     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HH22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   743     .   1   1   13   ARG   N      N   -5.949    -7.209    1.697     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   744     .   1   1   13   ARG   NE     N   -7.957    -6.458    4.293     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   NE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   745     .   1   1   13   ARG   NH1    N   -9.897    -5.226    4.179     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   NH1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   746     .   1   1   13   ARG   NH2    N   -9.973    -7.514    3.911     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   NH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   747     .   1   1   13   ARG   O      O   -4.484    -5.219    0.156     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   748     .   1   1   14   LYS   C      C   -5.798    -2.229    -0.723    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   749     .   1   1   14   LYS   CA     C   -6.305    -3.606    -1.072    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   750     .   1   1   14   LYS   CB     C   -7.590    -3.550    -1.899    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   751     .   1   1   14   LYS   CD     C   -9.429    -4.897    -3.042    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   752     .   1   1   14   LYS   CE     C   -9.311    -4.211    -4.394    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   753     .   1   1   14   LYS   CG     C   -8.103    -4.939    -2.291    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   754     .   1   1   14   LYS   H      H   -7.374    -4.291    0.599     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   755     .   1   1   14   LYS   HA     H   -5.538    -4.115    -1.636    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   756     .   1   1   14   LYS   HB2    H   -8.351    -3.051    -1.317    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   757     .   1   1   14   LYS   HB3    H   -7.406    -2.986    -2.800    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   758     .   1   1   14   LYS   HD2    H   -9.763    -5.911    -3.199    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   759     .   1   1   14   LYS   HD3    H   -10.156   -4.370    -2.440    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   760     .   1   1   14   LYS   HE2    H   -9.028    -3.181    -4.241    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   761     .   1   1   14   LYS   HE3    H   -8.551    -4.711    -4.974    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   762     .   1   1   14   LYS   HG2    H   -7.367    -5.410    -2.926    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   763     .   1   1   14   LYS   HG3    H   -8.222    -5.528    -1.395    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   764     .   1   1   14   LYS   HZ1    H   -10.871   -5.238    -5.306    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   765     .   1   1   14   LYS   HZ2    H   -10.491   -3.787    -6.066    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   766     .   1   1   14   LYS   HZ3    H   -11.351   -3.777    -4.609    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   767     .   1   1   14   LYS   N      N   -6.517    -4.346    0.128     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   768     .   1   1   14   LYS   NZ     N   -10.592   -4.250    -5.139    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   769     .   1   1   14   LYS   O      O   -6.510    -1.408    -0.122    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   770     .   1   1   15   CYS   C      C   -4.316    0.240     -1.841    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   771     .   1   1   15   CYS   CA     C   -3.901    -0.757    -0.770    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   772     .   1   1   15   CYS   CB     C   -2.381    -0.973    -0.731    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   773     .   1   1   15   CYS   H      H   -4.056    -2.722    -1.484    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   774     .   1   1   15   CYS   HA     H   -4.249    -0.392    0.183     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   775     .   1   1   15   CYS   HB2    H   -2.164    -1.835    -0.119    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   776     .   1   1   15   CYS   HB3    H   -2.034    -1.164    -1.736    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   777     .   1   1   15   CYS   N      N   -4.557    -2.008    -1.040    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   778     .   1   1   15   CYS   O      O   -4.673    -0.172    -2.962    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   779     .   1   1   15   CYS   SG     S   -1.423    0.415     -0.067    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   780     .   1   1   16   CYS   C      C   -3.985    2.633     -3.719    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   781     .   1   1   16   CYS   CA     C   -4.792    2.542     -2.420    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   782     .   1   1   16   CYS   CB     C   -4.912    3.882     -1.700    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   783     .   1   1   16   CYS   H      H   -3.955    1.799     -0.641    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   784     .   1   1   16   CYS   HA     H   -5.786    2.226     -2.700    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   785     .   1   1   16   CYS   HB2    H   -3.956    4.138     -1.266    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   786     .   1   1   16   CYS   HB3    H   -5.202    4.644     -2.408    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   787     .   1   1   16   CYS   N      N   -4.309    1.510     -1.514    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   788     .   1   1   16   CYS   O      O   -2.777    2.352     -3.753    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   789     .   1   1   16   CYS   SG     S   -6.163    3.863     -0.349    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   790     .   1   1   17   LYS   C      C   -3.047    4.147     -6.195    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   791     .   1   1   17   LYS   CA     C   -4.072    3.028     -6.105    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   792     .   1   1   17   LYS   CB     C   -5.149    3.150     -7.188    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   793     .   1   1   17   LYS   CD     C   -5.754    3.051     -9.609    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   794     .   1   1   17   LYS   CE     C   -5.247    2.868     -11.026   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   795     .   1   1   17   LYS   CG     C   -4.620    3.075     -8.612    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   796     .   1   1   17   LYS   H      H   -5.614    3.247     -4.701    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   797     .   1   1   17   LYS   HA     H   -3.554    2.090     -6.238    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   798     .   1   1   17   LYS   HB2    H   -5.863    2.351     -7.053    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   799     .   1   1   17   LYS   HB3    H   -5.661    4.094     -7.063    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   800     .   1   1   17   LYS   HD2    H   -6.415    2.235     -9.363    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   801     .   1   1   17   LYS   HD3    H   -6.297    3.983     -9.546    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   802     .   1   1   17   LYS   HE2    H   -4.703    3.752     -11.320   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   803     .   1   1   17   LYS   HE3    H   -4.586    2.014     -11.051   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   804     .   1   1   17   LYS   HG2    H   -3.997    3.936     -8.804    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   805     .   1   1   17   LYS   HG3    H   -4.037    2.174     -8.720    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   806     .   1   1   17   LYS   HZ1    H   -6.892    1.799     -11.703   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   807     .   1   1   17   LYS   HZ2    H   -5.979    2.528     -12.934   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   808     .   1   1   17   LYS   HZ3    H   -7.004    3.461     -11.966   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   809     .   1   1   17   LYS   N      N   -4.671    2.985     -4.794    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   810     .   1   1   17   LYS   NZ     N   -6.355    2.648     -11.973   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   811     .   1   1   17   LYS   O      O   -3.328    5.300     -5.863    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   812     .   1   1   18   GLY   C      C   0.284     4.302     -5.711    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   813     .   1   1   18   GLY   CA     C   -0.776    4.730     -6.690    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   814     .   1   1   18   GLY   H      H   -1.746    2.877     -6.960    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   815     .   1   1   18   GLY   HA2    H   -0.364    4.749     -7.690    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   HA2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   816     .   1   1   18   GLY   HA3    H   -1.125    5.715     -6.422    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   HA3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   817     .   1   1   18   GLY   N      N   -1.877    3.798     -6.646    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   818     .   1   1   18   GLY   O      O   1.446     4.714     -5.793    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   819     .   1   1   19   MET   C      C   1.088     1.457     -4.270    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   820     .   1   1   19   MET   CA     C   0.774     2.860     -3.837    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   821     .   1   1   19   MET   CB     C   0.104     2.820     -2.456    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   822     .   1   1   19   MET   CE     C   -1.469    5.858     -0.121    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   823     .   1   1   19   MET   CG     C   -0.198    4.179     -1.883    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   824     .   1   1   19   MET   H      H   -1.051    3.151     -4.797    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   825     .   1   1   19   MET   HA     H   1.678     3.447     -3.783    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   826     .   1   1   19   MET   HB2    H   -0.826    2.276     -2.540    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   827     .   1   1   19   MET   HB3    H   0.754     2.296     -1.771    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   828     .   1   1   19   MET   HE1    H   -2.035    6.241     -0.957    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   829     .   1   1   19   MET   HE2    H   -0.528    6.384     -0.056    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   830     .   1   1   19   MET   HE3    H   -2.029    6.001     0.791     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   831     .   1   1   19   MET   HG2    H   0.761     4.600     -1.625    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   832     .   1   1   19   MET   HG3    H   -0.703    4.790     -2.617    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   833     .   1   1   19   MET   N      N   -0.112    3.435     -4.813    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   834     .   1   1   19   MET   O      O   0.352     0.869     -5.078    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   835     .   1   1   19   MET   SD     S   -1.166    4.116     -0.369    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   SD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   836     .   1   1   20   VAL   C      C   2.206     -1.270    -2.886    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   837     .   1   1   20   VAL   CA     C   2.502     -0.427    -4.088    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   838     .   1   1   20   VAL   CB     C   3.997     -0.569    -4.501    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   839     .   1   1   20   VAL   CG1    C   4.370     -2.035    -4.715    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   CG1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   840     .   1   1   20   VAL   CG2    C   4.262     0.211     -5.777    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   CG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   841     .   1   1   20   VAL   H      H   2.702     1.449     -3.161    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   842     .   1   1   20   VAL   HA     H   1.872     -0.748    -4.906    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   843     .   1   1   20   VAL   HB     H   4.619     -0.161    -3.717    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   844     .   1   1   20   VAL   HG11   H   3.756     -2.451    -5.499    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG11   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   845     .   1   1   20   VAL   HG12   H   4.204     -2.586    -3.799    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG12   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   846     .   1   1   20   VAL   HG13   H   5.410     -2.108    -4.995    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG13   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   847     .   1   1   20   VAL   HG21   H   5.312     0.157     -6.025    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   848     .   1   1   20   VAL   HG22   H   3.962     1.238     -5.645    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   849     .   1   1   20   VAL   HG23   H   3.684     -0.223    -6.579    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG23   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   850     .   1   1   20   VAL   N      N   2.144     0.921     -3.777    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   851     .   1   1   20   VAL   O      O   2.674     -0.975    -1.775    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   852     .   1   1   21   CYS   C      C   2.114     -4.112    -1.783    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   853     .   1   1   21   CYS   CA     C   0.988     -3.138    -2.038    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   854     .   1   1   21   CYS   CB     C   -0.311    -3.878    -2.392    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   855     .   1   1   21   CYS   H      H   1.030     -2.408    -3.994    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   856     .   1   1   21   CYS   HA     H   0.829     -2.546    -1.149    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   857     .   1   1   21   CYS   HB2    H   -1.045    -3.160    -2.731    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   858     .   1   1   21   CYS   HB3    H   -0.111    -4.579    -3.187    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   859     .   1   1   21   CYS   N      N   1.378     -2.259    -3.090    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   860     .   1   1   21   CYS   O      O   2.680     -4.695    -2.720    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   861     .   1   1   21   CYS   SG     S   -1.055    -4.806    -1.000    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   862     .   1   1   22   ARG   C      C   3.243     -5.355    1.349     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   863     .   1   1   22   ARG   CA     C   3.520     -5.087    -0.129    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   864     .   1   1   22   ARG   CB     C   4.847     -4.299    -0.302    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   865     .   1   1   22   ARG   CD     C   6.286     -5.768    -1.805    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   866     .   1   1   22   ARG   CG     C   6.137     -5.114    -0.427    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   867     .   1   1   22   ARG   CZ     C   5.245     -7.546    -3.190    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   CZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   868     .   1   1   22   ARG   H      H   1.966     -3.789    0.163     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   869     .   1   1   22   ARG   HA     H   3.534     -5.995    -0.709    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   870     .   1   1   22   ARG   HB2    H   4.764     -3.692    -1.192    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   871     .   1   1   22   ARG   HB3    H   4.947     -3.635    0.545     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   872     .   1   1   22   ARG   HD2    H   6.155     -5.001    -2.555    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   873     .   1   1   22   ARG   HD3    H   7.279     -6.178    -1.893    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   874     .   1   1   22   ARG   HE     H   4.673     -7.016    -1.348    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   875     .   1   1   22   ARG   HG2    H   6.978     -4.454    -0.271    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   876     .   1   1   22   ARG   HG3    H   6.149     -5.883    0.331     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   877     .   1   1   22   ARG   HH11   H   6.826     -6.628    -4.115    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HH11   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   878     .   1   1   22   ARG   HH12   H   6.100     -7.871    -5.022    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HH12   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   879     .   1   1   22   ARG   HH21   H   3.647     -8.684    -2.589    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HH21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   880     .   1   1   22   ARG   HH22   H   4.253     -9.073    -4.127    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HH22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   881     .   1   1   22   ARG   N      N   2.457     -4.254    -0.550    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   882     .   1   1   22   ARG   NE     N   5.305     -6.823    -2.075    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   NE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   883     .   1   1   22   ARG   NH1    N   6.112     -7.331    -4.177    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   NH1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   884     .   1   1   22   ARG   NH2    N   4.319     -8.492    -3.311    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   NH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   885     .   1   1   22   ARG   O      O   2.147     -4.969    1.861     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   886     .   1   1   23   LEU   C      C   3.801     -4.872    4.219     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   887     .   1   1   23   LEU   CA     C   4.129     -6.184    3.497     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   888     .   1   1   23   LEU   CB     C   5.452     -6.764    4.023     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   889     .   1   1   23   LEU   CD1    C   7.225     -8.544    3.994     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   890     .   1   1   23   LEU   CD2    C   4.832     -9.188    3.715     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   891     .   1   1   23   LEU   CG     C   5.880     -8.118    3.439     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   892     .   1   1   23   LEU   H      H   4.957     -6.351    1.553     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   893     .   1   1   23   LEU   HA     H   3.333     -6.888    3.684     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   894     .   1   1   23   LEU   HB2    H   6.237     -6.051    3.817     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   895     .   1   1   23   LEU   HB3    H   5.366     -6.875    5.093     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   896     .   1   1   23   LEU   HD11   H   7.968     -7.799    3.749     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD11   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   897     .   1   1   23   LEU   HD12   H   7.508     -9.490    3.560     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD12   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   898     .   1   1   23   LEU   HD13   H   7.155     -8.645    5.066     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD13   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   899     .   1   1   23   LEU   HD21   H   3.897     -8.911    3.248     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   900     .   1   1   23   LEU   HD22   H   4.689     -9.283    4.780     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   901     .   1   1   23   LEU   HD23   H   5.167     -10.131   3.311     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD23   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   902     .   1   1   23   LEU   HG     H   5.994     -8.021    2.371     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   903     .   1   1   23   LEU   N      N   4.201     -5.967    2.044     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   904     .   1   1   23   LEU   O      O   3.265     -4.876    5.317     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   905     .   1   1   24   TRP   C      C   3.273     -1.699    2.758     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   906     .   1   1   24   TRP   CA     C   3.776     -2.454    4.003     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   907     .   1   1   24   TRP   CB     C   4.996     -1.733    4.616     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   908     .   1   1   24   TRP   CD1    C   6.122     -0.009    3.127     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   909     .   1   1   24   TRP   CD2    C   7.043     -2.035    2.970     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   910     .   1   1   24   TRP   CE2    C   7.733     -1.162    2.107     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   911     .   1   1   24   TRP   CE3    C   7.445     -3.369    3.038     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   912     .   1   1   24   TRP   CG     C   6.014     -1.265    3.615     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   913     .   1   1   24   TRP   CH2    C   9.171     -2.892    1.406     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   914     .   1   1   24   TRP   CZ2    C   8.800     -1.579    1.319     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   915     .   1   1   24   TRP   CZ3    C   8.505     -3.785    2.257     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   916     .   1   1   24   TRP   H      H   4.602     -3.837    2.715     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   917     .   1   1   24   TRP   HA     H   2.992     -2.561    4.735     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   918     .   1   1   24   TRP   HB2    H   4.657     -0.868    5.165     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   919     .   1   1   24   TRP   HB3    H   5.486     -2.408    5.302     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   920     .   1   1   24   TRP   HD1    H   5.464     0.793     3.436     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   921     .   1   1   24   TRP   HE1    H   7.414     0.889     1.752     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   922     .   1   1   24   TRP   HE3    H   6.942     -4.065    3.693     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   923     .   1   1   24   TRP   HH2    H   9.994     -3.259    0.812     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   924     .   1   1   24   TRP   HZ2    H   9.328     -0.909    0.656     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   925     .   1   1   24   TRP   HZ3    H   8.832     -4.814    2.292     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   926     .   1   1   24   TRP   N      N   4.125     -3.765    3.568     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   927     .   1   1   24   TRP   NE1    N   7.152     0.070     2.228     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   NE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   928     .   1   1   24   TRP   O      O   3.559     -2.128    1.642     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   929     .   1   1   25   CYS   C      C   3.177     1.182     1.464     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   930     .   1   1   25   CYS   CA     C   2.123     0.156     1.773     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   931     .   1   1   25   CYS   CB     C   0.763     0.817     1.951     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   932     .   1   1   25   CYS   H      H   2.214     -0.363    3.814     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   933     .   1   1   25   CYS   HA     H   2.077     -0.523    0.934     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   934     .   1   1   25   CYS   HB2    H   0.686     1.201     2.957     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   935     .   1   1   25   CYS   HB3    H   0.677     1.636     1.253     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   936     .   1   1   25   CYS   N      N   2.516     -0.643    2.923     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   937     .   1   1   25   CYS   O      O   3.633     1.917     2.357     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   938     .   1   1   25   CYS   SG     S   -0.645    -0.292    1.681     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   939     .   1   1   26   LYS   C      C   4.002     3.128     -1.143    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   940     .   1   1   26   LYS   CA     C   4.611     2.109     -0.215    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   941     .   1   1   26   LYS   CB     C   5.684     1.284     -0.941    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   942     .   1   1   26   LYS   CD     C   7.864     1.196     -2.163    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   943     .   1   1   26   LYS   CE     C   9.037     1.994     -2.711    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   944     .   1   1   26   LYS   CG     C   6.859     2.089     -1.462    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   945     .   1   1   26   LYS   H      H   3.116     0.681     -0.446    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   946     .   1   1   26   LYS   HA     H   5.053     2.597     0.640     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   947     .   1   1   26   LYS   HB2    H   6.067     0.540     -0.260    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   948     .   1   1   26   LYS   HB3    H   5.220     0.782     -1.776    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   949     .   1   1   26   LYS   HD2    H   8.238     0.468     -1.458    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   950     .   1   1   26   LYS   HD3    H   7.373     0.686     -2.979    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   951     .   1   1   26   LYS   HE2    H   9.698     1.326     -3.243    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   952     .   1   1   26   LYS   HE3    H   8.653     2.732     -3.398    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   953     .   1   1   26   LYS   HG2    H   6.497     2.829     -2.161    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   954     .   1   1   26   LYS   HG3    H   7.342     2.580     -0.632    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   955     .   1   1   26   LYS   HZ1    H   9.213     3.373     -1.133    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   956     .   1   1   26   LYS   HZ2    H   10.625    3.185     -2.021    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   957     .   1   1   26   LYS   HZ3    H   10.149    1.995     -0.947    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   958     .   1   1   26   LYS   N      N   3.571     1.234     0.228     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   959     .   1   1   26   LYS   NZ     N   9.798     2.681     -1.643    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   960     .   1   1   26   LYS   O      O   3.375     2.760     -2.130    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   961     .   1   1   27   LYS   C      C   4.488     5.719     -2.821    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   962     .   1   1   27   LYS   CA     C   3.579     5.437     -1.635    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   963     .   1   1   27   LYS   CB     C   3.354     6.718     -0.806    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   964     .   1   1   27   LYS   CD     C   4.295     8.728     0.355     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   965     .   1   1   27   LYS   CE     C   5.489     9.661     0.438     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   966     .   1   1   27   LYS   CG     C   4.613     7.497     -0.468    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   967     .   1   1   27   LYS   H      H   4.735     4.622     -0.063    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   968     .   1   1   27   LYS   HA     H   2.634     5.081     -2.010    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   969     .   1   1   27   LYS   HB2    H   2.704     7.380     -1.356    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   970     .   1   1   27   LYS   HB3    H   2.869     6.447     0.119     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   971     .   1   1   27   LYS   HD2    H   3.471     9.255     -0.106    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   972     .   1   1   27   LYS   HD3    H   4.015     8.422     1.352     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   973     .   1   1   27   LYS   HE2    H   5.696     10.039    -0.551    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   974     .   1   1   27   LYS   HE3    H   5.238     10.486    1.088     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   975     .   1   1   27   LYS   HG2    H   5.277     6.865     0.100     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   976     .   1   1   27   LYS   HG3    H   5.097     7.801     -1.386    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   977     .   1   1   27   LYS   HZ1    H   6.571     8.598     1.902     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   978     .   1   1   27   LYS   HZ2    H   7.490     9.670     0.981     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   979     .   1   1   27   LYS   HZ3    H   7.008     8.227     0.319     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   980     .   1   1   27   LYS   N      N   4.167     4.390     -0.831    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   981     .   1   1   27   LYS   NZ     N   6.700     8.993     0.950     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   982     .   1   1   27   LYS   O      O   5.615     5.182     -2.892    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   983     .   1   1   28   LYS   C      C   5.993     7.759     -4.471    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   984     .   1   1   28   LYS   CA     C   4.826     6.865     -4.900    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   985     .   1   1   28   LYS   CB     C   3.973     7.475     -6.014    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   986     .   1   1   28   LYS   CD     C   2.247     9.092     -6.713    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   987     .   1   1   28   LYS   CE     C   1.670     10.473    -6.536    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   988     .   1   1   28   LYS   CG     C   3.311     8.787     -5.688    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   989     .   1   1   28   LYS   H      H   3.101     6.855     -3.667    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   990     .   1   1   28   LYS   HA     H   5.251     5.939     -5.253    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   991     .   1   1   28   LYS   HB2    H   4.604     7.630     -6.876    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   992     .   1   1   28   LYS   HB3    H   3.206     6.763     -6.279    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   993     .   1   1   28   LYS   HD2    H   2.676     9.004     -7.699    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   994     .   1   1   28   LYS   HD3    H   1.456     8.364     -6.610    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   995     .   1   1   28   LYS   HE2    H   0.764     10.552    -7.117    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   996     .   1   1   28   LYS   HE3    H   1.449     10.567    -5.484    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   997     .   1   1   28   LYS   HG2    H   2.861     8.724     -4.708    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   998     .   1   1   28   LYS   HG3    H   4.052     9.574     -5.702    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   999     .   1   1   28   LYS   HZ1    H   2.928     11.414    -7.915    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   1000    .   1   1   28   LYS   HZ2    H   3.457     11.588    -6.312    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   1001    .   1   1   28   LYS   HZ3    H   2.144     12.470    -6.871    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   1002    .   1   1   28   LYS   N      N   4.017     6.511     -3.755    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   1003    .   1   1   28   LYS   NZ     N   2.614     11.543    -6.930    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   1004    .   1   1   28   LYS   O      O   5.916     8.428     -3.418    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   1005    .   1   1   29   LEU   C      C   8.091     9.916     -4.628    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   1006    .   1   1   29   LEU   CA     C   8.312     8.438     -4.942    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   1007    .   1   1   29   LEU   CB     C   9.320     8.261     -6.091    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   1008    .   1   1   29   LEU   CD1    C   11.404    8.183     -4.674    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   1009    .   1   1   29   LEU   CD2    C   11.573    8.635     -7.121    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   1010    .   1   1   29   LEU   CG     C   10.729    8.834     -5.874    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   1011    .   1   1   29   LEU   H      H   6.997     7.263     -6.110    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   1012    .   1   1   29   LEU   HA     H   8.714     7.964     -4.059    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   1013    .   1   1   29   LEU   HB2    H   9.415     7.206     -6.294    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   1014    .   1   1   29   LEU   HB3    H   8.902     8.733     -6.968    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   1015    .   1   1   29   LEU   HD11   H   12.396    8.592     -4.554    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD11   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   1016    .   1   1   29   LEU   HD12   H   11.471    7.116     -4.832    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD12   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   1017    .   1   1   29   LEU   HD13   H   10.826    8.378     -3.784    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD13   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   1018    .   1   1   29   LEU   HD21   H   11.108    9.135     -7.956    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   1019    .   1   1   29   LEU   HD22   H   11.652    7.580     -7.336    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   1020    .   1   1   29   LEU   HD23   H   12.560    9.043     -6.960    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD23   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   1021    .   1   1   29   LEU   HG     H   10.656    9.894     -5.681    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   1022    .   1   1   29   LEU   N      N   7.056     7.751     -5.260    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   1023    .   1   1   29   LEU   O      O   8.655     10.444    -3.655    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   1024    .   1   1   30   TRP   C      C   5.578     12.195    -5.818    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   1025    .   1   1   30   TRP   CA     C   6.935     11.940    -5.206    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   1026    .   1   1   30   TRP   CB     C   8.012     12.871    -5.788    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   1027    .   1   1   30   TRP   CD1    C   7.564     15.292    -6.515    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   1028    .   1   1   30   TRP   CD2    C   7.703     15.022    -4.297    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   1029    .   1   1   30   TRP   CE2    C   7.471     16.382    -4.567    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   1030    .   1   1   30   TRP   CE3    C   7.821     14.614    -2.968    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   1031    .   1   1   30   TRP   CG     C   7.768     14.339    -5.561    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   1032    .   1   1   30   TRP   CH2    C   7.476     16.905    -2.270    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   1033    .   1   1   30   TRP   CZ2    C   7.357     17.334    -3.561    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   1034    .   1   1   30   TRP   CZ3    C   7.705     15.561    -1.968    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   1035    .   1   1   30   TRP   H      H   6.879     10.107    -6.195    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   1036    .   1   1   30   TRP   HA     H   6.864     12.095    -4.139    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   1037    .   1   1   30   TRP   HB2    H   8.958     12.628    -5.328    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   1038    .   1   1   30   TRP   HB3    H   8.089     12.701    -6.850    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   1039    .   1   1   30   TRP   HD1    H   7.554     15.092    -7.577    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   1040    .   1   1   30   TRP   HE1    H   7.249     17.374    -6.399    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   1041    .   1   1   30   TRP   HE3    H   8.000     13.580    -2.719    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   1042    .   1   1   30   TRP   HH2    H   7.392     17.608    -1.454    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   1043    .   1   1   30   TRP   HZ2    H   7.178     18.377    -3.775    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   1044    .   1   1   30   TRP   HZ3    H   7.794     15.262    -0.934    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   1045    .   1   1   30   TRP   N      N   7.277     10.563    -5.422    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   1046    .   1   1   30   TRP   NE1    N   7.396     16.523    -5.924    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   NE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   1047    .   1   1   30   TRP   O      O   5.490     12.522    -7.001    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   2    .   1048    .   1   1   30   TRP   OXT    O   4.564     12.009    -5.122    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   OXT    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1049    .   1   1   1    TYR   C      C   -10.275   0.751     1.087     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1050    .   1   1   1    TYR   CA     C   -11.567   1.295     1.676     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1051    .   1   1   1    TYR   CB     C   -11.714   2.809     1.389     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1052    .   1   1   1    TYR   CD1    C   -10.880   3.387     -0.938    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1053    .   1   1   1    TYR   CD2    C   -13.228   3.297     -0.580    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1054    .   1   1   1    TYR   CE1    C   -11.088   3.720     -2.258    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1055    .   1   1   1    TYR   CE2    C   -13.444   3.629     -1.900    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1056    .   1   1   1    TYR   CG     C   -11.942   3.168     -0.073    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1057    .   1   1   1    TYR   CZ     C   -12.370   3.838     -2.734    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1058    .   1   1   1    TYR   H1     H   -10.795   1.494     3.607     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   H1     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1059    .   1   1   1    TYR   H2     H   -11.528   0.018     3.305     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   H2     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1060    .   1   1   1    TYR   H3     H   -12.474   1.385     3.526     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   H3     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1061    .   1   1   1    TYR   HA     H   -12.393   0.760     1.236     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1062    .   1   1   1    TYR   HB2    H   -12.550   3.196     1.951     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1063    .   1   1   1    TYR   HB3    H   -10.815   3.311     1.713     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1064    .   1   1   1    TYR   HD1    H   -9.868    3.293     -0.569    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1065    .   1   1   1    TYR   HD2    H   -14.072   3.135     0.075     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1066    .   1   1   1    TYR   HE1    H   -10.239   3.881     -2.907    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1067    .   1   1   1    TYR   HE2    H   -14.459   3.719     -2.261    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1068    .   1   1   1    TYR   HH     H   -13.257   4.859     -4.082    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HH     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1069    .   1   1   1    TYR   N      N   -11.585   1.037     3.114     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1070    .   1   1   1    TYR   O      O   -10.288   -0.172    0.265     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1071    .   1   1   1    TYR   OH     O   -12.580   4.170     -4.050    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   OH     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1072    .   1   1   2    CYS   C      C   -6.818    1.219     2.078     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1073    .   1   1   2    CYS   CA     C   -7.865    0.851     1.058     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1074    .   1   1   2    CYS   CB     C   -7.522    1.428     -0.331    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1075    .   1   1   2    CYS   H      H   -9.153    2.032     2.168     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1076    .   1   1   2    CYS   HA     H   -7.907    -0.227    0.991     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1077    .   1   1   2    CYS   HB2    H   -6.522    1.119     -0.598    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1078    .   1   1   2    CYS   HB3    H   -8.217    1.026     -1.053    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1079    .   1   1   2    CYS   N      N   -9.157    1.301     1.512     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1080    .   1   1   2    CYS   O      O   -7.058    2.080     2.932     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1081    .   1   1   2    CYS   SG     S   -7.577    3.258     -0.459    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1082    .   1   1   3    GLN   C      C   -3.823    2.022     2.448     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1083    .   1   1   3    GLN   CA     C   -4.622    0.829     2.931     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1084    .   1   1   3    GLN   CB     C   -3.717    -0.396    3.039     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1085    .   1   1   3    GLN   CD     C   -5.241    -1.653    4.604     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1086    .   1   1   3    GLN   CG     C   -4.451    -1.698    3.325     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1087    .   1   1   3    GLN   H      H   -5.584    -0.128    1.336     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1088    .   1   1   3    GLN   HA     H   -5.044    1.045     3.901     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1089    .   1   1   3    GLN   HB2    H   -3.152    -0.509    2.126     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1090    .   1   1   3    GLN   HB3    H   -3.019    -0.227    3.844     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1091    .   1   1   3    GLN   HE21   H   -3.654    -2.248    5.597     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HE21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1092    .   1   1   3    GLN   HE22   H   -5.075    -1.937    6.543     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HE22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1093    .   1   1   3    GLN   HG2    H   -5.140    -1.877    2.511     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1094    .   1   1   3    GLN   HG3    H   -3.739    -2.509    3.364     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1095    .   1   1   3    GLN   N      N   -5.694    0.576     2.012     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1096    .   1   1   3    GLN   NE2    N   -4.601    -1.985    5.685     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   NE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1097    .   1   1   3    GLN   O      O   -3.454    2.098     1.279     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1098    .   1   1   3    GLN   OE1    O   -6.421    -1.308    4.617     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   OE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1099    .   1   1   4    LYS   C      C   -1.379    3.929     3.156     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1100    .   1   1   4    LYS   CA     C   -2.886    4.179     3.053     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1101    .   1   1   4    LYS   CB     C   -3.305    5.270     4.034     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1102    .   1   1   4    LYS   CD     C   -5.141    6.578     5.132     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1103    .   1   1   4    LYS   CE     C   -6.643    6.783     5.262     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1104    .   1   1   4    LYS   CG     C   -4.803    5.508     4.105     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1105    .   1   1   4    LYS   H      H   -3.942    2.806     4.250     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1106    .   1   1   4    LYS   HA     H   -3.131    4.489     2.048     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1107    .   1   1   4    LYS   HB2    H   -2.959    5.000     5.021     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1108    .   1   1   4    LYS   HB3    H   -2.832    6.192     3.735     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1109    .   1   1   4    LYS   HD2    H   -4.746    6.277     6.091     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1110    .   1   1   4    LYS   HD3    H   -4.682    7.508     4.829     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1111    .   1   1   4    LYS   HE2    H   -7.096    5.852     5.569     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1112    .   1   1   4    LYS   HE3    H   -6.825    7.532     6.017     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1113    .   1   1   4    LYS   HG2    H   -5.161    5.823     3.137     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1114    .   1   1   4    LYS   HG3    H   -5.289    4.585     4.388     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1115    .   1   1   4    LYS   HZ1    H   -7.163    6.510     3.235     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1116    .   1   1   4    LYS   HZ2    H   -6.855    8.102     3.643     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1117    .   1   1   4    LYS   HZ3    H   -8.281    7.378     4.125     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1118    .   1   1   4    LYS   N      N   -3.608    2.955     3.342     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1119    .   1   1   4    LYS   NZ     N   -7.262    7.214     3.995     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1120    .   1   1   4    LYS   O      O   -0.961    2.854     3.557     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1121    .   1   1   5    TRP   C      C   1.488     4.481     4.198     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1122    .   1   1   5    TRP   CA     C   0.884     4.796     2.819     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1123    .   1   1   5    TRP   CB     C   1.553     6.051     2.208     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1124    .   1   1   5    TRP   CD1    C   2.186     7.774     4.005     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1125    .   1   1   5    TRP   CD2    C   0.325     8.292     2.879     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1126    .   1   1   5    TRP   CE2    C   0.569     9.291     3.836     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1127    .   1   1   5    TRP   CE3    C   -0.794    8.415     2.055     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1128    .   1   1   5    TRP   CG     C   1.373     7.318     3.009     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1129    .   1   1   5    TRP   CH2    C   -1.344    10.482    3.174     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1130    .   1   1   5    TRP   CZ2    C   -0.259    10.387    3.993     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1131    .   1   1   5    TRP   CZ3    C   -1.616    9.511     2.210     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1132    .   1   1   5    TRP   H      H   -0.973    5.816     2.675     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1133    .   1   1   5    TRP   HA     H   1.091     3.957     2.174     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1134    .   1   1   5    TRP   HB2    H   2.614     5.873     2.118     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1135    .   1   1   5    TRP   HB3    H   1.145     6.219     1.221     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1136    .   1   1   5    TRP   HD1    H   3.074     7.263     4.348     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1137    .   1   1   5    TRP   HE1    H   2.111     9.472     5.235     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1138    .   1   1   5    TRP   HE3    H   -1.022    7.678     1.300     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1139    .   1   1   5    TRP   HH2    H   -2.012    11.327    3.265     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1140    .   1   1   5    TRP   HZ2    H   -0.061    11.141    4.739     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1141    .   1   1   5    TRP   HZ3    H   -2.487    9.624     1.581     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1142    .   1   1   5    TRP   N      N   -0.578    4.940     2.863     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1143    .   1   1   5    TRP   NE1    N   1.701     8.951     4.507     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   NE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1144    .   1   1   5    TRP   O      O   2.556     3.893     4.294     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1145    .   1   1   6    MET   C      C   0.740     3.279     7.104     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1146    .   1   1   6    MET   CA     C   1.292     4.623     6.606     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1147    .   1   1   6    MET   CB     C   0.889     5.780     7.537     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1148    .   1   1   6    MET   CE     C   -0.636    7.116     10.060    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1149    .   1   1   6    MET   CG     C   1.438     5.643     8.936     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1150    .   1   1   6    MET   H      H   -0.021    5.385     5.126     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1151    .   1   1   6    MET   HA     H   2.369     4.556     6.561     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1152    .   1   1   6    MET   HB2    H   1.234     6.715     7.115     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1153    .   1   1   6    MET   HB3    H   -0.188    5.812     7.596     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1154    .   1   1   6    MET   HE1    H   -0.990    6.182     10.469    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1155    .   1   1   6    MET   HE2    H   -1.041    7.258     9.069     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1156    .   1   1   6    MET   HE3    H   -0.949    7.928     10.698    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1157    .   1   1   6    MET   HG2    H   0.973     4.780     9.393     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1158    .   1   1   6    MET   HG3    H   2.492     5.461     8.821     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1159    .   1   1   6    MET   N      N   0.812     4.881     5.254     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1160    .   1   1   6    MET   O      O   1.084     2.773     8.182     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1161    .   1   1   6    MET   SD     S   1.154     7.085     9.984     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   SD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1162    .   1   1   7    TRP   C      C   0.066     0.315     5.954     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1163    .   1   1   7    TRP   CA     C   -0.729    1.444     6.585     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1164    .   1   1   7    TRP   CB     C   -2.186    1.426     6.060     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1165    .   1   1   7    TRP   CD1    C   -2.823    3.640     7.233     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1166    .   1   1   7    TRP   CD2    C   -4.550    2.285     6.831     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1167    .   1   1   7    TRP   CE2    C   -5.024    3.443     7.468     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1168    .   1   1   7    TRP   CE3    C   -5.462    1.296     6.479     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1169    .   1   1   7    TRP   CG     C   -3.129    2.419     6.701     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1170    .   1   1   7    TRP   CH2    C   -7.239    2.650     7.394     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1171    .   1   1   7    TRP   CZ2    C   -6.371    3.636     7.755     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1172    .   1   1   7    TRP   CZ3    C   -6.796    1.487     6.760     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1173    .   1   1   7    TRP   H      H   -0.212    3.124     5.416     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1174    .   1   1   7    TRP   HA     H   -0.735    1.313     7.656     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1175    .   1   1   7    TRP   HB2    H   -2.180    1.630     5.000     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1176    .   1   1   7    TRP   HB3    H   -2.594    0.437     6.210     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1177    .   1   1   7    TRP   HD1    H   -1.820    4.043     7.282     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1178    .   1   1   7    TRP   HE1    H   -3.988    5.125     8.149     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1179    .   1   1   7    TRP   HE3    H   -5.144    0.386     5.988     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1180    .   1   1   7    TRP   HH2    H   -8.295    2.757     7.596     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1181    .   1   1   7    TRP   HZ2    H   -6.734    4.527     8.246     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1182    .   1   1   7    TRP   HZ3    H   -7.515    0.727     6.489     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1183    .   1   1   7    TRP   N      N   -0.080    2.701     6.290     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1184    .   1   1   7    TRP   NE1    N   -3.953    4.246     7.705     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   NE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1185    .   1   1   7    TRP   O      O   1.132     0.537     5.359     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1186    .   1   1   8    THR   C      C   -0.777    -2.872    4.781     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1187    .   1   1   8    THR   CA     C   0.242     -2.041    5.560     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1188    .   1   1   8    THR   CB     C   0.840     -2.864    6.737     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1189    .   1   1   8    THR   CG2    C   1.961     -2.106    7.438     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   CG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1190    .   1   1   8    THR   H      H   -1.301    -1.007    6.512     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1191    .   1   1   8    THR   HA     H   1.030     -1.686    4.917     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1192    .   1   1   8    THR   HB     H   1.229     -3.794    6.349     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1193    .   1   1   8    THR   HG1    H   -0.440    -2.296    8.098     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HG1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1194    .   1   1   8    THR   HG21   H   1.571     -1.169    7.806     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HG21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1195    .   1   1   8    THR   HG22   H   2.778     -1.907    6.761     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HG22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1196    .   1   1   8    THR   HG23   H   2.317     -2.690    8.274     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HG23   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1197    .   1   1   8    THR   N      N   -0.429    -0.878    6.078     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1198    .   1   1   8    THR   O      O   -1.978    -2.751    5.060     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1199    .   1   1   8    THR   OG1    O   -0.182    -3.143    7.708     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   OG1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1200    .   1   1   9    CYS   C      C   -1.069    -5.925    3.058     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1201    .   1   1   9    CYS   CA     C   -1.378    -4.443    3.104     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1202    .   1   1   9    CYS   CB     C   -1.664    -3.860    1.713     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1203    .   1   1   9    CYS   H      H   0.569     -3.830    3.522     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1204    .   1   1   9    CYS   HA     H   -2.274    -4.340    3.697     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1205    .   1   1   9    CYS   HB2    H   -2.422    -4.458    1.229     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1206    .   1   1   9    CYS   HB3    H   -2.040    -2.853    1.833     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1207    .   1   1   9    CYS   N      N   -0.367    -3.690    3.805     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1208    .   1   1   9    CYS   O      O   -0.024    -6.382    3.568     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1209    .   1   1   9    CYS   SG     S   -0.244    -3.792    0.598     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1210    .   1   1   10   ASP   C      C   -2.608    -8.496    1.119     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1211    .   1   1   10   ASP   CA     C   -1.906    -8.115    2.387     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1212    .   1   1   10   ASP   CB     C   -2.632    -8.809    3.561     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1213    .   1   1   10   ASP   CG     C   -1.956    -8.682    4.903     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1214    .   1   1   10   ASP   H      H   -2.761    -6.248    2.060     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1215    .   1   1   10   ASP   HA     H   -0.873    -8.422    2.359     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1216    .   1   1   10   ASP   HB2    H   -3.622    -8.390    3.657     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1217    .   1   1   10   ASP   HB3    H   -2.726    -9.857    3.325     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1218    .   1   1   10   ASP   N      N   -1.984    -6.671    2.492     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1219    .   1   1   10   ASP   O      O   -2.899    -7.626    0.296     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1220    .   1   1   10   ASP   OD1    O   -2.346    -7.821    5.692     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   OD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1221    .   1   1   10   ASP   OD2    O   -1.053    -9.484    5.212     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   OD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1222    .   1   1   11   SER   C      C   -5.112    -9.771    0.079     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1223    .   1   1   11   SER   CA     C   -3.661    -10.166   -0.189    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1224    .   1   1   11   SER   CB     C   -3.527    -11.676   -0.452    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1225    .   1   1   11   SER   H      H   -2.570    -10.440   1.575     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1226    .   1   1   11   SER   HA     H   -3.299    -9.611    -1.042    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1227    .   1   1   11   SER   HB2    H   -2.483    -11.953   -0.444    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1228    .   1   1   11   SER   HB3    H   -4.048    -12.223   0.320     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1229    .   1   1   11   SER   HG     H   -5.011    -11.743   -1.740    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   HG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1230    .   1   1   11   SER   N      N   -2.893    -9.762    0.942     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1231    .   1   1   11   SER   O      O   -5.820    -9.337    -0.814    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1232    .   1   1   11   SER   OG     O   -4.087    -12.035   -1.718    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   OG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1233    .   1   1   12   GLU   C      C   -6.996    -7.995    1.805     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1234    .   1   1   12   GLU   CA     C   -6.861    -9.509    1.747     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1235    .   1   1   12   GLU   CB     C   -7.203    -10.088   3.107     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1236    .   1   1   12   GLU   CD     C   -7.648    -12.077   4.509     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1237    .   1   1   12   GLU   CG     C   -7.221    -11.591   3.164     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1238    .   1   1   12   GLU   H      H   -4.908    -10.293   1.990     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1239    .   1   1   12   GLU   HA     H   -7.555    -9.899    1.019     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1240    .   1   1   12   GLU   HB2    H   -6.472    -9.736    3.820     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1241    .   1   1   12   GLU   HB3    H   -8.174    -9.724    3.405     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1242    .   1   1   12   GLU   HG2    H   -7.916    -11.959   2.425     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1243    .   1   1   12   GLU   HG3    H   -6.234    -11.971   2.952     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1244    .   1   1   12   GLU   N      N   -5.524    -9.897    1.338     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1245    .   1   1   12   GLU   O      O   -7.860    -7.417    1.156     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1246    .   1   1   12   GLU   OE1    O   -6.807    -12.193   5.416     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   OE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1247    .   1   1   12   GLU   OE2    O   -8.855    -12.342   4.699     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   OE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1248    .   1   1   13   ARG   C      C   -5.585    -5.241    1.541     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1249    .   1   1   13   ARG   CA     C   -6.187    -5.917    2.753     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1250    .   1   1   13   ARG   CB     C   -5.459    -5.475    4.024     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1251    .   1   1   13   ARG   CD     C   -5.354    -5.456    6.530     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1252    .   1   1   13   ARG   CG     C   -6.071    -6.005    5.309     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1253    .   1   1   13   ARG   CZ     C   -2.969    -5.156    7.176     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   CZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1254    .   1   1   13   ARG   H      H   -5.462    -7.884    3.064     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1255    .   1   1   13   ARG   HA     H   -7.225    -5.632    2.828     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1256    .   1   1   13   ARG   HB2    H   -4.435    -5.816    3.972     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1257    .   1   1   13   ARG   HB3    H   -5.462    -4.395    4.067     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1258    .   1   1   13   ARG   HD2    H   -5.419    -4.378    6.510     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1259    .   1   1   13   ARG   HD3    H   -5.846    -5.826    7.417     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1260    .   1   1   13   ARG   HE     H   -3.672    -6.684    6.127     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1261    .   1   1   13   ARG   HG2    H   -7.109    -5.715    5.351     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1262    .   1   1   13   ARG   HG3    H   -5.997    -7.082    5.311     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1263    .   1   1   13   ARG   HH11   H   -4.166    -3.660    7.887     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HH11   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1264    .   1   1   13   ARG   HH12   H   -2.525    -3.483    8.265     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HH12   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1265    .   1   1   13   ARG   HH21   H   -1.571    -6.495    6.658     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HH21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1266    .   1   1   13   ARG   HH22   H   -0.957    -5.158    7.572     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HH22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1267    .   1   1   13   ARG   N      N   -6.143    -7.362    2.595     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1268    .   1   1   13   ARG   NE     N   -3.937    -5.841    6.574     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   NE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1269    .   1   1   13   ARG   NH1    N   -3.236    -4.032    7.819     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   NH1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1270    .   1   1   13   ARG   NH2    N   -1.735    -5.625    7.142     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   NH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1271    .   1   1   13   ARG   O      O   -4.381    -5.336    1.311     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1272    .   1   1   14   LYS   C      C   -5.483    -2.546    -0.166    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1273    .   1   1   14   LYS   CA     C   -5.997    -3.919    -0.444    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1274    .   1   1   14   LYS   CB     C   -7.136    -3.832    -1.442    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1275    .   1   1   14   LYS   CD     C   -6.737    -6.107    -2.424    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1276    .   1   1   14   LYS   CE     C   -7.389    -7.429    -2.786    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1277    .   1   1   14   LYS   CG     C   -7.743    -5.160    -1.805    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1278    .   1   1   14   LYS   H      H   -7.358    -4.482    1.053     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1279    .   1   1   14   LYS   HA     H   -5.203    -4.505    -0.878    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1280    .   1   1   14   LYS   HB2    H   -7.915    -3.211    -1.025    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1281    .   1   1   14   LYS   HB3    H   -6.769    -3.368    -2.346    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1282    .   1   1   14   LYS   HD2    H   -6.326    -5.656    -3.315    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1283    .   1   1   14   LYS   HD3    H   -5.949    -6.292    -1.709    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1284    .   1   1   14   LYS   HE2    H   -7.819    -7.864    -1.896    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1285    .   1   1   14   LYS   HE3    H   -8.172    -7.240    -3.504    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1286    .   1   1   14   LYS   HG2    H   -8.109    -5.602    -0.894    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1287    .   1   1   14   LYS   HG3    H   -8.547    -4.980    -2.502    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1288    .   1   1   14   LYS   HZ1    H   -6.904    -9.281    -3.597    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1289    .   1   1   14   LYS   HZ2    H   -5.685    -8.603    -2.672    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1290    .   1   1   14   LYS   HZ3    H   -5.984    -8.017    -4.232    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1291    .   1   1   14   LYS   N      N   -6.419    -4.564    0.781     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1292    .   1   1   14   LYS   NZ     N   -6.429    -8.385    -3.367    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1293    .   1   1   14   LYS   O      O   -6.038    -1.811    0.646     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1294    .   1   1   15   CYS   C      C   -4.381    0.090     -1.658    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1295    .   1   1   15   CYS   CA     C   -3.805    -0.936    -0.666    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1296    .   1   1   15   CYS   CB     C   -2.293    -1.134    -0.835    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1297    .   1   1   15   CYS   H      H   -4.193    -2.822    -1.556    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1298    .   1   1   15   CYS   HA     H   -4.017    -0.595    0.336     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1299    .   1   1   15   CYS   HB2    H   -1.986    -1.981    -0.240    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1300    .   1   1   15   CYS   HB3    H   -2.081    -1.349    -1.871    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1301    .   1   1   15   CYS   N      N   -4.472    -2.198    -0.852    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1302    .   1   1   15   CYS   O      O   -5.029    -0.293    -2.646    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1303    .   1   1   15   CYS   SG     S   -1.263    0.273     -0.331    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1304    .   1   1   16   CYS   C      C   -4.038    2.502     -3.595    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1305    .   1   1   16   CYS   CA     C   -4.759    2.417     -2.245    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1306    .   1   1   16   CYS   CB     C   -4.733    3.780     -1.539    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1307    .   1   1   16   CYS   H      H   -3.683    1.641     -0.593    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1308    .   1   1   16   CYS   HA     H   -5.789    2.153     -2.437    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1309    .   1   1   16   CYS   HB2    H   -3.709    4.027     -1.297    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1310    .   1   1   16   CYS   HB3    H   -5.122    4.528     -2.214    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1311    .   1   1   16   CYS   N      N   -4.203    1.371     -1.387    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1312    .   1   1   16   CYS   O      O   -2.862    2.091     -3.738    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1313    .   1   1   16   CYS   SG     S   -5.700    3.877     0.023     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1314    .   1   1   17   LYS   C      C   -3.109    4.263     -5.828    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1315    .   1   1   17   LYS   CA     C   -4.170    3.176     -5.911    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1316    .   1   1   17   LYS   CB     C   -5.246    3.540     -6.949    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1317    .   1   1   17   LYS   CD     C   -5.821    3.938     -9.394    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1318    .   1   1   17   LYS   CE     C   -6.294    5.385     -9.261    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1319    .   1   1   17   LYS   CG     C   -4.726    3.581     -8.390    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1320    .   1   1   17   LYS   H      H   -5.688    3.234     -4.456    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1321    .   1   1   17   LYS   HA     H   -3.693    2.248     -6.193    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1322    .   1   1   17   LYS   HB2    H   -6.041    2.811     -6.896    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1323    .   1   1   17   LYS   HB3    H   -5.645    4.513     -6.702    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1324    .   1   1   17   LYS   HD2    H   -5.438    3.793     -10.392   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1325    .   1   1   17   LYS   HD3    H   -6.660    3.277     -9.234    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1326    .   1   1   17   LYS   HE2    H   -7.104    5.551     -9.955    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1327    .   1   1   17   LYS   HE3    H   -6.653    5.550     -8.256    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1328    .   1   1   17   LYS   HG2    H   -3.943    4.321     -8.454    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1329    .   1   1   17   LYS   HG3    H   -4.320    2.612     -8.638    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1330    .   1   1   17   LYS   HZ1    H   -4.430    6.278     -8.872    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1331    .   1   1   17   LYS   HZ2    H   -5.564    7.332     -9.513    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1332    .   1   1   17   LYS   HZ3    H   -4.822    6.190     -10.507   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1333    .   1   1   17   LYS   N      N   -4.747    2.992     -4.601    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1334    .   1   1   17   LYS   NZ     N   -5.211    6.356     -9.556    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1335    .   1   1   17   LYS   O      O   -3.297    5.289     -5.145    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1336    .   1   1   18   GLY   C      C   0.068     4.496     -5.357    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1337    .   1   1   18   GLY   CA     C   -0.908    4.950     -6.403    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1338    .   1   1   18   GLY   H      H   -1.919    3.221     -7.023    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1339    .   1   1   18   GLY   HA2    H   -0.416    4.995     -7.364    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   HA2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1340    .   1   1   18   GLY   HA3    H   -1.276    5.928     -6.139    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   HA3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1341    .   1   1   18   GLY   N      N   -2.005    4.033     -6.476    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1342    .   1   1   18   GLY   O      O   1.015     5.201     -5.005    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1343    .   1   1   19   MET   C      C   1.054     1.338     -4.327    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1344    .   1   1   19   MET   CA     C   0.682     2.720     -3.861    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1345    .   1   1   19   MET   CB     C   0.008     2.667     -2.494    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1346    .   1   1   19   MET   CE     C   -1.532    5.810     -0.307    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1347    .   1   1   19   MET   CG     C   -0.193    4.031     -1.896    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1348    .   1   1   19   MET   H      H   -1.028    2.865     -5.039    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1349    .   1   1   19   MET   HA     H   1.576     3.322     -3.788    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1350    .   1   1   19   MET   HB2    H   -0.957    2.193     -2.599    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1351    .   1   1   19   MET   HB3    H   0.618     2.083     -1.822    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1352    .   1   1   19   MET   HE1    H   -1.989    6.216     -1.197    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1353    .   1   1   19   MET   HE2    H   -0.566    6.270     -0.163    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1354    .   1   1   19   MET   HE3    H   -2.164    6.005     0.546     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1355    .   1   1   19   MET   HG2    H   0.784     4.315     -1.529    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1356    .   1   1   19   MET   HG3    H   -0.531    4.721     -2.654    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1357    .   1   1   19   MET   N      N   -0.191    3.331     -4.817    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1358    .   1   1   19   MET   O      O   0.377     0.756     -5.185    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1359    .   1   1   19   MET   SD     S   -1.316    4.048     -0.500    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   SD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1360    .   1   1   20   VAL   C      C   2.278     -1.338    -2.898    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1361    .   1   1   20   VAL   CA     C   2.586     -0.474    -4.095    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1362    .   1   1   20   VAL   CB     C   4.120     -0.459    -4.346    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1363    .   1   1   20   VAL   CG1    C   4.644     -1.847    -4.649    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   CG1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1364    .   1   1   20   VAL   CG2    C   4.484     0.499     -5.468    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   CG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1365    .   1   1   20   VAL   H      H   2.575     1.364     -3.108    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1366    .   1   1   20   VAL   HA     H   2.075     -0.849    -4.969    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1367    .   1   1   20   VAL   HB     H   4.600     -0.117    -3.444    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1368    .   1   1   20   VAL   HG11   H   5.708     -1.802    -4.831    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG11   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1369    .   1   1   20   VAL   HG12   H   4.141     -2.238    -5.521    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG12   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1370    .   1   1   20   VAL   HG13   H   4.451     -2.495    -3.806    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG13   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1371    .   1   1   20   VAL   HG21   H   3.997     0.183     -6.380    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1372    .   1   1   20   VAL   HG22   H   5.554     0.497     -5.612    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1373    .   1   1   20   VAL   HG23   H   4.156     1.495     -5.211    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG23   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1374    .   1   1   20   VAL   N      N   2.100     0.835     -3.792    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1375    .   1   1   20   VAL   O      O   2.631     -0.980    -1.762    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1376    .   1   1   21   CYS   C      C   2.384     -4.182    -1.654    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1377    .   1   1   21   CYS   CA     C   1.218     -3.287    -2.043    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1378    .   1   1   21   CYS   CB     C   -0.022    -4.113    -2.405    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1379    .   1   1   21   CYS   H      H   1.383     -2.688    -4.046    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1380    .   1   1   21   CYS   HA     H   0.984     -2.651    -1.202    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1381    .   1   1   21   CYS   HB2    H   -0.769    -3.463    -2.837    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1382    .   1   1   21   CYS   HB3    H   0.257     -4.867    -3.129    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1383    .   1   1   21   CYS   N      N   1.605     -2.431    -3.126    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1384    .   1   1   21   CYS   O      O   3.040     -4.784    -2.513    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1385    .   1   1   21   CYS   SG     S   -0.781    -4.964    -0.978    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1386    .   1   1   22   ARG   C      C   3.353     -5.250    1.633     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1387    .   1   1   22   ARG   CA     C   3.730     -4.990    0.161     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1388    .   1   1   22   ARG   CB     C   5.015     -4.107    0.067     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1389    .   1   1   22   ARG   CD     C   6.561     -5.677    -1.144    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1390    .   1   1   22   ARG   CG     C   6.341     -4.852    0.118     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1391    .   1   1   22   ARG   CZ     C   6.516     -5.222    -3.601    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   CZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1392    .   1   1   22   ARG   H      H   2.069     -3.779    0.266     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1393    .   1   1   22   ARG   HA     H   3.863     -5.914    -0.379    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1394    .   1   1   22   ARG   HB2    H   4.985     -3.562    -0.865    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1395    .   1   1   22   ARG   HB3    H   4.993     -3.396    0.879     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1396    .   1   1   22   ARG   HD2    H   7.431     -6.300    -1.009    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1397    .   1   1   22   ARG   HD3    H   5.695     -6.301    -1.305    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1398    .   1   1   22   ARG   HE     H   7.149     -3.955    -2.143    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1399    .   1   1   22   ARG   HG2    H   7.139     -4.132    0.208     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1400    .   1   1   22   ARG   HG3    H   6.358     -5.509    0.975     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1401    .   1   1   22   ARG   HH11   H   5.712     -7.051    -3.118    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HH11   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1402    .   1   1   22   ARG   HH12   H   5.767     -6.738    -4.783    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HH12   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1403    .   1   1   22   ARG   HH21   H   7.238     -3.504    -4.476    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HH21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1404    .   1   1   22   ARG   HH22   H   6.628     -4.663    -5.566    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HH22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1405    .   1   1   22   ARG   N      N   2.646     -4.245    -0.380    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1406    .   1   1   22   ARG   NE     N   6.766     -4.841    -2.336    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   NE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1407    .   1   1   22   ARG   NH1    N   5.962     -6.413    -3.852    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   NH1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1408    .   1   1   22   ARG   NH2    N   6.818     -4.407    -4.615    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   NH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1409    .   1   1   22   ARG   O      O   2.181     -4.956    2.048     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1410    .   1   1   23   LEU   C      C   3.596     -4.642    4.510     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1411    .   1   1   23   LEU   CA     C   4.092     -5.943    3.881     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1412    .   1   1   23   LEU   CB     C   5.374     -6.408    4.581     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1413    .   1   1   23   LEU   CD1    C   7.211     -8.064    4.943     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1414    .   1   1   23   LEU   CD2    C   4.904     -8.877    4.440     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1415    .   1   1   23   LEU   CG     C   5.928     -7.777    4.182     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1416    .   1   1   23   LEU   H      H   5.150     -6.055    2.046     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1417    .   1   1   23   LEU   HA     H   3.323     -6.691    4.005     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1418    .   1   1   23   LEU   HB2    H   6.143     -5.676    4.388     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1419    .   1   1   23   LEU   HB3    H   5.179     -6.424    5.643     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1420    .   1   1   23   LEU   HD11   H   7.589     -9.033    4.656     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD11   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1421    .   1   1   23   LEU   HD12   H   7.010     -8.055    6.003     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD12   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1422    .   1   1   23   LEU   HD13   H   7.945     -7.307    4.709     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD13   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1423    .   1   1   23   LEU   HD21   H   5.330     -9.834    4.172     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1424    .   1   1   23   LEU   HD22   H   4.023     -8.702    3.840     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1425    .   1   1   23   LEU   HD23   H   4.634     -8.884    5.486     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD23   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1426    .   1   1   23   LEU   HG     H   6.161     -7.767    3.129     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1427    .   1   1   23   LEU   N      N   4.303     -5.759    2.437     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1428    .   1   1   23   LEU   O      O   2.857     -4.654    5.482     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1429    .   1   1   24   TRP   C      C   3.112     -1.556    2.976     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1430    .   1   1   24   TRP   CA     C   3.519     -2.243    4.287     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1431    .   1   1   24   TRP   CB     C   4.609     -1.434    5.018     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1432    .   1   1   24   TRP   CD1    C   5.858     0.187     3.533     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1433    .   1   1   24   TRP   CD2    C   6.857     -1.790    3.726     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1434    .   1   1   24   TRP   CE2    C   7.627     -0.986    2.874     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1435    .   1   1   24   TRP   CE3    C   7.288     -3.085    4.002     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1436    .   1   1   24   TRP   CG     C   5.730     -1.014    4.132     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1437    .   1   1   24   TRP   CH2    C   9.195     -2.703    2.575     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1438    .   1   1   24   TRP   CZ2    C   8.800     -1.433    2.290     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1439    .   1   1   24   TRP   CZ3    C   8.452     -3.528    3.423     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1440    .   1   1   24   TRP   H      H   4.618     -3.584    3.168     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1441    .   1   1   24   TRP   HA     H   2.671     -2.412    4.928     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1442    .   1   1   24   TRP   HB2    H   4.168     -0.542    5.437     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1443    .   1   1   24   TRP   HB3    H   5.017     -2.036    5.817     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1444    .   1   1   24   TRP   HD1    H   5.128     0.974     3.664     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1445    .   1   1   24   TRP   HE1    H   7.307     0.981     2.238     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1446    .   1   1   24   TRP   HE3    H   6.726     -3.730    4.659     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1447    .   1   1   24   TRP   HH2    H   10.104    -3.091    2.139     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1448    .   1   1   24   TRP   HZ2    H   9.391     -0.815    1.630     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1449    .   1   1   24   TRP   HZ3    H   8.803     -4.531    3.623     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1450    .   1   1   24   TRP   N      N   3.994     -3.539    3.924     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1451    .   1   1   24   TRP   NE1    N   6.993     0.216     2.771     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   NE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1452    .   1   1   24   TRP   O      O   3.431     -2.077    1.912     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1453    .   1   1   25   CYS   C      C   3.221     1.184     1.395     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1454    .   1   1   25   CYS   CA     C   2.115     0.238     1.787     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1455    .   1   1   25   CYS   CB     C   0.763     0.935     1.811     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1456    .   1   1   25   CYS   H      H   2.117     -0.058    3.868     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1457    .   1   1   25   CYS   HA     H   2.091     -0.532    1.028     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1458    .   1   1   25   CYS   HB2    H   0.633     1.420     2.767     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1459    .   1   1   25   CYS   HB3    H   0.736     1.679     1.029     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1460    .   1   1   25   CYS   N      N   2.423     -0.454    3.022     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1461    .   1   1   25   CYS   O      O   3.671     2.018     2.191     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1462    .   1   1   25   CYS   SG     S   -0.654    -0.183    1.564     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1463    .   1   1   26   LYS   C      C   4.127     2.767     -1.363    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1464    .   1   1   26   LYS   CA     C   4.731     1.827     -0.349    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1465    .   1   1   26   LYS   CB     C   5.761     0.893     -1.013    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1466    .   1   1   26   LYS   CD     C   7.795     0.613     -2.459    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1467    .   1   1   26   LYS   CE     C   8.950     1.315     -3.162    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1468    .   1   1   26   LYS   CG     C   6.919     1.597     -1.708    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1469    .   1   1   26   LYS   H      H   3.214     0.409     -0.413    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1470    .   1   1   26   LYS   HA     H   5.203     2.380     0.448     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1471    .   1   1   26   LYS   HB2    H   6.180     0.261     -0.243    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1472    .   1   1   26   LYS   HB3    H   5.255     0.264     -1.726    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1473    .   1   1   26   LYS   HD2    H   8.190     -0.107    -1.759    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1474    .   1   1   26   LYS   HD3    H   7.193     0.100     -3.198    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1475    .   1   1   26   LYS   HE2    H   8.553     2.041     -3.856    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1476    .   1   1   26   LYS   HE3    H   9.551     1.820     -2.420    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1477    .   1   1   26   LYS   HG2    H   6.523     2.319     -2.407    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1478    .   1   1   26   LYS   HG3    H   7.516     2.104     -0.965    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1479    .   1   1   26   LYS   HZ1    H   10.594    0.842     -4.372    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1480    .   1   1   26   LYS   HZ2    H   9.246     -0.132    -4.628    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1481    .   1   1   26   LYS   HZ3    H   10.197    -0.357    -3.257    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1482    .   1   1   26   LYS   N      N   3.663     1.045     0.187     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1483    .   1   1   26   LYS   NZ     N   9.803     0.360     -3.901    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1484    .   1   1   26   LYS   O      O   3.106     2.455     -1.938    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1485    .   1   1   27   LYS   C      C   4.688     4.484     -3.913    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1486    .   1   1   27   LYS   CA     C   4.197     4.845     -2.519    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1487    .   1   1   27   LYS   CB     C   4.645     6.250     -2.140    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1488    .   1   1   27   LYS   CD     C   4.807     7.977     -0.316    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1489    .   1   1   27   LYS   CE     C   4.314     8.383     1.060     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1490    .   1   1   27   LYS   CG     C   4.166     6.679     -0.761    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1491    .   1   1   27   LYS   H      H   5.540     4.102     -1.074    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1492    .   1   1   27   LYS   HA     H   3.119     4.798     -2.495    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1493    .   1   1   27   LYS   HB2    H   5.724     6.283     -2.174    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1494    .   1   1   27   LYS   HB3    H   4.255     6.945     -2.867    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1495    .   1   1   27   LYS   HD2    H   5.878     7.842     -0.281    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1496    .   1   1   27   LYS   HD3    H   4.561     8.752     -1.026    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1497    .   1   1   27   LYS   HE2    H   3.260     8.609     0.996     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1498    .   1   1   27   LYS   HE3    H   4.452     7.552     1.734     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1499    .   1   1   27   LYS   HG2    H   3.095     6.810     -0.786    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1500    .   1   1   27   LYS   HG3    H   4.414     5.901     -0.054    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1501    .   1   1   27   LYS   HZ1    H   6.035     9.357     1.725     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1502    .   1   1   27   LYS   HZ2    H   4.630     9.857     2.511     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1503    .   1   1   27   LYS   HZ3    H   4.945     10.388    0.956     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1504    .   1   1   27   LYS   N      N   4.716     3.897     -1.563    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1505    .   1   1   27   LYS   NZ     N   5.025     9.568     1.592     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1506    .   1   1   27   LYS   O      O   5.783     3.954     -4.069    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1507    .   1   1   28   LYS   C      C   4.918     5.748     -6.759    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1508    .   1   1   28   LYS   CA     C   4.250     4.479     -6.279    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1509    .   1   1   28   LYS   CB     C   2.989     4.205     -7.125    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1510    .   1   1   28   LYS   CD     C   3.672     2.215     -8.531    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1511    .   1   1   28   LYS   CE     C   3.531     1.553     -9.902    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1512    .   1   1   28   LYS   CG     C   3.193     3.662     -8.543    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1513    .   1   1   28   LYS   H      H   2.979     5.089     -4.703    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1514    .   1   1   28   LYS   HA     H   4.929     3.640     -6.327    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1515    .   1   1   28   LYS   HB2    H   2.377     3.492     -6.594    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1516    .   1   1   28   LYS   HB3    H   2.434     5.129     -7.195    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1517    .   1   1   28   LYS   HD2    H   4.711     2.190     -8.239    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1518    .   1   1   28   LYS   HD3    H   3.083     1.662     -7.813    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1519    .   1   1   28   LYS   HE2    H   3.798     0.511     -9.811    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1520    .   1   1   28   LYS   HE3    H   2.499     1.625     -10.207   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1521    .   1   1   28   LYS   HG2    H   2.256     3.715     -9.078    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1522    .   1   1   28   LYS   HG3    H   3.928     4.273     -9.048    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1523    .   1   1   28   LYS   HZ1    H   4.160     1.771     -11.875   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1524    .   1   1   28   LYS   HZ2    H   5.388     1.957     -10.758   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1525    .   1   1   28   LYS   HZ3    H   4.303     3.205     -10.998   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1526    .   1   1   28   LYS   N      N   3.870     4.723     -4.900    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1527    .   1   1   28   LYS   NZ     N   4.385     2.165     -10.939   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1528    .   1   1   28   LYS   O      O   4.248     6.776     -6.921    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1529    .   1   1   29   LEU   C      C   6.786     7.079     -8.819    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1530    .   1   1   29   LEU   CA     C   6.945     6.898     -7.328    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1531    .   1   1   29   LEU   CB     C   8.448     6.842     -6.961    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1532    .   1   1   29   LEU   CD1    C   8.564     5.415     -4.863    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1533    .   1   1   29   LEU   CD2    C   10.298    7.165     -5.282    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1534    .   1   1   29   LEU   CG     C   8.838     6.781     -5.469    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1535    .   1   1   29   LEU   H      H   6.686     4.876     -6.727    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1536    .   1   1   29   LEU   HA     H   6.492     7.746     -6.836    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1537    .   1   1   29   LEU   HB2    H   8.868     5.971     -7.440    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1538    .   1   1   29   LEU   HB3    H   8.920     7.712     -7.395    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1539    .   1   1   29   LEU   HD11   H   8.860     5.419     -3.825    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD11   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1540    .   1   1   29   LEU   HD12   H   9.127     4.664     -5.395    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD12   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1541    .   1   1   29   LEU   HD13   H   7.509     5.194     -4.935    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD13   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1542    .   1   1   29   LEU   HD21   H   10.457    8.171     -5.640    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1543    .   1   1   29   LEU   HD22   H   10.922    6.483     -5.841    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1544    .   1   1   29   LEU   HD23   H   10.553    7.110     -4.234    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD23   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1545    .   1   1   29   LEU   HG     H   8.237     7.498     -4.929    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1546    .   1   1   29   LEU   N      N   6.213     5.719     -6.905    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1547    .   1   1   29   LEU   O      O   6.459     8.179     -9.303    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1548    .   1   1   30   TRP   C      C   6.040     4.797     -11.357   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1549    .   1   1   30   TRP   CA     C   6.860     5.998     -10.975   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1550    .   1   1   30   TRP   CB     C   8.240     5.932     -11.667   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1551    .   1   1   30   TRP   CD1    C   9.117     8.319     -11.923   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1552    .   1   1   30   TRP   CD2    C   10.214    7.110     -10.403   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1553    .   1   1   30   TRP   CE2    C   10.782    8.395     -10.443   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1554    .   1   1   30   TRP   CE3    C   10.743    6.172     -9.519    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1555    .   1   1   30   TRP   CG     C   9.143     7.086     -11.354   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1556    .   1   1   30   TRP   CH2    C   12.345    7.824     -8.782    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1557    .   1   1   30   TRP   CZ2    C   11.849    8.763     -9.635    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1558    .   1   1   30   TRP   CZ3    C   11.804    6.538     -8.719    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1559    .   1   1   30   TRP   H      H   7.210     5.163     -9.089    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1560    .   1   1   30   TRP   HA     H   6.346     6.897     -11.279   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1561    .   1   1   30   TRP   HB2    H   8.745     5.030     -11.356   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1562    .   1   1   30   TRP   HB3    H   8.091     5.901     -12.736   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1563    .   1   1   30   TRP   HD1    H   8.417     8.619     -12.690   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1564    .   1   1   30   TRP   HE1    H   10.256    10.052    -11.631   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1565    .   1   1   30   TRP   HE3    H   10.339    5.172     -9.454    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1566    .   1   1   30   TRP   HH2    H   13.176    8.067     -8.136    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1567    .   1   1   30   TRP   HZ2    H   12.282    9.751     -9.664    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1568    .   1   1   30   TRP   HZ3    H   12.227    5.825     -8.028    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1569    .   1   1   30   TRP   N      N   6.989     6.007     -9.539    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1570    .   1   1   30   TRP   NE1    N   10.091    9.115     -11.375   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   NE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1571    .   1   1   30   TRP   O      O   4.795     4.884     -11.382   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   3    .   1572    .   1   1   30   TRP   OXT    O   6.622     3.720     -11.562   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   OXT    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1573    .   1   1   1    TYR   C      C   -9.760    0.621     2.325     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1574    .   1   1   1    TYR   CA     C   -10.815   0.233     3.324     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1575    .   1   1   1    TYR   CB     C   -12.196   0.743     2.897     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1576    .   1   1   1    TYR   CD1    C   -13.135   -1.245    1.665     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1577    .   1   1   1    TYR   CD2    C   -12.884   0.796     0.467     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1578    .   1   1   1    TYR   CE1    C   -13.653   -1.848    0.546     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1579    .   1   1   1    TYR   CE2    C   -13.397   0.198     -0.659    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1580    .   1   1   1    TYR   CG     C   -12.741   0.086     1.650     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1581    .   1   1   1    TYR   CZ     C   -13.782   -1.126    -0.613    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1582    .   1   1   1    TYR   H1     H   -11.113   0.545     5.368     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   H1     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1583    .   1   1   1    TYR   H2     H   -10.347   1.812     4.585     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   H2     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1584    .   1   1   1    TYR   H3     H   -9.509    0.406     4.908     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   H3     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1585    .   1   1   1    TYR   HA     H   -10.828   -0.845    3.404     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1586    .   1   1   1    TYR   HB2    H   -12.904   0.567     3.693     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1587    .   1   1   1    TYR   HB3    H   -12.133   1.805     2.712     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1588    .   1   1   1    TYR   HD1    H   -13.034   -1.817    2.577     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1589    .   1   1   1    TYR   HD2    H   -12.583   1.833     0.429     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1590    .   1   1   1    TYR   HE1    H   -13.952   -2.886    0.587     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1591    .   1   1   1    TYR   HE2    H   -13.494   0.777     -1.566    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1592    .   1   1   1    TYR   HH     H   -15.082   -2.240    -1.460    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HH     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1593    .   1   1   1    TYR   N      N   -10.434   0.780     4.617     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1594    .   1   1   1    TYR   O      O   -9.087    -0.239    1.752     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1595    .   1   1   1    TYR   OH     O   -14.314   -1.720    -1.728    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   OH     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1596    .   1   1   2    CYS   C      C   -7.358    2.449     2.263     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1597    .   1   1   2    CYS   CA     C   -8.514    2.360     1.320     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1598    .   1   1   2    CYS   CB     C   -8.782    3.715     0.696     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1599    .   1   1   2    CYS   H      H   -10.191   2.576     2.512     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1600    .   1   1   2    CYS   HA     H   -8.305    1.620     0.559     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1601    .   1   1   2    CYS   HB2    H   -9.761    3.725     0.247     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1602    .   1   1   2    CYS   HB3    H   -8.716    4.442     1.490     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1603    .   1   1   2    CYS   N      N   -9.598    1.906     2.113     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1604    .   1   1   2    CYS   O      O   -7.530    2.838     3.425     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1605    .   1   1   2    CYS   SG     S   -7.565    4.199     -0.581    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1606    .   1   1   3    GLN   C      C   -4.221    3.204     2.593     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1607    .   1   1   3    GLN   CA     C   -5.103    1.995     2.690     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1608    .   1   1   3    GLN   CB     C   -4.316    0.706     2.468     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1609    .   1   1   3    GLN   CD     C   -5.773    -0.674    4.044     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1610    .   1   1   3    GLN   CG     C   -5.134    -0.575    2.665     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1611    .   1   1   3    GLN   H      H   -6.156    1.950     0.845     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1612    .   1   1   3    GLN   HA     H   -5.524    1.967     3.682     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1613    .   1   1   3    GLN   HB2    H   -3.928    0.717     1.461     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1614    .   1   1   3    GLN   HB3    H   -3.485    0.688     3.159     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1615    .   1   1   3    GLN   HE21   H   -4.175    -1.597    4.761     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HE21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1616    .   1   1   3    GLN   HE22   H   -5.476    -1.305    5.875     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HE22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1617    .   1   1   3    GLN   HG2    H   -5.919    -0.599    1.926     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1618    .   1   1   3    GLN   HG3    H   -4.484    -1.426    2.522     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1619    .   1   1   3    GLN   N      N   -6.223    2.092     1.810     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1620    .   1   1   3    GLN   NE2    N   -5.068    -1.254    4.983     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   NE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1621    .   1   1   3    GLN   O      O   -4.042    3.777     1.516     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1622    .   1   1   3    GLN   OE1    O   -6.903    -0.235    4.258     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   OE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1623    .   1   1   4    LYS   C      C   -1.405    4.239     3.776     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1624    .   1   1   4    LYS   CA     C   -2.830    4.738     3.834     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1625    .   1   1   4    LYS   CB     C   -3.046    5.450     5.175     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1626    .   1   1   4    LYS   CD     C   -4.606    6.592     6.774     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1627    .   1   1   4    LYS   CE     C   -6.044    6.998     7.035     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1628    .   1   1   4    LYS   CG     C   -4.471    5.899     5.425     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1629    .   1   1   4    LYS   H      H   -3.931    3.102     4.536     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1630    .   1   1   4    LYS   HA     H   -3.030    5.426     3.027     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1631    .   1   1   4    LYS   HB2    H   -2.763    4.778     5.972     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1632    .   1   1   4    LYS   HB3    H   -2.404    6.319     5.210     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1633    .   1   1   4    LYS   HD2    H   -4.284    5.913     7.552     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1634    .   1   1   4    LYS   HD3    H   -3.980    7.472     6.780     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1635    .   1   1   4    LYS   HE2    H   -6.361    7.678     6.260     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1636    .   1   1   4    LYS   HE3    H   -6.655    6.108     7.003     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1637    .   1   1   4    LYS   HG2    H   -4.763    6.584     4.644     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1638    .   1   1   4    LYS   HG3    H   -5.117    5.035     5.406     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1639    .   1   1   4    LYS   HZ1    H   -5.864    7.056     9.115     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1640    .   1   1   4    LYS   HZ2    H   -7.236    7.805     8.534     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1641    .   1   1   4    LYS   HZ3    H   -5.742    8.580     8.390     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1642    .   1   1   4    LYS   N      N   -3.712    3.606     3.728     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1643    .   1   1   4    LYS   NZ     N   -6.223    7.658     8.348     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1644    .   1   1   4    LYS   O      O   -1.164    3.045     3.928     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1645    .   1   1   5    TRP   C      C   1.436     4.215     4.887     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1646    .   1   1   5    TRP   CA     C   0.987     4.849     3.568     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1647    .   1   1   5    TRP   CB     C   1.795     6.157     3.357     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1648    .   1   1   5    TRP   CD1    C   0.685     7.897     4.900     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1649    .   1   1   5    TRP   CD2    C   2.738     7.307     5.550     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1650    .   1   1   5    TRP   CE2    C   2.227     8.241     6.468     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1651    .   1   1   5    TRP   CE3    C   4.018     6.795     5.757     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1652    .   1   1   5    TRP   CG     C   1.728     7.100     4.547     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1653    .   1   1   5    TRP   CH2    C   4.201     8.148     7.751     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1654    .   1   1   5    TRP   CZ2    C   2.951     8.669     7.576     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1655    .   1   1   5    TRP   CZ3    C   4.736     7.220     6.854     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1656    .   1   1   5    TRP   H      H   -0.742    6.097     3.551     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1657    .   1   1   5    TRP   HA     H   1.175     4.177     2.745     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1658    .   1   1   5    TRP   HB2    H   2.831     5.909     3.188     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1659    .   1   1   5    TRP   HB3    H   1.406     6.678     2.493     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1660    .   1   1   5    TRP   HD1    H   -0.239    7.960     4.347     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1661    .   1   1   5    TRP   HE1    H   0.373     9.214     6.504     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1662    .   1   1   5    TRP   HE3    H   4.449     6.076     5.074     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1663    .   1   1   5    TRP   HH2    H   4.798     8.452     8.598     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1664    .   1   1   5    TRP   HZ2    H   2.554     9.385     8.281     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1665    .   1   1   5    TRP   HZ3    H   5.729     6.828     7.026     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1666    .   1   1   5    TRP   N      N   -0.462    5.162     3.629     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1667    .   1   1   5    TRP   NE1    N   0.972     8.578     6.051     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   NE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1668    .   1   1   5    TRP   O      O   2.432     3.500     4.956     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1669    .   1   1   6    MET   C      C   0.566     2.661     7.478     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1670    .   1   1   6    MET   CA     C   0.961     4.111     7.254     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1671    .   1   1   6    MET   CB     C   0.221     5.035     8.223     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1672    .   1   1   6    MET   CE     C   0.543     7.411     10.345    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1673    .   1   1   6    MET   CG     C   0.430     4.710     9.690     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1674    .   1   1   6    MET   H      H   -0.119    5.060     5.746     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1675    .   1   1   6    MET   HA     H   2.018     4.265     7.388     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1676    .   1   1   6    MET   HB2    H   0.557     6.045     8.049     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1677    .   1   1   6    MET   HB3    H   -0.836    4.980     8.010     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1678    .   1   1   6    MET   HE1    H   1.598     7.266     10.517    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1679    .   1   1   6    MET   HE2    H   0.194     8.230     10.956    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1680    .   1   1   6    MET   HE3    H   0.375     7.644     9.305     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1681    .   1   1   6    MET   HG2    H   0.007     3.735     9.886     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1682    .   1   1   6    MET   HG3    H   1.491     4.682     9.875     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1683    .   1   1   6    MET   N      N   0.675     4.518     5.919     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1684    .   1   1   6    MET   O      O   1.119     1.975     8.337     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1685    .   1   1   6    MET   SD     S   -0.348    5.914     10.791    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   SD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1686    .   1   1   7    TRP   C      C   -0.104    -0.079    5.909     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1687    .   1   1   7    TRP   CA     C   -0.846    0.848     6.840     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1688    .   1   1   7    TRP   CB     C   -2.368    0.743     6.642     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1689    .   1   1   7    TRP   CD1    C   -2.815    1.876     8.915     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1690    .   1   1   7    TRP   CD2    C   -4.480    2.078     7.439     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1691    .   1   1   7    TRP   CE2    C   -4.844    2.752     8.617     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1692    .   1   1   7    TRP   CE3    C   -5.368    2.062     6.378     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1693    .   1   1   7    TRP   CG     C   -3.170    1.544     7.636     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1694    .   1   1   7    TRP   CH2    C   -6.918    3.368     7.686     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1695    .   1   1   7    TRP   CZ2    C   -6.065    3.404     8.753     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1696    .   1   1   7    TRP   CZ3    C   -6.580    2.702     6.508     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1697    .   1   1   7    TRP   H      H   -0.681    2.749     5.950     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1698    .   1   1   7    TRP   HA     H   -0.606    0.549     7.851     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1699    .   1   1   7    TRP   HB2    H   -2.618    1.100     5.655     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1700    .   1   1   7    TRP   HB3    H   -2.664    -0.292    6.727     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1701    .   1   1   7    TRP   HD1    H   -1.876    1.607     9.379     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1702    .   1   1   7    TRP   HE1    H   -3.785    2.994     10.410    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1703    .   1   1   7    TRP   HE3    H   -5.116    1.539     5.469     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1704    .   1   1   7    TRP   HH2    H   -7.880    3.856     7.745     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1705    .   1   1   7    TRP   HZ2    H   -6.347    3.925     9.656     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1706    .   1   1   7    TRP   HZ3    H   -7.279    2.694     5.684     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1707    .   1   1   7    TRP   N      N   -0.364    2.194     6.693     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1708    .   1   1   7    TRP   NE1    N   -3.812    2.617     9.500     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   NE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1709    .   1   1   7    TRP   O      O   0.734     0.354     5.112     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1710    .   1   1   8    THR   C      C   -0.720    -3.128    4.455     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1711    .   1   1   8    THR   CA     C   0.306     -2.335    5.266     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1712    .   1   1   8    THR   CB     C   1.042     -3.270    6.250     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1713    .   1   1   8    THR   CG2    C   2.039     -2.480    7.111     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   CG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1714    .   1   1   8    THR   H      H   -1.067    -1.636    6.651     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1715    .   1   1   8    THR   HA     H   1.022     -1.856    4.619     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1716    .   1   1   8    THR   HB     H   1.571     -4.030    5.695     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1717    .   1   1   8    THR   HG1    H   0.180     -3.509    8.014     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HG1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1718    .   1   1   8    THR   HG21   H   2.587     -3.155    7.752     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HG21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1719    .   1   1   8    THR   HG22   H   1.492     -1.778    7.722     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HG22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1720    .   1   1   8    THR   HG23   H   2.728     -1.920    6.494     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HG23   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1721    .   1   1   8    THR   N      N   -0.377    -1.334    6.025     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1722    .   1   1   8    THR   O      O   -1.938    -2.890    4.615     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1723    .   1   1   8    THR   OG1    O   0.075     -3.882    7.129     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   OG1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1724    .   1   1   9    CYS   C      C   -1.057    -6.314    3.216     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1725    .   1   1   9    CYS   CA     C   -1.288    -4.844    2.923     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1726    .   1   1   9    CYS   CB     C   -1.357    -4.599    1.415     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1727    .   1   1   9    CYS   H      H   0.656     -4.187    3.338     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1728    .   1   1   9    CYS   HA     H   -2.236    -4.573    3.365     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1729    .   1   1   9    CYS   HB2    H   -2.306    -4.964    1.051     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1730    .   1   1   9    CYS   HB3    H   -1.301    -3.536    1.233     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1731    .   1   1   9    CYS   N      N   -0.289    -4.039    3.576     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1732    .   1   1   9    CYS   O      O   -0.011    -6.698    3.784     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1733    .   1   1   9    CYS   SG     S   -0.070    -5.404    0.430     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1734    .   1   1   10   ASP   C      C   -2.546    -9.115    1.742     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1735    .   1   1   10   ASP   CA     C   -1.988    -8.557    3.032     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1736    .   1   1   10   ASP   CB     C   -2.910    -9.015    4.188     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1737    .   1   1   10   ASP   CG     C   -2.748    -8.281    5.505     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1738    .   1   1   10   ASP   H      H   -2.810    -6.739    2.398     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1739    .   1   1   10   ASP   HA     H   -0.973    -8.886    3.188     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1740    .   1   1   10   ASP   HB2    H   -3.932    -8.889    3.869     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1741    .   1   1   10   ASP   HB3    H   -2.735    -10.067   4.358     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1742    .   1   1   10   ASP   N      N   -2.027    -7.119    2.858     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1743    .   1   1   10   ASP   O      O   -2.432    -8.471    0.697     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1744    .   1   1   10   ASP   OD1    O   -3.732    -7.665    5.965     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   OD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1745    .   1   1   10   ASP   OD2    O   -1.657    -8.306    6.119     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   OD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1746    .   1   1   11   SER   C      C   -5.159    -10.114   0.417     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1747    .   1   1   11   SER   CA     C   -3.792    -10.786   0.593     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1748    .   1   1   11   SER   CB     C   -3.923    -12.299   0.640     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1749    .   1   1   11   SER   H      H   -3.127    -10.828   2.594     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1750    .   1   1   11   SER   HA     H   -3.176    -10.510   -0.249    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1751    .   1   1   11   SER   HB2    H   -4.536    -12.580   1.484     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1752    .   1   1   11   SER   HB3    H   -4.385    -12.649   -0.271    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1753    .   1   1   11   SER   HG     H   -2.045    -12.250   1.152     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   HG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1754    .   1   1   11   SER   N      N   -3.138    -10.285   1.776     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1755    .   1   1   11   SER   O      O   -5.545    -9.779    -0.694    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1756    .   1   1   11   SER   OG     O   -2.641    -12.902   0.765     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   OG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1757    .   1   1   12   GLU   C      C   -7.109    -7.744    1.451     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1758    .   1   1   12   GLU   CA     C   -7.186    -9.265    1.445     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1759    .   1   1   12   GLU   CB     C   -8.157    -9.780    2.517     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1760    .   1   1   12   GLU   CD     C   -7.575    -12.256   2.422     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1761    .   1   1   12   GLU   CG     C   -8.654    -11.211   2.317     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1762    .   1   1   12   GLU   H      H   -5.496    -10.132   2.394     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1763    .   1   1   12   GLU   HA     H   -7.570    -9.543    0.475     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1764    .   1   1   12   GLU   HB2    H   -7.661    -9.743    3.474     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1765    .   1   1   12   GLU   HB3    H   -9.015    -9.125    2.545     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1766    .   1   1   12   GLU   HG2    H   -9.396    -11.421   3.072     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1767    .   1   1   12   GLU   HG3    H   -9.114    -11.279   1.342     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1768    .   1   1   12   GLU   N      N   -5.867    -9.880    1.523     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1769    .   1   1   12   GLU   O      O   -7.652    -7.099    0.551     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1770    .   1   1   12   GLU   OE1    O   -7.212    -12.634   3.550     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   OE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1771    .   1   1   12   GLU   OE2    O   -7.082    -12.738   1.395     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   OE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1772    .   1   1   13   ARG   C      C   -5.261    -5.374    1.396     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1773    .   1   1   13   ARG   CA     C   -6.283    -5.704    2.451     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1774    .   1   1   13   ARG   CB     C   -5.751    -5.153    3.786     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1775    .   1   1   13   ARG   CD     C   -5.976    -4.654    6.217     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1776    .   1   1   13   ARG   CG     C   -6.655    -5.277    4.999     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1777    .   1   1   13   ARG   CZ     C   -3.553    -4.605    6.898     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   CZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1778    .   1   1   13   ARG   H      H   -6.142    -7.698    3.210     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1779    .   1   1   13   ARG   HA     H   -7.224    -5.232    2.207     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1780    .   1   1   13   ARG   HB2    H   -4.834    -5.670    4.022     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1781    .   1   1   13   ARG   HB3    H   -5.517    -4.107    3.645     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1782    .   1   1   13   ARG   HD2    H   -5.870    -3.592    6.050     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1783    .   1   1   13   ARG   HD3    H   -6.588    -4.827    7.090     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1784    .   1   1   13   ARG   HE     H   -4.544    -6.195    6.192     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1785    .   1   1   13   ARG   HG2    H   -7.582    -4.758    4.805     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1786    .   1   1   13   ARG   HG3    H   -6.851    -6.318    5.201     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1787    .   1   1   13   ARG   HH11   H   -4.490    -2.849    7.365     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HH11   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1788    .   1   1   13   ARG   HH12   H   -2.812    -2.887    7.686     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HH12   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1789    .   1   1   13   ARG   HH21   H   -2.335    -6.213    6.638     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HH21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1790    .   1   1   13   ARG   HH22   H   -1.528    -4.826    7.222     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HH22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1791    .   1   1   13   ARG   N      N   -6.475    -7.156    2.462     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1792    .   1   1   13   ARG   NE     N   -4.643    -5.242    6.442     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   NE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1793    .   1   1   13   ARG   NH1    N   -3.627    -3.361    7.344     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   NH1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1794    .   1   1   13   ARG   NH2    N   -2.393    -5.253    6.935     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   NH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1795    .   1   1   13   ARG   O      O   -4.107    -5.758    1.528     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1796    .   1   1   14   LYS   C      C   -4.539    -2.816    -0.598    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1797    .   1   1   14   LYS   CA     C   -4.750    -4.311    -0.679    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1798    .   1   1   14   LYS   CB     C   -5.200    -4.750    -2.075    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1799    .   1   1   14   LYS   CD     C   -6.950    -4.838    -3.832    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1800    .   1   1   14   LYS   CE     C   -8.388    -4.541    -4.167    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1801    .   1   1   14   LYS   CG     C   -6.587    -4.301    -2.467    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1802    .   1   1   14   LYS   H      H   -6.626    -4.512    0.257     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1803    .   1   1   14   LYS   HA     H   -3.813    -4.793    -0.451    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1804    .   1   1   14   LYS   HB2    H   -4.507    -4.351    -2.801    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1805    .   1   1   14   LYS   HB3    H   -5.166    -5.828    -2.122    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1806    .   1   1   14   LYS   HD2    H   -6.315    -4.377    -4.573    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1807    .   1   1   14   LYS   HD3    H   -6.798    -5.907    -3.842    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1808    .   1   1   14   LYS   HE2    H   -8.654    -5.068    -5.071    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1809    .   1   1   14   LYS   HE3    H   -8.963    -4.924    -3.340    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1810    .   1   1   14   LYS   HG2    H   -7.294    -4.668    -1.739    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1811    .   1   1   14   LYS   HG3    H   -6.616    -3.222    -2.491    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1812    .   1   1   14   LYS   HZ1    H   -9.666    -2.930    -4.519    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1813    .   1   1   14   LYS   HZ2    H   -8.122    -2.692    -5.113    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1814    .   1   1   14   LYS   HZ3    H   -8.417    -2.564    -3.458    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1815    .   1   1   14   LYS   N      N   -5.674    -4.733    0.345     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1816    .   1   1   14   LYS   NZ     N   -8.661    -3.095    -4.320    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1817    .   1   1   14   LYS   O      O   -5.441    -2.086    -0.193    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1818    .   1   1   15   CYS   C      C   -3.751    -0.286    -2.124    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1819    .   1   1   15   CYS   CA     C   -3.082    -0.941    -0.929    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1820    .   1   1   15   CYS   CB     C   -1.573    -0.688    -0.949    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1821    .   1   1   15   CYS   H      H   -2.668    -2.990    -1.224    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1822    .   1   1   15   CYS   HA     H   -3.505    -0.536    -0.022    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1823    .   1   1   15   CYS   HB2    H   -1.165    -1.052    -1.880    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1824    .   1   1   15   CYS   HB3    H   -1.392    0.374     -0.873    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1825    .   1   1   15   CYS   N      N   -3.364    -2.363    -0.948    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1826    .   1   1   15   CYS   O      O   -3.891    -0.916    -3.185    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1827    .   1   1   15   CYS   SG     S   -0.672    -1.506    0.410     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1828    .   1   1   16   CYS   C      C   -3.901    2.023     -4.154    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1829    .   1   1   16   CYS   CA     C   -4.855    1.640     -3.034    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1830    .   1   1   16   CYS   CB     C   -5.602    2.857     -2.490    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1831    .   1   1   16   CYS   H      H   -4.020    1.419     -1.127    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1832    .   1   1   16   CYS   HA     H   -5.578    0.948     -3.438    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1833    .   1   1   16   CYS   HB2    H   -4.899    3.490     -1.968    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1834    .   1   1   16   CYS   HB3    H   -6.048    3.405     -3.306    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1835    .   1   1   16   CYS   N      N   -4.171    0.941     -1.969    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1836    .   1   1   16   CYS   O      O   -2.673    1.980     -3.981    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1837    .   1   1   16   CYS   SG     S   -6.925    2.420     -1.315    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1838    .   1   1   17   LYS   C      C   -2.947    4.013     -6.153    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1839    .   1   1   17   LYS   CA     C   -3.695    2.725     -6.463    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1840    .   1   1   17   LYS   CB     C   -4.615    2.877     -7.668    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1841    .   1   1   17   LYS   CD     C   -4.895    3.164     -10.112   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1842    .   1   1   17   LYS   CE     C   -4.240    3.477     -11.439   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1843    .   1   1   17   LYS   CG     C   -3.908    3.184     -8.970    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1844    .   1   1   17   LYS   H      H   -5.436    2.275     -5.389    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1845    .   1   1   17   LYS   HA     H   -2.976    1.943     -6.659    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1846    .   1   1   17   LYS   HB2    H   -5.170    1.959     -7.797    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1847    .   1   1   17   LYS   HB3    H   -5.313    3.676     -7.466    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1848    .   1   1   17   LYS   HD2    H   -5.346    2.186     -10.162   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1849    .   1   1   17   LYS   HD3    H   -5.662    3.897     -9.911    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1850    .   1   1   17   LYS   HE2    H   -3.387    2.826     -11.555   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1851    .   1   1   17   LYS   HE3    H   -4.949    3.281     -12.230   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1852    .   1   1   17   LYS   HG2    H   -3.451    4.160     -8.906    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1853    .   1   1   17   LYS   HG3    H   -3.149    2.437     -9.145    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1854    .   1   1   17   LYS   HZ1    H   -3.369    5.090     -12.450   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1855    .   1   1   17   LYS   HZ2    H   -3.079    5.116     -10.794   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1856    .   1   1   17   LYS   HZ3    H   -4.588    5.528     -11.387   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1857    .   1   1   17   LYS   N      N   -4.460    2.326     -5.308    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1858    .   1   1   17   LYS   NZ     N   -3.785    4.880     -11.523   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1859    .   1   1   17   LYS   O      O   -3.520    4.963     -5.623    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1860    .   1   1   18   GLY   C      C   0.166     4.570     -5.064    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1861    .   1   1   18   GLY   CA     C   -0.814    5.103     -6.069    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1862    .   1   1   18   GLY   H      H   -1.308    3.278     -6.984    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1863    .   1   1   18   GLY   HA2    H   -0.290    5.484     -6.934    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   HA2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1864    .   1   1   18   GLY   HA3    H   -1.395    5.889     -5.610    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   HA3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1865    .   1   1   18   GLY   N      N   -1.684    4.023     -6.465    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1866    .   1   1   18   GLY   O      O   1.158     5.210     -4.707    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1867    .   1   1   19   MET   C      C   0.743     1.228     -4.262    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1868    .   1   1   19   MET   CA     C   0.685     2.618     -3.719    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1869    .   1   1   19   MET   CB     C   0.057     2.533     -2.325    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1870    .   1   1   19   MET   CE     C   -1.202    5.370     0.366     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1871    .   1   1   19   MET   CG     C   -0.152    3.846     -1.639    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1872    .   1   1   19   MET   H      H   -0.979    2.961     -4.890    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1873    .   1   1   19   MET   HA     H   1.671     3.051     -3.652    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1874    .   1   1   19   MET   HB2    H   -0.904    2.053     -2.413    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1875    .   1   1   19   MET   HB3    H   0.692     1.920     -1.701    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1876    .   1   1   19   MET   HE1    H   -1.722    5.441     1.309     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1877    .   1   1   19   MET   HE2    H   -1.769    5.875     -0.401    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1878    .   1   1   19   MET   HE3    H   -0.230    5.831     0.459     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1879    .   1   1   19   MET   HG2    H   0.822     4.270     -1.446    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1880    .   1   1   19   MET   HG3    H   -0.727    4.499     -2.278    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1881    .   1   1   19   MET   N      N   -0.134    3.376     -4.611    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1882    .   1   1   19   MET   O      O   -0.137    0.819     -5.043    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1883    .   1   1   19   MET   SD     S   -0.996    3.659     -0.071    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   SD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1884    .   1   1   20   VAL   C      C   1.601     -1.693    -3.026    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1885    .   1   1   20   VAL   CA     C   1.826     -0.858    -4.258    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1886    .   1   1   20   VAL   CB     C   3.167     -1.232    -4.953    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1887    .   1   1   20   VAL   CG1    C   3.281     -0.518    -6.287    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   CG1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1888    .   1   1   20   VAL   CG2    C   4.371     -0.905    -4.073    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   CG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1889    .   1   1   20   VAL   H      H   2.460     0.920     -3.362    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1890    .   1   1   20   VAL   HA     H   1.011     -1.047    -4.941    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1891    .   1   1   20   VAL   HB     H   3.157     -2.296    -5.145    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1892    .   1   1   20   VAL   HG11   H   4.205     -0.800    -6.765    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG11   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1893    .   1   1   20   VAL   HG12   H   3.270     0.550     -6.123    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG12   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1894    .   1   1   20   VAL   HG13   H   2.448     -0.794    -6.917    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG13   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1895    .   1   1   20   VAL   HG21   H   4.384     0.155     -3.863    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1896    .   1   1   20   VAL   HG22   H   5.279     -1.180    -4.588    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1897    .   1   1   20   VAL   HG23   H   4.299     -1.455    -3.146    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG23   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1898    .   1   1   20   VAL   N      N   1.741     0.513     -3.902    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1899    .   1   1   20   VAL   O      O   1.999     -1.286    -1.901    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1900    .   1   1   21   CYS   C      C   1.944     -4.368    -1.781    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1901    .   1   1   21   CYS   CA     C   0.634     -3.718    -2.138    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1902    .   1   1   21   CYS   CB     C   -0.404    -4.763    -2.593    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1903    .   1   1   21   CYS   H      H   0.555     -2.987    -4.102    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1904    .   1   1   21   CYS   HA     H   0.256     -3.170    -1.287    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1905    .   1   1   21   CYS   HB2    H   -1.266    -4.246    -2.988    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1906    .   1   1   21   CYS   HB3    H   0.033     -5.356    -3.384    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1907    .   1   1   21   CYS   N      N   0.901     -2.790    -3.205    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1908    .   1   1   21   CYS   O      O   2.511     -5.120    -2.569    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1909    .   1   1   21   CYS   SG     S   -1.019    -5.922    -1.297    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1910    .   1   1   22   ARG   C      C   3.678     -4.730    1.299     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1911    .   1   1   22   ARG   CA     C   3.715     -4.493    -0.223    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1912    .   1   1   22   ARG   CB     C   4.716     -3.391    -0.588    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1913    .   1   1   22   ARG   CD     C   5.952     -4.574    -2.435    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1914    .   1   1   22   ARG   CG     C   6.062     -3.868    -1.087    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1915    .   1   1   22   ARG   CZ     C   7.519     -5.533    -4.125    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   CZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1916    .   1   1   22   ARG   H      H   1.926     -3.482    -0.009    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1917    .   1   1   22   ARG   HA     H   3.970     -5.399    -0.749    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1918    .   1   1   22   ARG   HB2    H   4.277     -2.779    -1.362    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1919    .   1   1   22   ARG   HB3    H   4.871     -2.775    0.285     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1920    .   1   1   22   ARG   HD2    H   5.363     -5.471    -2.322    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1921    .   1   1   22   ARG   HD3    H   5.471     -3.912    -3.141    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1922    .   1   1   22   ARG   HE     H   8.024     -4.700    -2.363    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1923    .   1   1   22   ARG   HG2    H   6.721     -3.018    -1.191    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1924    .   1   1   22   ARG   HG3    H   6.467     -4.556    -0.360    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1925    .   1   1   22   ARG   HH11   H   5.563     -5.671    -4.726    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HH11   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1926    .   1   1   22   ARG   HH12   H   6.698     -6.319    -5.817    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HH12   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1927    .   1   1   22   ARG   HH21   H   9.544     -5.531    -3.895    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HH21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1928    .   1   1   22   ARG   HH22   H   9.009     -6.235    -5.345    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HH22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1929    .   1   1   22   ARG   N      N   2.443     -4.041    -0.630    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1930    .   1   1   22   ARG   NE     N   7.271     -4.937    -2.955    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   NE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1931    .   1   1   22   ARG   NH1    N   6.526     -5.858    -4.944    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   NH1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1932    .   1   1   22   ARG   NH2    N   8.768     -5.782    -4.482    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   NH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1933    .   1   1   22   ARG   O      O   2.561     -4.684    1.925     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1934    .   1   1   23   LEU   C      C   4.288     -4.152    4.112     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1935    .   1   1   23   LEU   CA     C   5.056     -5.200    3.350     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1936    .   1   1   23   LEU   CB     C   6.543     -5.109    3.718     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1937    .   1   1   23   LEU   CD1    C   8.929     -5.789    3.390     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1938    .   1   1   23   LEU   CD2    C   7.128     -7.519    3.276     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1939    .   1   1   23   LEU   CG     C   7.491     -6.066    2.988     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1940    .   1   1   23   LEU   H      H   5.682     -4.977    1.335     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1941    .   1   1   23   LEU   HA     H   4.680     -6.180    3.601     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1942    .   1   1   23   LEU   HB2    H   6.873     -4.100    3.521     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1943    .   1   1   23   LEU   HB3    H   6.636     -5.289    4.778     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1944    .   1   1   23   LEU   HD11   H   9.185     -4.774    3.132     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD11   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1945    .   1   1   23   LEU   HD12   H   9.585     -6.471    2.869     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD12   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1946    .   1   1   23   LEU   HD13   H   9.039     -5.928    4.456     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD13   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1947    .   1   1   23   LEU   HD21   H   7.183     -7.701    4.339     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1948    .   1   1   23   LEU   HD22   H   7.825     -8.168    2.767     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1949    .   1   1   23   LEU   HD23   H   6.128     -7.721    2.925     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD23   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1950    .   1   1   23   LEU   HG     H   7.403     -5.896    1.926     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1951    .   1   1   23   LEU   N      N   4.880     -4.965    1.896     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1952    .   1   1   23   LEU   O      O   3.554     -4.449    5.055     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1953    .   1   1   24   TRP   C      C   3.239     -1.143    2.817     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1954    .   1   1   24   TRP   CA     C   3.681     -1.834    4.096     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1955    .   1   1   24   TRP   CB     C   4.490     -0.887    5.023     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1956    .   1   1   24   TRP   CD1    C   5.516     1.024     3.718     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1957    .   1   1   24   TRP   CD2    C   6.988     -0.549    4.270     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1958    .   1   1   24   TRP   CE2    C   7.657     0.454     3.542     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1959    .   1   1   24   TRP   CE3    C   7.715     -1.646    4.729     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1960    .   1   1   24   TRP   CG     C   5.611     -0.157    4.354     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1961    .   1   1   24   TRP   CH2    C   9.706     -0.696    3.729     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1962    .   1   1   24   TRP   CZ2    C   9.016     0.391     3.266     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1963    .   1   1   24   TRP   CZ3    C   9.067     -1.708    4.455     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1964    .   1   1   24   TRP   H      H   5.106     -2.774    2.953     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1965    .   1   1   24   TRP   HA     H   2.829     -2.246    4.609     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1966    .   1   1   24   TRP   HB2    H   3.823     -0.144    5.433     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1967    .   1   1   24   TRP   HB3    H   4.905     -1.468    5.835     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1968    .   1   1   24   TRP   HD1    H   4.572     1.547     3.636     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1969    .   1   1   24   TRP   HE1    H   6.913     2.223     2.704     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1970    .   1   1   24   TRP   HE3    H   7.238     -2.434    5.290     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1971    .   1   1   24   TRP   HH2    H   10.764    -0.788    3.537     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1972    .   1   1   24   TRP   HZ2    H   9.527     1.163     2.707     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1973    .   1   1   24   TRP   HZ3    H   9.647     -2.552    4.802     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1974    .   1   1   24   TRP   N      N   4.450     -2.941    3.662     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1975    .   1   1   24   TRP   NE1    N   6.737     1.397     3.215     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   NE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1976    .   1   1   24   TRP   O      O   3.862     -1.392    1.768     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1977    .   1   1   25   CYS   C      C   2.771     1.328     1.186     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1978    .   1   1   25   CYS   CA     C   1.746     0.328     1.651     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1979    .   1   1   25   CYS   CB     C   0.369     0.951     1.837     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1980    .   1   1   25   CYS   H      H   1.732     -0.145    3.700     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1981    .   1   1   25   CYS   HA     H   1.683     -0.439    0.892     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1982    .   1   1   25   CYS   HB2    H   0.374     1.565     2.725     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1983    .   1   1   25   CYS   HB3    H   0.134     1.564     0.978     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1984    .   1   1   25   CYS   N      N   2.201     -0.339    2.856     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1985    .   1   1   25   CYS   O      O   3.030     2.354     1.839     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1986    .   1   1   25   CYS   SG     S   -0.954    -0.292    2.017     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1987    .   1   1   26   LYS   C      C   4.019     2.606     -1.610    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1988    .   1   1   26   LYS   CA     C   4.449     1.785     -0.436    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1989    .   1   1   26   LYS   CB     C   5.584     0.829     -0.812    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1990    .   1   1   26   LYS   CD     C   7.978     0.529     -1.449    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1991    .   1   1   26   LYS   CE     C   9.282     1.235     -1.777    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1992    .   1   1   26   LYS   CG     C   6.835     1.512     -1.297    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1993    .   1   1   26   LYS   H      H   3.014     0.271     -0.472    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1994    .   1   1   26   LYS   HA     H   4.799     2.430     0.354     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1995    .   1   1   26   LYS   HB2    H   5.839     0.237     0.055     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1996    .   1   1   26   LYS   HB3    H   5.233     0.167     -1.589    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1997    .   1   1   26   LYS   HD2    H   8.098     -0.017    -0.523    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1998    .   1   1   26   LYS   HD3    H   7.738     -0.161    -2.243    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   1999    .   1   1   26   LYS   HE2    H   9.524     1.909     -0.970    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   2000    .   1   1   26   LYS   HE3    H   10.064    0.494     -1.865    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   2001    .   1   1   26   LYS   HG2    H   6.626     1.957     -2.260    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   2002    .   1   1   26   LYS   HG3    H   7.098     2.286     -0.597    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   2003    .   1   1   26   LYS   HZ1    H   10.122    2.472     -3.201    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   2004    .   1   1   26   LYS   HZ2    H   8.492     2.760     -2.960    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   2005    .   1   1   26   LYS   HZ3    H   9.000     1.392     -3.845    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   2006    .   1   1   26   LYS   N      N   3.353     1.028     0.058     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   2007    .   1   1   26   LYS   NZ     N   9.207     2.009     -3.032    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   2008    .   1   1   26   LYS   O      O   3.444     2.070     -2.543    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   2009    .   1   1   27   LYS   C      C   4.585     4.441     -3.908    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   2010    .   1   1   27   LYS   CA     C   3.909     4.808     -2.621    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   2011    .   1   1   27   LYS   CB     C   4.260     6.256     -2.290    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   2012    .   1   1   27   LYS   CD     C   1.944     7.069     -1.747    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   2013    .   1   1   27   LYS   CE     C   1.102     7.860     -0.755    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   2014    .   1   1   27   LYS   CG     C   3.378     6.915     -1.261    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   2015    .   1   1   27   LYS   H      H   4.683     4.255     -0.732    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   2016    .   1   1   27   LYS   HA     H   2.842     4.751     -2.768    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   2017    .   1   1   27   LYS   HB2    H   5.275     6.284     -1.923    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   2018    .   1   1   27   LYS   HB3    H   4.210     6.835     -3.201    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   2019    .   1   1   27   LYS   HD2    H   1.947     7.588     -2.695    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   2020    .   1   1   27   LYS   HD3    H   1.503     6.094     -1.879    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   2021    .   1   1   27   LYS   HE2    H   0.072     7.870     -1.074    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   2022    .   1   1   27   LYS   HE3    H   1.169     7.376     0.209     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   2023    .   1   1   27   LYS   HG2    H   3.372     6.287     -0.384    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   2024    .   1   1   27   LYS   HG3    H   3.787     7.887     -1.039    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   2025    .   1   1   27   LYS   HZ1    H   1.567     9.724     -1.538    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   2026    .   1   1   27   LYS   HZ2    H   2.531     9.297     -0.232    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   2027    .   1   1   27   LYS   HZ3    H   0.939     9.794     0.013     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   2028    .   1   1   27   LYS   N      N   4.256     3.902     -1.543    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   2029    .   1   1   27   LYS   NZ     N   1.565     9.250     -0.612    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   2030    .   1   1   27   LYS   O      O   5.712     3.921     -3.934    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   2031    .   1   1   28   LYS   C      C   5.319     5.692     -6.543    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   2032    .   1   1   28   LYS   CA     C   4.424     4.505     -6.266    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   2033    .   1   1   28   LYS   CB     C   3.286     4.420     -7.287    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   2034    .   1   1   28   LYS   CD     C   2.549     3.965     -9.634    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   2035    .   1   1   28   LYS   CE     C   2.957     3.489     -11.019   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   2036    .   1   1   28   LYS   CG     C   3.726     4.014     -8.680    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   2037    .   1   1   28   LYS   H      H   3.004     5.092     -4.818    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   2038    .   1   1   28   LYS   HA     H   5.007     3.596     -6.272    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   2039    .   1   1   28   LYS   HB2    H   2.562     3.698     -6.939    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   2040    .   1   1   28   LYS   HB3    H   2.808     5.386     -7.350    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   2041    .   1   1   28   LYS   HD2    H   1.801     3.293     -9.239    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   2042    .   1   1   28   LYS   HD3    H   2.133     4.957     -9.714    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   2043    .   1   1   28   LYS   HE2    H   2.109     3.563     -11.681   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   2044    .   1   1   28   LYS   HE3    H   3.744     4.134     -11.383   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   2045    .   1   1   28   LYS   HG2    H   4.445     4.734     -9.045    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   2046    .   1   1   28   LYS   HG3    H   4.184     3.038     -8.631    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   2047    .   1   1   28   LYS   HZ1    H   2.745     1.448     -10.589   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   2048    .   1   1   28   LYS   HZ2    H   4.336     1.998     -10.477   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   2049    .   1   1   28   LYS   HZ3    H   3.620     1.766     -11.983   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   2050    .   1   1   28   LYS   N      N   3.900     4.710     -4.960    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   2051    .   1   1   28   LYS   NZ     N   3.448     2.088     -11.010   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   2052    .   1   1   28   LYS   O      O   4.935     6.830     -6.253    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   2053    .   1   1   29   LEU   C      C   7.016     7.597     -8.212    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   2054    .   1   1   29   LEU   CA     C   7.499     6.483     -7.277    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   2055    .   1   1   29   LEU   CB     C   8.866     5.871     -7.679    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   2056    .   1   1   29   LEU   CD1    C   8.707     5.488     -10.177   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   2057    .   1   1   29   LEU   CD2    C   10.173    4.040     -8.787    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   2058    .   1   1   29   LEU   CG     C   8.893     4.842     -8.824    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   2059    .   1   1   29   LEU   H      H   6.743     4.512     -7.271    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   2060    .   1   1   29   LEU   HA     H   7.619     6.952     -6.312    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   2061    .   1   1   29   LEU   HB2    H   9.522     6.681     -7.958    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   2062    .   1   1   29   LEU   HB3    H   9.284     5.400     -6.802    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   2063    .   1   1   29   LEU   HD11   H   7.754     5.995     -10.204   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD11   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   2064    .   1   1   29   LEU   HD12   H   8.733     4.729     -10.945   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD12   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   2065    .   1   1   29   LEU   HD13   H   9.498     6.202     -10.347   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD13   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   2066    .   1   1   29   LEU   HD21   H   10.171    3.328     -9.600    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   2067    .   1   1   29   LEU   HD22   H   10.242    3.512     -7.847    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   2068    .   1   1   29   LEU   HD23   H   11.019    4.704     -8.892    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD23   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   2069    .   1   1   29   LEU   HG     H   8.072     4.155     -8.682    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   2070    .   1   1   29   LEU   N      N   6.504     5.437     -7.053    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   2071    .   1   1   29   LEU   O      O   7.439     8.746     -8.088    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   2072    .   1   1   30   TRP   C      C   4.245     7.578     -10.504   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   2073    .   1   1   30   TRP   CA     C   5.520     8.198     -10.003   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   2074    .   1   1   30   TRP   CB     C   6.459     8.559     -11.171   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   2075    .   1   1   30   TRP   CD1    C   5.321     9.487     -13.280   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   2076    .   1   1   30   TRP   CD2    C   5.978     11.060    -11.838   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   2077    .   1   1   30   TRP   CE2    C   5.383     11.691    -12.945   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   2078    .   1   1   30   TRP   CE3    C   6.466     11.850    -10.800   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   2079    .   1   1   30   TRP   CG     C   5.934     9.646     -12.075   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   2080    .   1   1   30   TRP   CH2    C   5.755     13.824    -12.006   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   2081    .   1   1   30   TRP   CZ2    C   5.266     13.076    -13.041   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   2082    .   1   1   30   TRP   CZ3    C   6.350     13.224    -10.891   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   2083    .   1   1   30   TRP   H      H   5.827     6.323     -9.175    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   2084    .   1   1   30   TRP   HA     H   5.276     9.085     -9.438    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   2085    .   1   1   30   TRP   HB2    H   7.405     8.895     -10.768   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   2086    .   1   1   30   TRP   HB3    H   6.627     7.676     -11.771   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   2087    .   1   1   30   TRP   HD1    H   5.135     8.528     -13.741   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   2088    .   1   1   30   TRP   HE1    H   4.541     10.849    -14.673   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   2089    .   1   1   30   TRP   HE3    H   6.926     11.393    -9.937    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   2090    .   1   1   30   TRP   HH2    H   5.684     14.900    -12.038   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   2091    .   1   1   30   TRP   HZ2    H   4.810     13.556    -13.894   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   2092    .   1   1   30   TRP   HZ3    H   6.724     13.848    -10.093   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   2093    .   1   1   30   TRP   N      N   6.123     7.255     -9.107    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   2094    .   1   1   30   TRP   NE1    N   4.989     10.713    -13.807   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   NE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   2095    .   1   1   30   TRP   O      O   4.314     6.711     -11.394   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   4    .   2096    .   1   1   30   TRP   OXT    O   3.171     7.912     -9.964    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   OXT    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2097    .   1   1   1    TYR   C      C   -10.549   -0.049    2.682     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2098    .   1   1   1    TYR   CA     C   -11.803   0.287     3.499     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2099    .   1   1   1    TYR   CB     C   -12.646   1.388     2.817     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2100    .   1   1   1    TYR   CD1    C   -14.232   0.152     1.286     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2101    .   1   1   1    TYR   CD2    C   -12.612   1.588     0.297     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2102    .   1   1   1    TYR   CE1    C   -14.717   -0.168    0.037     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2103    .   1   1   1    TYR   CE2    C   -13.093   1.275     -0.954    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2104    .   1   1   1    TYR   CG     C   -13.170   1.033     1.440     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2105    .   1   1   1    TYR   CZ     C   -14.143   0.399     -1.079    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2106    .   1   1   1    TYR   H1     H   -10.813   1.547     4.804     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   H1     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2107    .   1   1   1    TYR   H2     H   -10.912   -0.065    5.305     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   H2     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2108    .   1   1   1    TYR   H3     H   -12.278   0.933     5.390     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   H3     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2109    .   1   1   1    TYR   HA     H   -12.395   -0.611    3.590     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2110    .   1   1   1    TYR   HB2    H   -13.501   1.609     3.439     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2111    .   1   1   1    TYR   HB3    H   -12.045   2.280     2.725     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2112    .   1   1   1    TYR   HD1    H   -14.683   -0.295    2.161     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2113    .   1   1   1    TYR   HD2    H   -11.785   2.279     0.390     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2114    .   1   1   1    TYR   HE1    H   -15.543   -0.857    -0.053    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2115    .   1   1   1    TYR   HE2    H   -12.638   1.722     -1.827    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2116    .   1   1   1    TYR   HH     H   -15.582   0.110     -2.327    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HH     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2117    .   1   1   1    TYR   N      N   -11.426   0.708     4.838     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2118    .   1   1   1    TYR   O      O   -10.345   -1.197    2.279     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2119    .   1   1   1    TYR   OH     O   -14.616   0.081     -2.326    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   OH     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2120    .   1   1   2    CYS   C      C   -7.303    1.154     2.568     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2121    .   1   1   2    CYS   CA     C   -8.493    0.752     1.706     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2122    .   1   1   2    CYS   CB     C   -8.583    1.611     0.439     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2123    .   1   1   2    CYS   H      H   -9.823    1.812     2.891     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2124    .   1   1   2    CYS   HA     H   -8.406    -0.290    1.435     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2125    .   1   1   2    CYS   HB2    H   -9.486    1.358     -0.093    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2126    .   1   1   2    CYS   HB3    H   -8.626    2.645     0.749     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2127    .   1   1   2    CYS   N      N   -9.695    0.927     2.487     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2128    .   1   1   2    CYS   O      O   -7.473    1.864     3.567     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2129    .   1   1   2    CYS   SG     S   -7.202    1.452     -0.746    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2130    .   1   1   3    GLN   C      C   -4.253    2.232     2.594     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2131    .   1   1   3    GLN   CA     C   -4.947    0.957     3.011     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2132    .   1   1   3    GLN   CB     C   -3.968    -0.220    3.000     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2133    .   1   1   3    GLN   CD     C   -5.146    -1.415    4.869     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2134    .   1   1   3    GLN   CG     C   -4.572    -1.527    3.481     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2135    .   1   1   3    GLN   H      H   -6.070    0.162     1.391     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2136    .   1   1   3    GLN   HA     H   -5.297    1.095     4.023     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2137    .   1   1   3    GLN   HB2    H   -3.573    -0.361    2.007     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2138    .   1   1   3    GLN   HB3    H   -3.146    0.023     3.657     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2139    .   1   1   3    GLN   HE21   H   -3.419    -1.936    5.647     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HE21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2140    .   1   1   3    GLN   HE22   H   -4.707    -1.606    6.764     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HE22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2141    .   1   1   3    GLN   HG2    H   -5.363    -1.813    2.803     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2142    .   1   1   3    GLN   HG3    H   -3.806    -2.289    3.480     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2143    .   1   1   3    GLN   N      N   -6.131    0.693     2.216     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2144    .   1   1   3    GLN   NE2    N   -4.348    -1.679    5.853     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   NE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2145    .   1   1   3    GLN   O      O   -4.161    2.550     1.402     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2146    .   1   1   3    GLN   OE1    O   -6.319    -1.092    5.051     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   OE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2147    .   1   1   4    LYS   C      C   -1.595    3.922     3.431     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2148    .   1   1   4    LYS   CA     C   -3.097    4.211     3.411     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2149    .   1   1   4    LYS   CB     C   -3.463    5.141     4.572     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2150    .   1   1   4    LYS   CD     C   -5.297    6.169     5.967     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2151    .   1   1   4    LYS   CE     C   -6.777    6.107     6.324     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2152    .   1   1   4    LYS   CG     C   -4.967    5.245     4.816     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2153    .   1   1   4    LYS   H      H   -3.934    2.625     4.496     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2154    .   1   1   4    LYS   HA     H   -3.388    4.663     2.476     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2155    .   1   1   4    LYS   HB2    H   -2.998    4.767     5.473     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2156    .   1   1   4    LYS   HB3    H   -3.080    6.129     4.365     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2157    .   1   1   4    LYS   HD2    H   -4.715    5.881     6.829     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2158    .   1   1   4    LYS   HD3    H   -5.048    7.182     5.686     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2159    .   1   1   4    LYS   HE2    H   -7.012    5.106     6.653     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2160    .   1   1   4    LYS   HE3    H   -6.955    6.797     7.134     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2161    .   1   1   4    LYS   HG2    H   -5.438    5.634     3.925     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2162    .   1   1   4    LYS   HG3    H   -5.355    4.260     5.030     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2163    .   1   1   4    LYS   HZ1    H   -7.505    7.424     4.863     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2164    .   1   1   4    LYS   HZ2    H   -8.659    6.389     5.484     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2165    .   1   1   4    LYS   HZ3    H   -7.545    5.807     4.388     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2166    .   1   1   4    LYS   N      N   -3.802    2.959     3.586     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2167    .   1   1   4    LYS   NZ     N   -7.663    6.453     5.193     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2168    .   1   1   4    LYS   O      O   -1.196    2.837     3.847     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2169    .   1   1   5    TRP   C      C   1.263     4.464     4.401     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2170    .   1   1   5    TRP   CA     C   0.716     4.724     3.008     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2171    .   1   1   5    TRP   CB     C   1.424     5.973     2.419     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2172    .   1   1   5    TRP   CD1    C   0.451     8.038     3.594     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2173    .   1   1   5    TRP   CD2    C   2.565     7.613     4.139     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2174    .   1   1   5    TRP   CE2    C   2.146     8.754     4.833     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2175    .   1   1   5    TRP   CE3    C   3.865     7.153     4.330     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2176    .   1   1   5    TRP   CG     C   1.457     7.170     3.340     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2177    .   1   1   5    TRP   CH2    C   4.241     8.967     5.871     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2178    .   1   1   5    TRP   CZ2    C   2.976     9.443     5.703     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2179    .   1   1   5    TRP   CZ3    C   4.689     7.836     5.196     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2180    .   1   1   5    TRP   H      H   -1.154    5.749     2.748     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2181    .   1   1   5    TRP   HA     H   0.931     3.869     2.384     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2182    .   1   1   5    TRP   HB2    H   2.445     5.717     2.177     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2183    .   1   1   5    TRP   HB3    H   0.912     6.263     1.511     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2184    .   1   1   5    TRP   HD1    H   -0.526    7.972     3.150     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2185    .   1   1   5    TRP   HE1    H   0.300     9.733     4.810     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2186    .   1   1   5    TRP   HE3    H   4.228     6.275     3.817     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2187    .   1   1   5    TRP   HH2    H   4.924     9.470     6.540     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2188    .   1   1   5    TRP   HZ2    H   2.647     10.322    6.237     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2189    .   1   1   5    TRP   HZ3    H   5.700     7.496     5.360     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2190    .   1   1   5    TRP   N      N   -0.767    4.902     3.051     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2191    .   1   1   5    TRP   NE1    N   0.857     8.993     4.480     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   NE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2192    .   1   1   5    TRP   O      O   2.334     3.890     4.578     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2193    .   1   1   6    MET   C      C   0.588     3.356     7.248     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2194    .   1   1   6    MET   CA     C   0.869     4.783     6.753     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2195    .   1   1   6    MET   CB     C   0.085     5.818     7.566     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2196    .   1   1   6    MET   CE     C   -2.177    6.881     9.526     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2197    .   1   1   6    MET   CG     C   0.336     5.771     9.058     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2198    .   1   1   6    MET   H      H   -0.318    5.360     5.120     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2199    .   1   1   6    MET   HA     H   1.918     5.025     6.808     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2200    .   1   1   6    MET   HB2    H   0.345     6.805     7.212     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2201    .   1   1   6    MET   HB3    H   -0.967    5.654     7.392     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2202    .   1   1   6    MET   HE1    H   -2.780    7.625     10.025    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2203    .   1   1   6    MET   HE2    H   -2.484    5.894     9.840     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2204    .   1   1   6    MET   HE3    H   -2.304    6.975     8.459     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2205    .   1   1   6    MET   HG2    H   -0.053    4.835     9.434     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2206    .   1   1   6    MET   HG3    H   1.403     5.801     9.213     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2207    .   1   1   6    MET   N      N   0.514     4.910     5.374     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2208    .   1   1   6    MET   O      O   1.138     2.893     8.245     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2209    .   1   1   6    MET   SD     S   -0.452    7.134     9.950     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   SD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2210    .   1   1   7    TRP   C      C   0.094     0.311     5.974     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2211    .   1   1   7    TRP   CA     C   -0.641    1.317     6.862     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2212    .   1   1   7    TRP   CB     C   -2.170    1.148     6.716     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2213    .   1   1   7    TRP   CD1    C   -2.597    2.816     8.670     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2214    .   1   1   7    TRP   CD2    C   -4.435    2.206     7.549     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2215    .   1   1   7    TRP   CE2    C   -4.806    3.108     8.562     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2216    .   1   1   7    TRP   CE3    C   -5.426    1.690     6.722     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2217    .   1   1   7    TRP   CG     C   -3.015    2.035     7.619     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2218    .   1   1   7    TRP   CH2    C   -7.068    2.972     7.936     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2219    .   1   1   7    TRP   CZ2    C   -6.123    3.497     8.762     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2220    .   1   1   7    TRP   CZ3    C   -6.732    2.076     6.925     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2221    .   1   1   7    TRP   H      H   -0.556    3.051     5.674     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2222    .   1   1   7    TRP   HA     H   -0.362    1.143     7.891     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2223    .   1   1   7    TRP   HB2    H   -2.442    1.383     5.698     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2224    .   1   1   7    TRP   HB3    H   -2.434    0.120     6.912     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2225    .   1   1   7    TRP   HD1    H   -1.569    2.902     8.991     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2226    .   1   1   7    TRP   HE1    H   -3.659    4.097     9.991     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2227    .   1   1   7    TRP   HE3    H   -5.183    0.986     5.940     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2228    .   1   1   7    TRP   HH2    H   -8.106    3.248     8.062     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2229    .   1   1   7    TRP   HZ2    H   -6.406    4.191     9.540     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2230    .   1   1   7    TRP   HZ3    H   -7.513    1.686     6.289     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2231    .   1   1   7    TRP   N      N   -0.236    2.663     6.516     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2232    .   1   1   7    TRP   NE1    N   -3.674    3.469     9.230     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   NE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2233    .   1   1   7    TRP   O      O   0.827     0.693     5.048     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2234    .   1   1   8    THR   C      C   -0.537    -2.754    4.747     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2235    .   1   1   8    THR   CA     C   0.568     -1.987    5.505     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2236    .   1   1   8    THR   CB     C   1.341     -2.923    6.476     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2237    .   1   1   8    THR   CG2    C   2.450     -2.153    7.195     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   CG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2238    .   1   1   8    THR   H      H   -0.619    -1.212    7.023     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2239    .   1   1   8    THR   HA     H   1.259     -1.523    4.814     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2240    .   1   1   8    THR   HB     H   1.787     -3.728    5.911     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2241    .   1   1   8    THR   HG1    H   1.003     -3.855    8.162     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HG1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2242    .   1   1   8    THR   HG21   H   2.995     -2.825    7.843     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HG21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2243    .   1   1   8    THR   HG22   H   2.009     -1.366    7.787     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HG22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2244    .   1   1   8    THR   HG23   H   3.127     -1.716    6.475     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HG23   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2245    .   1   1   8    THR   N      N   -0.057    -0.940    6.265     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2246    .   1   1   8    THR   O      O   -1.730    -2.502    5.012     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2247    .   1   1   8    THR   OG1    O   0.451     -3.470    7.466     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   OG1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2248    .   1   1   9    CYS   C      C   -1.053    -5.850    3.065     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2249    .   1   1   9    CYS   CA     C   -1.308    -4.362    3.151     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2250    .   1   1   9    CYS   CB     C   -1.638    -3.761    1.790     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2251    .   1   1   9    CYS   H      H   0.702     -3.877    3.505     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2252    .   1   1   9    CYS   HA     H   -2.164    -4.231    3.796     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2253    .   1   1   9    CYS   HB2    H   -2.440    -4.329    1.342     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2254    .   1   1   9    CYS   HB3    H   -1.964    -2.741    1.928     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2255    .   1   1   9    CYS   N      N   -0.213    -3.655    3.804     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2256    .   1   1   9    CYS   O      O   0.014     -6.334    3.483     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2257    .   1   1   9    CYS   SG     S   -0.258    -3.756    0.624     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2258    .   1   1   10   ASP   C      C   -2.708    -8.448    1.214     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2259    .   1   1   10   ASP   CA     C   -1.986    -8.028    2.458     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2260    .   1   1   10   ASP   CB     C   -2.700    -8.667    3.660     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2261    .   1   1   10   ASP   CG     C   -1.962    -8.568    4.960     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2262    .   1   1   10   ASP   H      H   -2.804    -6.134    2.138     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2263    .   1   1   10   ASP   HA     H   -0.959    -8.361    2.430     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2264    .   1   1   10   ASP   HB2    H   -3.647    -8.166    3.790     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2265    .   1   1   10   ASP   HB3    H   -2.888    -9.710    3.448     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2266    .   1   1   10   ASP   N      N   -2.023    -6.575    2.542     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2267    .   1   1   10   ASP   O      O   -2.962    -7.618    0.337     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2268    .   1   1   10   ASP   OD1    O   -1.240    -9.510    5.315     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   OD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2269    .   1   1   10   ASP   OD2    O   -2.118    -7.573    5.667     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   OD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2270    .   1   1   11   SER   C      C   -5.228    -9.694    0.083     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2271    .   1   1   11   SER   CA     C   -3.800    -10.225   0.023     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2272    .   1   1   11   SER   CB     C   -3.769    -11.753   0.051     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2273    .   1   1   11   SER   H      H   -2.769    -10.360   1.814     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2274    .   1   1   11   SER   HA     H   -3.336    -9.881    -0.889    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2275    .   1   1   11   SER   HB2    H   -4.475    -12.139   -0.668    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2276    .   1   1   11   SER   HB3    H   -2.778    -12.105   -0.193    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2277    .   1   1   11   SER   HG     H   -4.403    -13.158   1.190     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   HG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2278    .   1   1   11   SER   N      N   -3.045    -9.715    1.129     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2279    .   1   1   11   SER   O      O   -5.784    -9.261    -0.928    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2280    .   1   1   11   SER   OG     O   -4.116    -12.247   1.344     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   OG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2281    .   1   1   12   GLU   C      C   -7.193    -7.735    1.742     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2282    .   1   1   12   GLU   CA     C   -7.152    -9.222    1.444     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2283    .   1   1   12   GLU   CB     C   -7.895    -10.006   2.502     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2284    .   1   1   12   GLU   CD     C   -8.873    -12.183   3.187     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2285    .   1   1   12   GLU   CG     C   -7.999    -11.486   2.202     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2286    .   1   1   12   GLU   H      H   -5.303    -10.051   2.039     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2287    .   1   1   12   GLU   HA     H   -7.647    -9.375    0.497     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2288    .   1   1   12   GLU   HB2    H   -7.392    -9.884    3.449     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2289    .   1   1   12   GLU   HB3    H   -8.897    -9.610    2.588     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2290    .   1   1   12   GLU   HG2    H   -8.409    -11.617   1.212     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2291    .   1   1   12   GLU   HG3    H   -7.011    -11.920   2.244     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2292    .   1   1   12   GLU   N      N   -5.803    -9.696    1.276     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2293    .   1   1   12   GLU   O      O   -8.077    -7.036    1.260     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2294    .   1   1   12   GLU   OE1    O   -8.375    -12.606   4.241     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   OE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2295    .   1   1   12   GLU   OE2    O   -10.101   -12.278   2.945     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   OE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2296    .   1   1   13   ARG   C      C   -5.684    -5.109    1.559     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2297    .   1   1   13   ARG   CA     C   -6.218    -5.805    2.797     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2298    .   1   1   13   ARG   CB     C   -5.391    -5.427    4.035     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2299    .   1   1   13   ARG   CD     C   -5.204    -5.364    6.544     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2300    .   1   1   13   ARG   CG     C   -5.942    -5.960    5.351     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2301    .   1   1   13   ARG   CZ     C   -2.801    -4.894    7.067     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   CZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2302    .   1   1   13   ARG   H      H   -5.609    -7.842    2.971     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2303    .   1   1   13   ARG   HA     H   -7.243    -5.493    2.935     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2304    .   1   1   13   ARG   HB2    H   -4.389    -5.812    3.911     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2305    .   1   1   13   ARG   HB3    H   -5.341    -4.350    4.100     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2306    .   1   1   13   ARG   HD2    H   -5.351    -4.293    6.539     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2307    .   1   1   13   ARG   HD3    H   -5.617    -5.777    7.452     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2308    .   1   1   13   ARG   HE     H   -3.465    -6.451    6.020     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2309    .   1   1   13   ARG   HG2    H   -6.990    -5.707    5.422     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2310    .   1   1   13   ARG   HG3    H   -5.830    -7.034    5.369     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2311    .   1   1   13   ARG   HH11   H   -4.044    -3.512    7.911     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HH11   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2312    .   1   1   13   ARG   HH12   H   -2.388    -3.257    8.209     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HH12   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2313    .   1   1   13   ARG   HH21   H   -1.323    -6.095    6.415     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HH21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2314    .   1   1   13   ARG   HH22   H   -0.780    -4.711    7.303     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HH22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2315    .   1   1   13   ARG   N      N   -6.259    -7.240    2.554     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2316    .   1   1   13   ARG   NE     N   -3.763    -5.640    6.504     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   NE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2317    .   1   1   13   ARG   NH1    N   -3.099    -3.817    7.771     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   NH1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2318    .   1   1   13   ARG   NH2    N   -1.543    -5.256    6.930     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   NH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2319    .   1   1   13   ARG   O      O   -4.501    -5.238    1.223     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2320    .   1   1   14   LYS   C      C   -5.571    -2.430    -0.173    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2321    .   1   1   14   LYS   CA     C   -6.259    -3.751    -0.362    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2322    .   1   1   14   LYS   CB     C   -7.549    -3.535    -1.159    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2323    .   1   1   14   LYS   CD     C   -9.591    -4.499    -2.306    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2324    .   1   1   14   LYS   CE     C   -9.344    -3.718    -3.597    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2325    .   1   1   14   LYS   CG     C   -8.282    -4.811    -1.566    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2326    .   1   1   14   LYS   H      H   -7.423    -4.206    1.322     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2327    .   1   1   14   LYS   HA     H   -5.620    -4.414    -0.923    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2328    .   1   1   14   LYS   HB2    H   -8.223    -2.939    -0.562    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2329    .   1   1   14   LYS   HB3    H   -7.300    -2.983    -2.053    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2330    .   1   1   14   LYS   HD2    H   -10.086   -5.425    -2.551    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2331    .   1   1   14   LYS   HD3    H   -10.227   -3.915    -1.657    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2332    .   1   1   14   LYS   HE2    H   -8.824    -2.801    -3.359    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2333    .   1   1   14   LYS   HE3    H   -8.732    -4.317    -4.253    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2334    .   1   1   14   LYS   HG2    H   -7.643    -5.389    -2.217    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2335    .   1   1   14   LYS   HG3    H   -8.506    -5.386    -0.679    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2336    .   1   1   14   LYS   HZ1    H   -10.373   -2.822    -5.147    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2337    .   1   1   14   LYS   HZ2    H   -11.214   -2.786    -3.689    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2338    .   1   1   14   LYS   HZ3    H   -11.125   -4.217    -4.583    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2339    .   1   1   14   LYS   N      N   -6.549    -4.374    0.910     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2340    .   1   1   14   LYS   NZ     N   -10.601   -3.368    -4.292    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2341    .   1   1   14   LYS   O      O   -6.058    -1.568    0.561     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2342    .   1   1   15   CYS   C      C   -4.164    -0.174    -1.915    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2343    .   1   1   15   CYS   CA     C   -3.743    -1.017    -0.742    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2344    .   1   1   15   CYS   CB     C   -2.240    -1.240    -0.748    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2345    .   1   1   15   CYS   H      H   -4.107    -2.988    -1.381    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2346    .   1   1   15   CYS   HA     H   -4.041    -0.510    0.162     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2347    .   1   1   15   CYS   HB2    H   -1.986    -2.011    -0.041    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2348    .   1   1   15   CYS   HB3    H   -1.956    -1.556    -1.739    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2349    .   1   1   15   CYS   N      N   -4.454    -2.263    -0.816    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2350    .   1   1   15   CYS   O      O   -4.378    -0.699    -3.012    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2351    .   1   1   15   CYS   SG     S   -1.258    0.237     -0.344    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2352    .   1   1   16   CYS   C      C   -3.761    2.148     -3.867    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2353    .   1   1   16   CYS   CA     C   -4.788    1.980     -2.737    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2354    .   1   1   16   CYS   CB     C   -5.158    3.341     -2.149    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2355    .   1   1   16   CYS   H      H   -4.077    1.460     -0.821    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2356    .   1   1   16   CYS   HA     H   -5.679    1.531     -3.148    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2357    .   1   1   16   CYS   HB2    H   -4.276    3.770     -1.699    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2358    .   1   1   16   CYS   HB3    H   -5.477    3.984     -2.956    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2359    .   1   1   16   CYS   N      N   -4.303    1.094     -1.704    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2360    .   1   1   16   CYS   O      O   -2.537    2.158     -3.632    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2361    .   1   1   16   CYS   SG     S   -6.474    3.347     -0.862    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2362    .   1   1   17   LYS   C      C   -2.748    3.814     -6.122    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2363    .   1   1   17   LYS   CA     C   -3.402    2.461     -6.240    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2364    .   1   1   17   LYS   CB     C   -4.182    2.317     -7.538    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2365    .   1   1   17   LYS   CD     C   -5.465    0.784     -9.059    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2366    .   1   1   17   LYS   CE     C   -5.710    -0.670    -9.450    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2367    .   1   1   17   LYS   CG     C   -4.597    0.887     -7.824    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2368    .   1   1   17   LYS   H      H   -5.222    2.157     -5.219    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2369    .   1   1   17   LYS   HA     H   -2.622    1.715     -6.208    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2370    .   1   1   17   LYS   HB2    H   -5.069    2.931     -7.480    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2371    .   1   1   17   LYS   HB3    H   -3.569    2.663     -8.357    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2372    .   1   1   17   LYS   HD2    H   -6.416    1.256     -8.860    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2373    .   1   1   17   LYS   HD3    H   -4.974    1.290     -9.876    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2374    .   1   1   17   LYS   HE2    H   -6.387    -0.684    -10.293   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2375    .   1   1   17   LYS   HE3    H   -4.771    -1.109    -9.750    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2376    .   1   1   17   LYS   HG2    H   -3.709    0.290     -7.969    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2377    .   1   1   17   LYS   HG3    H   -5.144    0.509     -6.973    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2378    .   1   1   17   LYS   HZ1    H   -6.550    -2.418    -8.717    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2379    .   1   1   17   LYS   HZ2    H   -7.150    -1.028    -7.964    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2380    .   1   1   17   LYS   HZ3    H   -5.604    -1.604    -7.589    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2381    .   1   1   17   LYS   N      N   -4.253    2.235     -5.092    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2382    .   1   1   17   LYS   NZ     N   -6.296    -1.475    -8.355    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2383    .   1   1   17   LYS   O      O   -3.374    4.779     -5.683    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2384    .   1   1   18   GLY   C      C   0.341     4.692     -5.256    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2385    .   1   1   18   GLY   CA     C   -0.719    5.049     -6.260    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2386    .   1   1   18   GLY   H      H   -1.085    3.121     -6.950    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2387    .   1   1   18   GLY   HA2    H   -0.265    5.374     -7.185    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   HA2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2388    .   1   1   18   GLY   HA3    H   -1.337    5.834     -5.851    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   HA3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2389    .   1   1   18   GLY   N      N   -1.514    3.878     -6.494    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2390    .   1   1   18   GLY   O      O   1.303     5.445     -5.010    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2391    .   1   1   19   MET   C      C   1.264     1.505     -4.222    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2392    .   1   1   19   MET   CA     C   1.034     2.919     -3.752    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2393    .   1   1   19   MET   CB     C   0.477     2.922     -2.327    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2394    .   1   1   19   MET   CE     C   -2.028    3.994     -0.570    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2395    .   1   1   19   MET   CG     C   0.482     4.289     -1.678    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2396    .   1   1   19   MET   H      H   -0.717    3.069     -4.820    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2397    .   1   1   19   MET   HA     H   1.969     3.462     -3.774    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2398    .   1   1   19   MET   HB2    H   -0.541    2.561     -2.359    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2399    .   1   1   19   MET   HB3    H   1.066     2.251     -1.718    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2400    .   1   1   19   MET   HE1    H   -2.662    4.025     0.302     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2401    .   1   1   19   MET   HE2    H   -2.082    3.011     -1.013    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2402    .   1   1   19   MET   HE3    H   -2.362    4.733     -1.284    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2403    .   1   1   19   MET   HG2    H   1.516     4.520     -1.479    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2404    .   1   1   19   MET   HG3    H   0.048     5.018     -2.346    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2405    .   1   1   19   MET   N      N   0.126     3.543     -4.653    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2406    .   1   1   19   MET   O      O   0.482     0.972     -5.034    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2407    .   1   1   19   MET   SD     S   -0.351    4.349     -0.097    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   SD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2408    .   1   1   20   VAL   C      C   2.313     -1.286    -2.876    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2409    .   1   1   20   VAL   CA     C   2.655     -0.436    -4.070    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2410    .   1   1   20   VAL   CB     C   4.183     -0.557    -4.368    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2411    .   1   1   20   VAL   CG1    C   4.566     -1.979    -4.769    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   CG1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2412    .   1   1   20   VAL   CG2    C   4.608     0.431     -5.445    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   CG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2413    .   1   1   20   VAL   H      H   2.872     1.401     -3.101    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2414    .   1   1   20   VAL   HA     H   2.089     -0.753    -4.933    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2415    .   1   1   20   VAL   HB     H   4.717     -0.318    -3.460    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2416    .   1   1   20   VAL   HG11   H   4.302     -2.661    -3.975    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG11   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2417    .   1   1   20   VAL   HG12   H   5.629     -2.028    -4.947    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG12   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2418    .   1   1   20   VAL   HG13   H   4.040     -2.253    -5.672    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG13   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2419    .   1   1   20   VAL   HG21   H   4.401     1.437     -5.114    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2420    .   1   1   20   VAL   HG22   H   4.056     0.231     -6.353    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2421    .   1   1   20   VAL   HG23   H   5.666     0.325     -5.637    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG23   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2422    .   1   1   20   VAL   N      N   2.299     0.911     -3.736    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2423    .   1   1   20   VAL   O      O   2.691     -0.953    -1.739    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2424    .   1   1   21   CYS   C      C   2.201     -4.227    -1.769    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2425    .   1   1   21   CYS   CA     C   1.143     -3.190    -2.053    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2426    .   1   1   21   CYS   CB     C   -0.186    -3.867    -2.409    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2427    .   1   1   21   CYS   H      H   1.376     -2.583    -4.039    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2428    .   1   1   21   CYS   HA     H   1.001     -2.580    -1.172    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2429    .   1   1   21   CYS   HB2    H   -0.886    -3.124    -2.761    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2430    .   1   1   21   CYS   HB3    H   -0.012    -4.588    -3.195    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2431    .   1   1   21   CYS   N      N   1.586     -2.340    -3.112    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2432    .   1   1   21   CYS   O      O   2.733     -4.859    -2.692    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2433    .   1   1   21   CYS   SG     S   -0.964    -4.753    -1.005    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2434    .   1   1   22   ARG   C      C   3.379     -5.370    1.451     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2435    .   1   1   22   ARG   CA     C   3.501     -5.317    -0.076    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2436    .   1   1   22   ARG   CB     C   4.908     -4.822    -0.501    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2437    .   1   1   22   ARG   CD     C   5.530     -6.769    -1.969    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2438    .   1   1   22   ARG   CG     C   5.927     -5.924    -0.764    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2439    .   1   1   22   ARG   CZ     C   6.434     -8.673    -3.304    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   CZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2440    .   1   1   22   ARG   H      H   2.080     -3.843    0.178     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2441    .   1   1   22   ARG   HA     H   3.300     -6.289    -0.499    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2442    .   1   1   22   ARG   HB2    H   4.812     -4.246    -1.409    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2443    .   1   1   22   ARG   HB3    H   5.298     -4.182    0.277     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2444    .   1   1   22   ARG   HD2    H   4.581     -7.240    -1.773    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2445    .   1   1   22   ARG   HD3    H   5.441     -6.124    -2.831    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2446    .   1   1   22   ARG   HE     H   7.259     -7.869    -1.625    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2447    .   1   1   22   ARG   HG2    H   6.883     -5.466    -0.965    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2448    .   1   1   22   ARG   HG3    H   6.006     -6.562    0.102     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2449    .   1   1   22   ARG   HH11   H   4.730     -7.865    -4.139    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HH11   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2450    .   1   1   22   ARG   HH12   H   5.376     -9.208    -4.960    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HH12   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2451    .   1   1   22   ARG   HH21   H   8.122     -9.732    -2.831    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HH21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2452    .   1   1   22   ARG   HH22   H   7.297     -10.267   -4.232    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HH22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2453    .   1   1   22   ARG   N      N   2.527     -4.381    -0.513    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2454    .   1   1   22   ARG   NE     N   6.512     -7.817    -2.265    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   NE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2455    .   1   1   22   ARG   NH1    N   5.446     -8.567    -4.191    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   NH1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2456    .   1   1   22   ARG   NH2    N   7.350     -9.619    -3.464    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   NH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2457    .   1   1   22   ARG   O      O   2.281     -5.024    2.019     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2458    .   1   1   23   LEU   C      C   4.062     -4.528    4.157     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2459    .   1   1   23   LEU   CA     C   4.568     -5.841    3.563     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2460    .   1   1   23   LEU   CB     C   6.039     -6.167    3.970     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2461    .   1   1   23   LEU   CD1    C   7.738     -7.119    5.557     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2462    .   1   1   23   LEU   CD2    C   6.308     -5.266    6.352     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2463    .   1   1   23   LEU   CG     C   6.353     -6.503    5.457     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2464    .   1   1   23   LEU   H      H   5.253     -6.061    1.595     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2465    .   1   1   23   LEU   HA     H   3.919     -6.639    3.893     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2466    .   1   1   23   LEU   HB2    H   6.350     -7.016    3.380     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2467    .   1   1   23   LEU   HB3    H   6.653     -5.330    3.676     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2468    .   1   1   23   LEU   HD11   H   8.471     -6.420    5.181     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD11   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2469    .   1   1   23   LEU   HD12   H   7.772     -8.028    4.975     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD12   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2470    .   1   1   23   LEU   HD13   H   7.956     -7.347    6.592     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD13   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2471    .   1   1   23   LEU   HD21   H   7.048     -4.553    6.022     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2472    .   1   1   23   LEU   HD22   H   6.513     -5.550    7.374     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2473    .   1   1   23   LEU   HD23   H   5.326     -4.817    6.293     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD23   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2474    .   1   1   23   LEU   HG     H   5.637     -7.226    5.821     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2475    .   1   1   23   LEU   N      N   4.473     -5.774    2.114     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2476    .   1   1   23   LEU   O      O   3.372     -4.532    5.153     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2477    .   1   1   24   TRP   C      C   3.352     -1.462    2.582     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2478    .   1   1   24   TRP   CA     C   3.829     -2.147    3.863     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2479    .   1   1   24   TRP   CB     C   4.903     -1.294    4.579     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2480    .   1   1   24   TRP   CD1    C   6.020     0.469     3.122     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2481    .   1   1   24   TRP   CD2    C   7.164     -1.440    3.244     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2482    .   1   1   24   TRP   CE2    C   7.870     -0.551    2.413     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2483    .   1   1   24   TRP   CE3    C   7.690     -2.707    3.473     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2484    .   1   1   24   TRP   CG     C   5.984     -0.764    3.683     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2485    .   1   1   24   TRP   CH2    C   9.561     -2.144    2.054     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2486    .   1   1   24   TRP   CZ2    C   9.071     -0.893    1.810     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2487    .   1   1   24   TRP   CZ3    C   8.882     -3.048    2.876     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2488    .   1   1   24   TRP   H      H   4.905     -3.465    2.684     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2489    .   1   1   24   TRP   HA     H   2.992     -2.323    4.520     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2490    .   1   1   24   TRP   HB2    H   4.425     -0.446    5.045     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2491    .   1   1   24   TRP   HB3    H   5.369     -1.896    5.344     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2492    .   1   1   24   TRP   HD1    H   5.234     1.192     3.289     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2493    .   1   1   24   TRP   HE1    H   7.420     1.401     1.834     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2494    .   1   1   24   TRP   HE3    H   7.175     -3.410    4.110     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2495    .   1   1   24   TRP   HH2    H   10.492    -2.455    1.607     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2496    .   1   1   24   TRP   HZ2    H   9.613     -0.210    1.172     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2497    .   1   1   24   TRP   HZ3    H   9.306     -4.028    3.040     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2498    .   1   1   24   TRP   N      N   4.350     -3.430    3.490     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2499    .   1   1   24   TRP   NE1    N   7.153     0.607     2.349     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   NE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2500    .   1   1   24   TRP   O      O   3.670     -1.943    1.489     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2501    .   1   1   25   CYS   C      C   3.258     1.372     1.183     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2502    .   1   1   25   CYS   CA     C   2.192     0.354     1.519     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2503    .   1   1   25   CYS   CB     C   0.829     1.029     1.688     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2504    .   1   1   25   CYS   H      H   2.270     -0.084    3.568     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2505    .   1   1   25   CYS   HA     H   2.141     -0.349    0.700     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2506    .   1   1   25   CYS   HB2    H   0.784     1.491     2.664     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2507    .   1   1   25   CYS   HB3    H   0.717     1.791     0.932     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2508    .   1   1   25   CYS   N      N   2.583     -0.401    2.694     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2509    .   1   1   25   CYS   O      O   3.507     2.306     1.950     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2510    .   1   1   25   CYS   SG     S   -0.590    -0.106    1.554     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2511    .   1   1   26   LYS   C      C   4.434     2.996     -1.408    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2512    .   1   1   26   LYS   CA     C   4.976     2.019     -0.389    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2513    .   1   1   26   LYS   CB     C   6.098     1.144     -0.981    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2514    .   1   1   26   LYS   CD     C   8.331     0.932     -2.090    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2515    .   1   1   26   LYS   CE     C   9.389     1.594     -2.964    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2516    .   1   1   26   LYS   CG     C   7.237     1.897     -1.659    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2517    .   1   1   26   LYS   H      H   3.606     0.426     -0.507    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2518    .   1   1   26   LYS   HA     H   5.358     2.560     0.464     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2519    .   1   1   26   LYS   HB2    H   6.525     0.554     -0.182    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2520    .   1   1   26   LYS   HB3    H   5.658     0.472     -1.700    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2521    .   1   1   26   LYS   HD2    H   8.812     0.538     -1.207    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2522    .   1   1   26   LYS   HD3    H   7.877     0.120     -2.641    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2523    .   1   1   26   LYS   HE2    H   10.153    0.862     -3.179    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2524    .   1   1   26   LYS   HE3    H   8.922     1.907     -3.886    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2525    .   1   1   26   LYS   HG2    H   6.851     2.408     -2.528    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2526    .   1   1   26   LYS   HG3    H   7.651     2.613     -0.967    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2527    .   1   1   26   LYS   HZ1    H   10.464    2.492     -1.417    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2528    .   1   1   26   LYS   HZ2    H   9.360     3.534     -2.157    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2529    .   1   1   26   LYS   HZ3    H   10.785    3.143     -2.929    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2530    .   1   1   26   LYS   N      N   3.898     1.172     0.064     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2531    .   1   1   26   LYS   NZ     N   10.032    2.758     -2.322    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2532    .   1   1   26   LYS   O      O   3.937     2.594     -2.448    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2533    .   1   1   27   LYS   C      C   4.878     5.669     -3.103    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2534    .   1   1   27   LYS   CA     C   3.945     5.263     -1.987    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2535    .   1   1   27   LYS   CB     C   3.439     6.483     -1.202    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2536    .   1   1   27   LYS   CD     C   3.867     8.367     0.383     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2537    .   1   1   27   LYS   CE     C   4.851     9.035     1.325     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2538    .   1   1   27   LYS   CG     C   4.476     7.167     -0.322    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2539    .   1   1   27   LYS   H      H   4.976     4.536     -0.293    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2540    .   1   1   27   LYS   HA     H   3.097     4.807     -2.473    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2541    .   1   1   27   LYS   HB2    H   3.074     7.214     -1.907    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2542    .   1   1   27   LYS   HB3    H   2.617     6.173     -0.572    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2543    .   1   1   27   LYS   HD2    H   3.552     9.082     -0.361    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2544    .   1   1   27   LYS   HD3    H   3.007     8.036     0.947     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2545    .   1   1   27   LYS   HE2    H   5.147     8.324     2.082     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2546    .   1   1   27   LYS   HE3    H   5.720     9.338     0.760     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2547    .   1   1   27   LYS   HG2    H   4.833     6.466     0.416     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2548    .   1   1   27   LYS   HG3    H   5.298     7.501     -0.939    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2549    .   1   1   27   LYS   HZ1    H   4.067     10.967    1.285     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2550    .   1   1   27   LYS   HZ2    H   4.908     10.622    2.697     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2551    .   1   1   27   LYS   HZ3    H   3.362     9.983     2.449     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2552    .   1   1   27   LYS   N      N   4.513     4.262     -1.113    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2553    .   1   1   27   LYS   NZ     N   4.262     10.224    1.986     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2554    .   1   1   27   LYS   O      O   6.113     5.632     -2.959    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2555    .   1   1   28   LYS   C      C   5.490     7.899     -5.124    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2556    .   1   1   28   LYS   CA     C   5.010     6.491     -5.377    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2557    .   1   1   28   LYS   CB     C   4.137     6.456     -6.639    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2558    .   1   1   28   LYS   CD     C   5.061     4.336     -7.611    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2559    .   1   1   28   LYS   CE     C   4.739     2.988     -8.220    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2560    .   1   1   28   LYS   CG     C   3.808     5.060     -7.153    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2561    .   1   1   28   LYS   H      H   3.306     5.943     -4.289    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2562    .   1   1   28   LYS   HA     H   5.869     5.855     -5.527    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2563    .   1   1   28   LYS   HB2    H   3.207     6.958     -6.422    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2564    .   1   1   28   LYS   HB3    H   4.644     6.997     -7.424    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2565    .   1   1   28   LYS   HD2    H   5.563     4.938     -8.354    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2566    .   1   1   28   LYS   HD3    H   5.716     4.189     -6.766    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2567    .   1   1   28   LYS   HE2    H   4.266     2.371     -7.471    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2568    .   1   1   28   LYS   HE3    H   4.062     3.132     -9.047    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2569    .   1   1   28   LYS   HG2    H   3.345     4.493     -6.359    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2570    .   1   1   28   LYS   HG3    H   3.123     5.143     -7.985    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2571    .   1   1   28   LYS   HZ1    H   6.622     2.126     -7.926    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2572    .   1   1   28   LYS   HZ2    H   6.443     2.906     -9.400    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2573    .   1   1   28   LYS   HZ3    H   5.722     1.408     -9.160    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2574    .   1   1   28   LYS   N      N   4.284     6.009     -4.229    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2575    .   1   1   28   LYS   NZ     N   5.957     2.310     -8.702    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2576    .   1   1   28   LYS   O      O   4.845     8.671     -4.406    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2577    .   1   1   29   LEU   C      C   6.958     10.361    -6.784    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2578    .   1   1   29   LEU   CA     C   7.193     9.537     -5.534    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2579    .   1   1   29   LEU   CB     C   8.690     9.421     -5.236    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2580    .   1   1   29   LEU   CD1    C   10.566    8.602     -3.802    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2581    .   1   1   29   LEU   CD2    C   8.426     9.302     -2.728    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2582    .   1   1   29   LEU   CG     C   9.063     8.661     -3.957    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2583    .   1   1   29   LEU   H      H   7.069     7.567     -6.262    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2584    .   1   1   29   LEU   HA     H   6.703     10.022    -4.704    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2585    .   1   1   29   LEU   HB2    H   9.156     8.922     -6.072    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2586    .   1   1   29   LEU   HB3    H   9.100     10.417    -5.165    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2587    .   1   1   29   LEU   HD11   H   10.818    8.065     -2.899    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD11   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2588    .   1   1   29   LEU   HD12   H   10.958    9.607     -3.752    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD12   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2589    .   1   1   29   LEU   HD13   H   10.984    8.092     -4.656    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD13   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2590    .   1   1   29   LEU   HD21   H   8.730     8.764     -1.844    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2591    .   1   1   29   LEU   HD22   H   7.350     9.262     -2.816    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2592    .   1   1   29   LEU   HD23   H   8.744     10.332    -2.652    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD23   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2593    .   1   1   29   LEU   HG     H   8.701     7.646     -4.038    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2594    .   1   1   29   LEU   N      N   6.610     8.225     -5.696    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2595    .   1   1   29   LEU   O      O   7.390     11.505    -6.870    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2596    .   1   1   30   TRP   C      C   7.100     10.593    -9.889    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2597    .   1   1   30   TRP   CA     C   5.886     10.350    -9.019    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2598    .   1   1   30   TRP   CB     C   5.041     11.632    -8.847    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2599    .   1   1   30   TRP   CD1    C   3.435     11.332    -6.867    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2600    .   1   1   30   TRP   CD2    C   2.450     11.200    -8.869    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2601    .   1   1   30   TRP   CE2    C   1.470     11.021    -7.873    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2602    .   1   1   30   TRP   CE3    C   2.063     11.159    -10.211   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2603    .   1   1   30   TRP   CG     C   3.704     11.396    -8.201    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2604    .   1   1   30   TRP   CH2    C   -0.220    10.771    -9.498    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2605    .   1   1   30   TRP   CZ2    C   0.129     10.806    -8.177    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2606    .   1   1   30   TRP   CZ3    C   0.731     10.945    -10.512   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2607    .   1   1   30   TRP   H      H   6.041     8.809     -7.576    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2608    .   1   1   30   TRP   HA     H   5.288     9.605     -9.524    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2609    .   1   1   30   TRP   HB2    H   5.585     12.332    -8.232    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2610    .   1   1   30   TRP   HB3    H   4.872     12.071    -9.819    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2611    .   1   1   30   TRP   HD1    H   4.181     11.442    -6.095    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2612    .   1   1   30   TRP   HE1    H   1.666     11.016    -5.784    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2613    .   1   1   30   TRP   HE3    H   2.787     11.290    -11.002   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2614    .   1   1   30   TRP   HH2    H   -1.250    10.605    -9.779    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2615    .   1   1   30   TRP   HZ2    H   -0.623    10.671    -7.413    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2616    .   1   1   30   TRP   HZ3    H   0.412     10.908    -11.544   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2617    .   1   1   30   TRP   N      N   6.269     9.747     -7.738    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2618    .   1   1   30   TRP   NE1    N   2.096     11.103    -6.664    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   NE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2619    .   1   1   30   TRP   O      O   7.664     11.690    -9.873    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   5    .   2620    .   1   1   30   TRP   OXT    O   7.534     9.644     -10.575   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   OXT    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2621    .   1   1   1    TYR   C      C   -10.609   1.152     2.742     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2622    .   1   1   1    TYR   CA     C   -11.560   1.640     3.807     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2623    .   1   1   1    TYR   CB     C   -11.040   1.219     5.186     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2624    .   1   1   1    TYR   CD1    C   -12.723   0.765     7.001     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2625    .   1   1   1    TYR   CD2    C   -11.919   2.986     6.742     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2626    .   1   1   1    TYR   CE1    C   -13.520   1.171     8.045     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2627    .   1   1   1    TYR   CE2    C   -12.713   3.397     7.781     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2628    .   1   1   1    TYR   CG     C   -11.907   1.664     6.333     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2629    .   1   1   1    TYR   CZ     C   -13.511   2.486     8.429     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2630    .   1   1   1    TYR   H1     H   -12.848   0.052     3.612     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   H1     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2631    .   1   1   1    TYR   H2     H   -13.174   1.348     2.601     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   H2     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2632    .   1   1   1    TYR   H3     H   -13.579   1.459     4.240     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   H3     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2633    .   1   1   1    TYR   HA     H   -11.623   2.717     3.761     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2634    .   1   1   1    TYR   HB2    H   -10.976   0.142     5.222     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2635    .   1   1   1    TYR   HB3    H   -10.051   1.631     5.333     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2636    .   1   1   1    TYR   HD1    H   -12.727   -0.272    6.699     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2637    .   1   1   1    TYR   HD2    H   -11.292   3.704     6.234     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2638    .   1   1   1    TYR   HE1    H   -14.147   0.453     8.554     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2639    .   1   1   1    TYR   HE2    H   -12.701   4.436     8.076     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2640    .   1   1   1    TYR   HH     H   -14.752   3.706     9.213     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HH     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2641    .   1   1   1    TYR   N      N   -12.883   1.089     3.565     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2642    .   1   1   1    TYR   O      O   -10.942   0.252     1.966     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2643    .   1   1   1    TYR   OH     O   -14.297   2.893     9.470     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   OH     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2644    .   1   1   2    CYS   C      C   -7.133    1.598     2.590     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2645    .   1   1   2    CYS   CA     C   -8.403    1.384     1.808     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2646    .   1   1   2    CYS   CB     C   -8.444    2.280     0.560     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2647    .   1   1   2    CYS   H      H   -9.254    2.462     3.339     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2648    .   1   1   2    CYS   HA     H   -8.502    0.344     1.538     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2649    .   1   1   2    CYS   HB2    H   -9.420    2.215     0.108     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2650    .   1   1   2    CYS   HB3    H   -8.262    3.296     0.877     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2651    .   1   1   2    CYS   N      N   -9.457    1.735     2.706     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2652    .   1   1   2    CYS   O      O   -7.151    2.330     3.594     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2653    .   1   1   2    CYS   SG     S   -7.216    1.881     -0.733    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2654    .   1   1   3    GLN   C      C   -4.080    2.333     2.689     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2655    .   1   1   3    GLN   CA     C   -4.859    1.069     2.967     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2656    .   1   1   3    GLN   CB     C   -3.982    -0.162    2.794     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2657    .   1   1   3    GLN   CD     C   -5.278    -1.533    4.449     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2658    .   1   1   3    GLN   CG     C   -4.671    -1.484    3.074     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2659    .   1   1   3    GLN   H      H   -6.067    0.523     1.321     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2660    .   1   1   3    GLN   HA     H   -5.184    1.112     3.994     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2661    .   1   1   3    GLN   HB2    H   -3.586    -0.183    1.793     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2662    .   1   1   3    GLN   HB3    H   -3.149    -0.073    3.477     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2663    .   1   1   3    GLN   HE21   H   -3.577    -2.197    5.212     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HE21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2664    .   1   1   3    GLN   HE22   H   -4.880    -1.990    6.324     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HE22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2665    .   1   1   3    GLN   HG2    H   -5.457    -1.626    2.346     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2666    .   1   1   3    GLN   HG3    H   -3.949    -2.282    2.983     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2667    .   1   1   3    GLN   N      N   -6.058    0.998     2.179     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2668    .   1   1   3    GLN   NE2    N   -4.510    -1.942    5.417     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   NE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2669    .   1   1   3    GLN   O      O   -3.877    2.724     1.530     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2670    .   1   1   3    GLN   OE1    O   -6.439    -1.186    4.641     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   OE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2671    .   1   1   4    LYS   C      C   -1.434    3.847     3.693     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2672    .   1   1   4    LYS   CA     C   -2.909    4.200     3.671     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2673    .   1   1   4    LYS   CB     C   -3.236    5.126     4.839     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2674    .   1   1   4    LYS   CD     C   -4.943    6.486     6.124     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2675    .   1   1   4    LYS   CE     C   -4.546    5.866     7.461     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2676    .   1   1   4    LYS   CG     C   -4.706    5.525     4.954     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2677    .   1   1   4    LYS   H      H   -3.921    2.627     4.630     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2678    .   1   1   4    LYS   HA     H   -3.134    4.701     2.743     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2679    .   1   1   4    LYS   HB2    H   -2.951    4.625     5.753     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2680    .   1   1   4    LYS   HB3    H   -2.648    6.022     4.728     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2681    .   1   1   4    LYS   HD2    H   -4.351    7.376     5.969     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2682    .   1   1   4    LYS   HD3    H   -5.989    6.751     6.154     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2683    .   1   1   4    LYS   HE2    H   -5.132    4.973     7.619     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2684    .   1   1   4    LYS   HE3    H   -3.501    5.599     7.432     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2685    .   1   1   4    LYS   HG2    H   -5.010    6.011     4.039     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2686    .   1   1   4    LYS   HG3    H   -5.300    4.635     5.106     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2687    .   1   1   4    LYS   HZ1    H   -4.471    6.346     9.488     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2688    .   1   1   4    LYS   HZ2    H   -5.776    7.021     8.703     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2689    .   1   1   4    LYS   HZ3    H   -4.246    7.668     8.488     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2690    .   1   1   4    LYS   N      N   -3.686    2.988     3.753     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2691    .   1   1   4    LYS   NZ     N   -4.772    6.776     8.592     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2692    .   1   1   4    LYS   O      O   -1.083    2.718     3.971     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2693    .   1   1   5    TRP   C      C   1.475     4.222     4.745     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2694    .   1   1   5    TRP   CA     C   0.868     4.636     3.395     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2695    .   1   1   5    TRP   CB     C   1.543     5.919     2.888     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2696    .   1   1   5    TRP   CD1    C   2.136     7.476     4.830     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2697    .   1   1   5    TRP   CD2    C   0.277     8.052     3.741     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2698    .   1   1   5    TRP   CE2    C   0.486     8.963     4.791     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2699    .   1   1   5    TRP   CE3    C   -0.835    8.221     2.913     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2700    .   1   1   5    TRP   CG     C   1.342     7.101     3.791     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2701    .   1   1   5    TRP   CH2    C   -1.450    10.157    4.209     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2702    .   1   1   5    TRP   CZ2    C   -0.373    10.017    5.037     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2703    .   1   1   5    TRP   CZ3    C   -1.684    9.275     3.157     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2704    .   1   1   5    TRP   H      H   -0.941    5.736     3.345     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2705    .   1   1   5    TRP   HA     H   1.055     3.849     2.680     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2706    .   1   1   5    TRP   HB2    H   2.604     5.759     2.784     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2707    .   1   1   5    TRP   HB3    H   1.122     6.165     1.924     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2708    .   1   1   5    TRP   HD1    H   3.032     6.954     5.129     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2709    .   1   1   5    TRP   HE1    H   2.022     9.023     6.225     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2710    .   1   1   5    TRP   HE3    H   -1.033    7.553     2.088     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2711    .   1   1   5    TRP   HH2    H   -2.147    10.968    4.359     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2712    .   1   1   5    TRP   HZ2    H   -0.209    10.709    5.850     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2713    .   1   1   5    TRP   HZ3    H   -2.550    9.426     2.529     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2714    .   1   1   5    TRP   N      N   -0.589    4.830     3.473     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2715    .   1   1   5    TRP   NE1    N   1.619     8.582     5.441     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   NE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2716    .   1   1   5    TRP   O      O   2.553     3.636     4.798     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2717    .   1   1   6    MET   C      C   0.821     2.786     7.461     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2718    .   1   1   6    MET   CA     C   1.250     4.206     7.162     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2719    .   1   1   6    MET   CB     C   0.635     5.137     8.197     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2720    .   1   1   6    MET   CE     C   -1.345    5.239     10.761    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2721    .   1   1   6    MET   CG     C   1.137     4.890     9.604     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2722    .   1   1   6    MET   H      H   -0.022    5.101     5.721     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2723    .   1   1   6    MET   HA     H   2.327     4.282     7.201     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2724    .   1   1   6    MET   HB2    H   0.853     6.158     7.921     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2725    .   1   1   6    MET   HB3    H   -0.435    4.997     8.187     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2726    .   1   1   6    MET   HE1    H   -1.319    4.177     10.963    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2727    .   1   1   6    MET   HE2    H   -1.759    5.411     9.779     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2728    .   1   1   6    MET   HE3    H   -1.967    5.723     11.499    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2729    .   1   1   6    MET   HG2    H   0.975     3.847     9.837     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2730    .   1   1   6    MET   HG3    H   2.195     5.091     9.593     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2731    .   1   1   6    MET   N      N   0.793     4.568     5.825     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2732    .   1   1   6    MET   O      O   1.371     2.101     8.325     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2733    .   1   1   6    MET   SD     S   0.315     5.905     10.854    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   SD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2734    .   1   1   7    TRP   C      C   0.022     0.091     6.013     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2735    .   1   1   7    TRP   CA     C   -0.725    1.062     6.894     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2736    .   1   1   7    TRP   CB     C   -2.235    1.036     6.577     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2737    .   1   1   7    TRP   CD1    C   -2.722    2.477     8.671     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2738    .   1   1   7    TRP   CD2    C   -4.544    1.851     7.534     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2739    .   1   1   7    TRP   CE2    C   -4.950    2.627     8.631     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2740    .   1   1   7    TRP   CE3    C   -5.518    1.347     6.679     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2741    .   1   1   7    TRP   CG     C   -3.113    1.767     7.566     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2742    .   1   1   7    TRP   CH2    C   -7.215    2.405     8.029     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2743    .   1   1   7    TRP   CZ2    C   -6.285    2.911     8.887     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2744    .   1   1   7    TRP   CZ3    C   -6.842    1.627     6.934     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2745    .   1   1   7    TRP   H      H   -0.482    2.963     6.036     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2746    .   1   1   7    TRP   HA     H   -0.580    0.767     7.923     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2747    .   1   1   7    TRP   HB2    H   -2.392    1.492     5.611     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2748    .   1   1   7    TRP   HB3    H   -2.566    0.009     6.531     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2749    .   1   1   7    TRP   HD1    H   -1.691    2.598     8.977     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2750    .   1   1   7    TRP   HE1    H   -3.825    3.550     10.129    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2751    .   1   1   7    TRP   HE3    H   -5.255    0.733     5.831     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2752    .   1   1   7    TRP   HH2    H   -8.263    2.600     8.192     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2753    .   1   1   7    TRP   HZ2    H   -6.597    3.512     9.729     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2754    .   1   1   7    TRP   HZ3    H   -7.607    1.243     6.275     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2755    .   1   1   7    TRP   N      N   -0.167    2.370     6.747     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2756    .   1   1   7    TRP   NE1    N   -3.825    2.996     9.313     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   NE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2757    .   1   1   7    TRP   O      O   0.900     0.474     5.227     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2758    .   1   1   8    THR   C      C   -0.722    -2.956    4.692     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2759    .   1   1   8    THR   CA     C   0.344     -2.176    5.435     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2760    .   1   1   8    THR   CB     C   1.093     -3.077    6.455     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2761    .   1   1   8    THR   CG2    C   2.106     -2.250    7.254     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   CG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2762    .   1   1   8    THR   H      H   -1.072    -1.375    6.709     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2763    .   1   1   8    THR   HA     H   1.045     -1.731    4.747     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2764    .   1   1   8    THR   HB     H   1.614     -3.866    5.933     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2765    .   1   1   8    THR   HG1    H   -0.393    -2.909    7.715     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HG1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2766    .   1   1   8    THR   HG21   H   2.649     -2.896    7.926     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HG21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2767    .   1   1   8    THR   HG22   H   1.572     -1.505    7.826     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HG22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2768    .   1   1   8    THR   HG23   H   2.796     -1.742    6.593     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HG23   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2769    .   1   1   8    THR   N      N   -0.313    -1.134    6.136     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2770    .   1   1   8    THR   O      O   -1.921    -2.741    4.961     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2771    .   1   1   8    THR   OG1    O   0.148     -3.637    7.390     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   OG1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2772    .   1   1   9    CYS   C      C   -1.287    -6.030    3.340     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2773    .   1   1   9    CYS   CA     C   -1.435    -4.542    3.125     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2774    .   1   1   9    CYS   CB     C   -1.526    -4.202    1.645     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2775    .   1   1   9    CYS   H      H   0.560     -4.006    3.495     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2776    .   1   1   9    CYS   HA     H   -2.351    -4.231    3.607     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2777    .   1   1   9    CYS   HB2    H   -2.437    -4.617    1.244     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2778    .   1   1   9    CYS   HB3    H   -1.549    -3.126    1.533     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2779    .   1   1   9    CYS   N      N   -0.371    -3.826    3.769     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2780    .   1   1   9    CYS   O      O   -0.299    -6.484    3.935     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2781    .   1   1   9    CYS   SG     S   -0.168    -4.829    0.648     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2782    .   1   1   10   ASP   C      C   -2.766    -8.733    1.654     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2783    .   1   1   10   ASP   CA     C   -2.316    -8.214    2.989     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2784    .   1   1   10   ASP   CB     C   -3.376    -8.673    4.038     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2785    .   1   1   10   ASP   CG     C   -3.127    -8.235    5.457     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2786    .   1   1   10   ASP   H      H   -2.973    -6.338    2.346     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2787    .   1   1   10   ASP   HA     H   -1.345    -8.606    3.247     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2788    .   1   1   10   ASP   HB2    H   -4.340    -8.283    3.749     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2789    .   1   1   10   ASP   HB3    H   -3.431    -9.752    4.019     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2790    .   1   1   10   ASP   N      N   -2.259    -6.771    2.870     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2791    .   1   1   10   ASP   O      O   -2.761    -8.005    0.665     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2792    .   1   1   10   ASP   OD1    O   -2.237    -8.798    6.128     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   OD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2793    .   1   1   10   ASP   OD2    O   -3.863    -7.349    5.947     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   OD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2794    .   1   1   11   SER   C      C   -5.188    -10.031   0.299     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2795    .   1   1   11   SER   CA     C   -3.742    -10.538   0.455     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2796    .   1   1   11   SER   CB     C   -3.671    -12.040   0.623     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2797    .   1   1   11   SER   H      H   -3.032    -10.552   2.391     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2798    .   1   1   11   SER   HA     H   -3.161    -10.247   -0.405    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2799    .   1   1   11   SER   HB2    H   -4.448    -12.510   0.038     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2800    .   1   1   11   SER   HB3    H   -2.703    -12.402   0.307     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2801    .   1   1   11   SER   HG     H   -4.441    -13.129   2.066     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   HG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2802    .   1   1   11   SER   N      N   -3.155    -9.958    1.619     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2803    .   1   1   11   SER   O      O   -5.672    -9.784    -0.813    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2804    .   1   1   11   SER   OG     O   -3.852    -12.366   2.007     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   OG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2805    .   1   1   12   GLU   C      C   -7.262    -7.820    1.393     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2806    .   1   1   12   GLU   CA     C   -7.209    -9.355    1.459     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2807    .   1   1   12   GLU   CB     C   -7.928    -9.864    2.709     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2808    .   1   1   12   GLU   CD     C   -8.027    -9.849    5.211     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2809    .   1   1   12   GLU   CG     C   -7.220    -9.516    4.006     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2810    .   1   1   12   GLU   H      H   -5.384    -10.059   2.261     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2811    .   1   1   12   GLU   HA     H   -7.711    -9.750    0.589     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2812    .   1   1   12   GLU   HB2    H   -8.919    -9.437    2.742     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2813    .   1   1   12   GLU   HB3    H   -8.013    -10.941   2.650     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2814    .   1   1   12   GLU   HG2    H   -6.292    -10.066   4.053     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2815    .   1   1   12   GLU   HG3    H   -7.007    -8.458    4.005     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2816    .   1   1   12   GLU   N      N   -5.846    -9.839    1.427     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2817    .   1   1   12   GLU   O      O   -8.109    -7.253    0.726     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2818    .   1   1   12   GLU   OE1    O   -7.772    -10.885   5.841     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   OE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2819    .   1   1   12   GLU   OE2    O   -8.928    -9.061    5.565     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   OE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2820    .   1   1   13   ARG   C      C   -5.287    -5.233    1.137     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2821    .   1   1   13   ARG   CA     C   -6.339    -5.709    2.098     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2822    .   1   1   13   ARG   CB     C   -6.028    -5.152    3.492     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2823    .   1   1   13   ARG   CD     C   -6.709    -4.819    5.878     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2824    .   1   1   13   ARG   CG     C   -7.044    -5.500    4.563     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2825    .   1   1   13   ARG   CZ     C   -4.762    -4.640    7.430     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   CZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2826    .   1   1   13   ARG   H      H   -5.694    -7.653    2.601     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2827    .   1   1   13   ARG   HA     H   -7.309    -5.358    1.782     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2828    .   1   1   13   ARG   HB2    H   -5.069    -5.535    3.808     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2829    .   1   1   13   ARG   HB3    H   -5.963    -4.075    3.424     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2830    .   1   1   13   ARG   HD2    H   -6.694    -3.754    5.707     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2831    .   1   1   13   ARG   HD3    H   -7.471    -5.057    6.603     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2832    .   1   1   13   ARG   HE     H   -4.951    -5.997    5.977     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2833    .   1   1   13   ARG   HG2    H   -8.020    -5.174    4.241     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2834    .   1   1   13   ARG   HG3    H   -7.049    -6.569    4.714     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2835    .   1   1   13   ARG   HH11   H   -6.194    -3.222    7.804     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HH11   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2836    .   1   1   13   ARG   HH12   H   -4.862    -3.164    8.847     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HH12   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2837    .   1   1   13   ARG   HH21   H   -3.150    -5.880    7.354     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HH21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2838    .   1   1   13   ARG   HH22   H   -3.076    -4.700    8.576     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HH22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2839    .   1   1   13   ARG   N      N   -6.367    -7.159    2.094     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2840    .   1   1   13   ARG   NE     N   -5.396    -5.222    6.408     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   NE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2841    .   1   1   13   ARG   NH1    N   -5.303    -3.609    8.060     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   NH1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2842    .   1   1   13   ARG   NH2    N   -3.589    -5.098    7.812     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   NH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2843    .   1   1   13   ARG   O      O   -4.132    -5.517    1.335     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2844    .   1   1   14   LYS   C      C   -4.540    -2.540    -0.695    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2845    .   1   1   14   LYS   CA     C   -4.718    -4.043    -0.860    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2846    .   1   1   14   LYS   CB     C   -5.135    -4.385    -2.296    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2847    .   1   1   14   LYS   CD     C   -5.549    -6.181    -4.038    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2848    .   1   1   14   LYS   CE     C   -6.936    -5.698    -4.441    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2849    .   1   1   14   LYS   CG     C   -5.216    -5.884    -2.576    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2850    .   1   1   14   LYS   H      H   -6.625    -4.344    -0.025    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2851    .   1   1   14   LYS   HA     H   -3.771    -4.518    -0.650    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2852    .   1   1   14   LYS   HB2    H   -6.104    -3.945    -2.484    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2853    .   1   1   14   LYS   HB3    H   -4.420    -3.951    -2.977    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2854    .   1   1   14   LYS   HD2    H   -4.820    -5.694    -4.669    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2855    .   1   1   14   LYS   HD3    H   -5.494    -7.249    -4.191    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2856    .   1   1   14   LYS   HE2    H   -7.012    -4.636    -4.253    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2857    .   1   1   14   LYS   HE3    H   -7.067    -5.879    -5.499    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2858    .   1   1   14   LYS   HG2    H   -4.264    -6.334    -2.338    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2859    .   1   1   14   LYS   HG3    H   -5.982    -6.314    -1.946    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2860    .   1   1   14   LYS   HZ1    H   -7.961    -6.209    -2.679    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2861    .   1   1   14   LYS   HZ2    H   -7.935    -7.421    -3.823    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2862    .   1   1   14   LYS   HZ3    H   -8.947    -6.098    -4.036    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2863    .   1   1   14   LYS   N      N   -5.675    -4.551    0.103     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2864    .   1   1   14   LYS   NZ     N   -8.007    -6.390    -3.703    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2865    .   1   1   14   LYS   O      O   -5.455    -1.840    -0.240    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2866    .   1   1   15   CYS   C      C   -3.808    0.096     -2.107    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2867    .   1   1   15   CYS   CA     C   -3.095    -0.620    -0.973    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2868    .   1   1   15   CYS   CB     C   -1.587    -0.373    -1.037    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2869    .   1   1   15   CYS   H      H   -2.686    -2.644    -1.398    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2870    .   1   1   15   CYS   HA     H   -3.488    -0.241    -0.046    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2871    .   1   1   15   CYS   HB2    H   -1.226    -0.648    -2.017    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2872    .   1   1   15   CYS   HB3    H   -1.394    0.677     -0.870    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2873    .   1   1   15   CYS   N      N   -3.380    -2.044    -1.056    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2874    .   1   1   15   CYS   O      O   -4.106    -0.526    -3.137    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2875    .   1   1   15   CYS   SG     S   -0.627    -1.321    0.194     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2876    .   1   1   16   CYS   C      C   -4.022    2.287     -4.215    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2877    .   1   1   16   CYS   CA     C   -4.843    2.135     -2.924    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2878    .   1   1   16   CYS   CB     C   -5.181    3.521     -2.379    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2879    .   1   1   16   CYS   H      H   -3.880    1.807     -1.078    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2880    .   1   1   16   CYS   HA     H   -5.762    1.614     -3.144    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2881    .   1   1   16   CYS   HB2    H   -4.266    4.082     -2.259    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2882    .   1   1   16   CYS   HB3    H   -5.812    4.029     -3.094    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2883    .   1   1   16   CYS   N      N   -4.119    1.360     -1.919    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2884    .   1   1   16   CYS   O      O   -2.795    2.050     -4.227    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2885    .   1   1   16   CYS   SG     S   -6.043    3.535     -0.767    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2886    .   1   1   17   LYS   C      C   -3.092    4.080     -6.422    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2887    .   1   1   17   LYS   CA     C   -4.025    2.887     -6.565    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2888    .   1   1   17   LYS   CB     C   -5.037    3.112     -7.690    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2889    .   1   1   17   LYS   CD     C   -6.926    2.174     -9.100    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2890    .   1   1   17   LYS   CE     C   -6.252    2.435     -10.447   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2891    .   1   1   17   LYS   CG     C   -5.924    1.909     -7.973    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2892    .   1   1   17   LYS   H      H   -5.667    2.742     -5.249    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2893    .   1   1   17   LYS   HA     H   -3.431    2.012     -6.784    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2894    .   1   1   17   LYS   HB2    H   -5.668    3.951     -7.435    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2895    .   1   1   17   LYS   HB3    H   -4.489    3.342     -8.590    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2896    .   1   1   17   LYS   HD2    H   -7.563    1.311     -9.198    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2897    .   1   1   17   LYS   HD3    H   -7.527    3.031     -8.834    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2898    .   1   1   17   LYS   HE2    H   -7.016    2.654     -11.179   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2899    .   1   1   17   LYS   HE3    H   -5.599    3.289     -10.355   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2900    .   1   1   17   LYS   HG2    H   -5.294    1.079     -8.252    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2901    .   1   1   17   LYS   HG3    H   -6.463    1.659     -7.071    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2902    .   1   1   17   LYS   HZ1    H   -4.720    1.022     -10.245   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2903    .   1   1   17   LYS   HZ2    H   -4.986    1.516     -11.808   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2904    .   1   1   17   LYS   HZ3    H   -6.072    0.445     -11.083   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2905    .   1   1   17   LYS   N      N   -4.691    2.643     -5.301    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2906    .   1   1   17   LYS   NZ     N   -5.469    1.277     -10.919   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2907    .   1   1   17   LYS   O      O   -3.503    5.159     -5.975    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2908    .   1   1   18   GLY   C      C   0.153     4.416     -5.533    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2909    .   1   1   18   GLY   CA     C   -0.835    4.888     -6.575    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2910    .   1   1   18   GLY   H      H   -1.622    3.033     -7.221    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2911    .   1   1   18   GLY   HA2    H   -0.319    5.072     -7.506    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   HA2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2912    .   1   1   18   GLY   HA3    H   -1.295    5.801     -6.229    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   HA3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2913    .   1   1   18   GLY   N      N   -1.852    3.879     -6.780    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2914    .   1   1   18   GLY   O      O   1.176     5.059     -5.262    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2915    .   1   1   19   MET   C      C   0.858     1.219     -4.400    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2916    .   1   1   19   MET   CA     C   0.663     2.643     -3.963    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2917    .   1   1   19   MET   CB     C   0.008     2.638     -2.577    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2918    .   1   1   19   MET   CE     C   -1.177    5.634     0.035     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2919    .   1   1   19   MET   CG     C   -0.155    3.993     -1.938    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2920    .   1   1   19   MET   H      H   -1.038    2.881     -5.141    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2921    .   1   1   19   MET   HA     H   1.614     3.150     -3.910    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2922    .   1   1   19   MET   HB2    H   -0.973    2.197     -2.666    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2923    .   1   1   19   MET   HB3    H   0.605     2.022     -1.922    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2924    .   1   1   19   MET   HE1    H   -1.723    6.155     -0.738    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2925    .   1   1   19   MET   HE2    H   -0.184    6.049     0.115     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2926    .   1   1   19   MET   HE3    H   -1.695    5.742     0.977     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2927    .   1   1   19   MET   HG2    H   0.839     4.356     -1.720    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2928    .   1   1   19   MET   HG3    H   -0.663    4.661     -2.616    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2929    .   1   1   19   MET   N      N   -0.174    3.301     -4.932    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2930    .   1   1   19   MET   O      O   0.064     0.697     -5.198    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2931    .   1   1   19   MET   SD     S   -1.067    3.900     -0.387    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   SD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2932    .   1   1   20   VAL   C      C   1.826     -1.571    -2.933    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2933    .   1   1   20   VAL   CA     C   2.123     -0.779    -4.192    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2934    .   1   1   20   VAL   CB     C   3.580     -1.059    -4.715    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2935    .   1   1   20   VAL   CG1    C   4.645     -0.671    -3.703    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   CG1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2936    .   1   1   20   VAL   CG2    C   3.746     -2.515    -5.139    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   CG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2937    .   1   1   20   VAL   H      H   2.516     1.094     -3.338    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2938    .   1   1   20   VAL   HA     H   1.409     -1.083    -4.943    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2939    .   1   1   20   VAL   HB     H   3.732     -0.440    -5.588    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2940    .   1   1   20   VAL   HG11   H   5.624     -0.883    -4.106    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG11   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2941    .   1   1   20   VAL   HG12   H   4.498     -1.237    -2.795    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG12   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2942    .   1   1   20   VAL   HG13   H   4.563     0.384     -3.487    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG13   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2943    .   1   1   20   VAL   HG21   H   3.055     -2.741    -5.937    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2944    .   1   1   20   VAL   HG22   H   3.542     -3.159    -4.295    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2945    .   1   1   20   VAL   HG23   H   4.758     -2.677    -5.481    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG23   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2946    .   1   1   20   VAL   N      N   1.886     0.605     -3.920    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2947    .   1   1   20   VAL   O      O   2.163     -1.132    -1.812    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2948    .   1   1   21   CYS   C      C   2.044     -4.315    -1.642    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2949    .   1   1   21   CYS   CA     C   0.803     -3.529    -2.006    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2950    .   1   1   21   CYS   CB     C   -0.363    -4.457    -2.389    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2951    .   1   1   21   CYS   H      H   0.847     -2.928    -4.001    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2952    .   1   1   21   CYS   HA     H   0.517     -2.912    -1.166    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2953    .   1   1   21   CYS   HB2    H   -1.180    -3.854    -2.753    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2954    .   1   1   21   CYS   HB3    H   -0.033    -5.114    -3.181    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2955    .   1   1   21   CYS   N      N   1.136     -2.669    -3.100    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2956    .   1   1   21   CYS   O      O   2.557     -5.110    -2.446    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2957    .   1   1   21   CYS   SG     S   -1.045    -5.504    -1.046    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2958    .   1   1   22   ARG   C      C   3.547     -4.882    1.540     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2959    .   1   1   22   ARG   CA     C   3.734     -4.659    0.016     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2960    .   1   1   22   ARG   CB     C   4.917     -3.681    -0.250    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2961    .   1   1   22   ARG   CD     C   6.600     -4.895    -1.731    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2962    .   1   1   22   ARG   CG     C   6.322     -4.296    -0.348    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2963    .   1   1   22   ARG   CZ     C   5.548     -6.482    -3.337    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   CZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2964    .   1   1   22   ARG   H      H   2.086     -3.426    0.136     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2965    .   1   1   22   ARG   HA     H   3.901     -5.590    -0.502    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2966    .   1   1   22   ARG   HB2    H   4.725     -3.169    -1.180    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2967    .   1   1   22   ARG   HB3    H   4.924     -2.948    0.543     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2968    .   1   1   22   ARG   HD2    H   6.517     -4.114    -2.470    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2969    .   1   1   22   ARG   HD3    H   7.611     -5.276    -1.735    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2970    .   1   1   22   ARG   HE     H   5.148     -6.354    -1.365    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2971    .   1   1   22   ARG   HG2    H   7.052     -3.523    -0.158    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2972    .   1   1   22   ARG   HG3    H   6.427     -5.071    0.395     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2973    .   1   1   22   ARG   HH11   H   6.952     -5.274    -4.209    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HH11   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2974    .   1   1   22   ARG   HH12   H   6.226     -6.382    -5.269    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HH12   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2975    .   1   1   22   ARG   HH21   H   4.098     -7.829    -2.830    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HH21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2976    .   1   1   22   ARG   HH22   H   4.557     -7.873    -4.469    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HH22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2977    .   1   1   22   ARG   N      N   2.546     -4.052    -0.464    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2978    .   1   1   22   ARG   NE     N   5.684     -5.982    -2.102    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   NE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2979    .   1   1   22   ARG   NH1    N   6.283     -6.009    -4.340    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   NH1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2980    .   1   1   22   ARG   NH2    N   4.675     -7.457    -3.565    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   NH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2981    .   1   1   22   ARG   O      O   2.412     -4.696    2.093     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2982    .   1   1   23   LEU   C      C   4.205     -4.142    4.383     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2983    .   1   1   23   LEU   CA     C   4.676     -5.413    3.680     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2984    .   1   1   23   LEU   CB     C   6.087     -5.768    4.134     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2985    .   1   1   23   LEU   CD1    C   8.095     -7.243    4.045     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2986    .   1   1   23   LEU   CD2    C   5.824     -8.255    3.817     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2987    .   1   1   23   LEU   CG     C   6.691     -7.034    3.525     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2988    .   1   1   23   LEU   H      H   5.454     -5.451    1.721     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2989    .   1   1   23   LEU   HA     H   4.008     -6.220    3.937     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2990    .   1   1   23   LEU   HB2    H   6.733     -4.937    3.893     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2991    .   1   1   23   LEU   HB3    H   6.073     -5.886    5.208     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2992    .   1   1   23   LEU   HD11   H   8.075     -7.338    5.120     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD11   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2993    .   1   1   23   LEU   HD12   H   8.710     -6.400    3.767     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD12   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2994    .   1   1   23   LEU   HD13   H   8.503     -8.144    3.613     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD13   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2995    .   1   1   23   LEU   HD21   H   5.714     -8.375    4.884     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2996    .   1   1   23   LEU   HD22   H   6.297     -9.134    3.404     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2997    .   1   1   23   LEU   HD23   H   4.852     -8.128    3.364     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD23   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2998    .   1   1   23   LEU   HG     H   6.754     -6.908    2.455     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   2999    .   1   1   23   LEU   N      N   4.640     -5.244    2.222     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3000    .   1   1   23   LEU   O      O   3.859     -4.165    5.552     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3001    .   1   1   24   TRP   C      C   3.163     -1.165    2.782     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3002    .   1   1   24   TRP   CA     C   3.670     -1.813    4.069     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3003    .   1   1   24   TRP   CB     C   4.680     -0.902    4.805     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3004    .   1   1   24   TRP   CD1    C   5.542     0.993     3.377     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3005    .   1   1   24   TRP   CD2    C   6.948     -0.730    3.494     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3006    .   1   1   24   TRP   CE2    C   7.522     0.256     2.667     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3007    .   1   1   24   TRP   CE3    C   7.651     -1.911    3.723     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3008    .   1   1   24   TRP   CG     C   5.678     -0.231    3.923     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3009    .   1   1   24   TRP   CH2    C   9.430     -1.075    2.316     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3010    .   1   1   24   TRP   CZ2    C   8.765     0.091     2.074     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3011    .   1   1   24   TRP   CZ3    C   8.886     -2.072    3.132     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3012    .   1   1   24   TRP   H      H   4.666     -3.049    2.776     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3013    .   1   1   24   TRP   HA     H   2.843     -2.069    4.708     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3014    .   1   1   24   TRP   HB2    H   4.139     -0.127    5.329     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3015    .   1   1   24   TRP   HB3    H   5.219     -1.499    5.526     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3016    .   1   1   24   TRP   HD1    H   4.649     1.577     3.559     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3017    .   1   1   24   TRP   HE1    H   6.769     2.133     2.094     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3018    .   1   1   24   TRP   HE3    H   7.245     -2.689    4.351     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3019    .   1   1   24   TRP   HH2    H   10.401    -1.241    1.874     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3020    .   1   1   24   TRP   HZ2    H   9.204     0.849     1.441     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3021    .   1   1   24   TRP   HZ3    H   9.446     -2.981    3.299     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3022    .   1   1   24   TRP   N      N   4.250     -3.043    3.664     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3023    .   1   1   24   TRP   NE1    N   6.640     1.301     2.605     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   NE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3024    .   1   1   24   TRP   O      O   3.576     -1.595    1.695     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3025    .   1   1   25   CYS   C      C   2.815     1.500     1.215     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3026    .   1   1   25   CYS   CA     C   1.832     0.448     1.652     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3027    .   1   1   25   CYS   CB     C   0.432     1.006     1.798     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3028    .   1   1   25   CYS   H      H   1.929     0.097     3.726     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3029    .   1   1   25   CYS   HA     H   1.825     -0.314    0.887     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3030    .   1   1   25   CYS   HB2    H   0.381     1.612     2.691     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3031    .   1   1   25   CYS   HB3    H   0.195     1.613     0.937     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3032    .   1   1   25   CYS   N      N   2.286     -0.204    2.860     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3033    .   1   1   25   CYS   O      O   3.010     2.526     1.880     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3034    .   1   1   25   CYS   SG     S   -0.832    -0.289    1.931     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3035    .   1   1   26   LYS   C      C   3.963     2.864     -1.571    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3036    .   1   1   26   LYS   CA     C   4.471     2.088     -0.392    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3037    .   1   1   26   LYS   CB     C   5.679     1.230     -0.776    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3038    .   1   1   26   LYS   CD     C   7.976     1.076     -1.733    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3039    .   1   1   26   LYS   CE     C   9.081     1.815     -2.453    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3040    .   1   1   26   LYS   CG     C   6.811     1.988     -1.432    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3041    .   1   1   26   LYS   H      H   3.145     0.475     -0.430    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3042    .   1   1   26   LYS   HA     H   4.763     2.770     0.390     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3043    .   1   1   26   LYS   HB2    H   6.065     0.764     0.120     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3044    .   1   1   26   LYS   HB3    H   5.350     0.453     -1.450    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3045    .   1   1   26   LYS   HD2    H   8.363     0.678     -0.807    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3046    .   1   1   26   LYS   HD3    H   7.631     0.265     -2.358    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3047    .   1   1   26   LYS   HE2    H   8.692     2.202     -3.383    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3048    .   1   1   26   LYS   HE3    H   9.412     2.636     -1.835    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3049    .   1   1   26   LYS   HG2    H   6.447     2.415     -2.355    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3050    .   1   1   26   LYS   HG3    H   7.127     2.781     -0.774    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3051    .   1   1   26   LYS   HZ1    H   10.943    1.424     -3.321    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3052    .   1   1   26   LYS   HZ2    H   9.917     0.084     -3.251    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3053    .   1   1   26   LYS   HZ3    H   10.679    0.622     -1.863    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3054    .   1   1   26   LYS   N      N   3.430     1.248     0.105     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3055    .   1   1   26   LYS   NZ     N   10.228    0.938     -2.744    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3056    .   1   1   26   LYS   O      O   3.316     2.308     -2.436    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3057    .   1   1   27   LYS   C      C   4.630     4.732     -3.917    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3058    .   1   1   27   LYS   CA     C   3.791     4.976     -2.682    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3059    .   1   1   27   LYS   CB     C   3.840     6.452     -2.293    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3060    .   1   1   27   LYS   CD     C   5.165     8.436     -1.545    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3061    .   1   1   27   LYS   CE     C   6.519     8.934     -1.101    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3062    .   1   1   27   LYS   CG     C   5.205     6.953     -1.857    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3063    .   1   1   27   LYS   H      H   4.764     4.522     -0.868    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3064    .   1   1   27   LYS   HA     H   2.769     4.711     -2.905    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3065    .   1   1   27   LYS   HB2    H   3.532     7.040     -3.143    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3066    .   1   1   27   LYS   HB3    H   3.142     6.607     -1.487    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3067    .   1   1   27   LYS   HD2    H   4.869     8.976     -2.432    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3068    .   1   1   27   LYS   HD3    H   4.450     8.616     -0.757    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3069    .   1   1   27   LYS   HE2    H   6.813     8.397     -0.211    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3070    .   1   1   27   LYS   HE3    H   7.232     8.740     -1.888    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3071    .   1   1   27   LYS   HG2    H   5.511     6.415     -0.972    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3072    .   1   1   27   LYS   HG3    H   5.916     6.777     -2.651    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3073    .   1   1   27   LYS   HZ1    H   6.167     10.921    -1.622    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3074    .   1   1   27   LYS   HZ2    H   7.483     10.672    -0.591    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3075    .   1   1   27   LYS   HZ3    H   5.923     10.588    0.028     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3076    .   1   1   27   LYS   N      N   4.232     4.137     -1.593    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3077    .   1   1   27   LYS   NZ     N   6.510     10.379    -0.804    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3078    .   1   1   27   LYS   O      O   5.813     4.374     -3.823    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3079    .   1   1   28   LYS   C      C   5.288     6.085     -6.681    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3080    .   1   1   28   LYS   CA     C   4.740     4.718     -6.289    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3081    .   1   1   28   LYS   CB     C   3.804     4.141     -7.375    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3082    .   1   1   28   LYS   CD     C   5.461     2.483     -8.379    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3083    .   1   1   28   LYS   CE     C   4.727     1.208     -7.934    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3084    .   1   1   28   LYS   CG     C   4.510     3.663     -8.648    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3085    .   1   1   28   LYS   H      H   3.076     5.112     -5.074    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3086    .   1   1   28   LYS   HA     H   5.567     4.048     -6.117    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3087    .   1   1   28   LYS   HB2    H   3.258     3.309     -6.957    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3088    .   1   1   28   LYS   HB3    H   3.095     4.904     -7.654    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3089    .   1   1   28   LYS   HD2    H   6.001     2.262     -9.287    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3090    .   1   1   28   LYS   HD3    H   6.167     2.769     -7.614    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3091    .   1   1   28   LYS   HE2    H   5.464     0.467     -7.660    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3092    .   1   1   28   LYS   HE3    H   4.120     1.433     -7.070    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3093    .   1   1   28   LYS   HG2    H   3.764     3.346     -9.363    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3094    .   1   1   28   LYS   HG3    H   5.077     4.483     -9.062    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3095    .   1   1   28   LYS   HZ1    H   4.444     0.349     -9.815    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3096    .   1   1   28   LYS   HZ2    H   3.146     1.316     -9.331    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3097    .   1   1   28   LYS   HZ3    H   3.363     -0.199    -8.653    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3098    .   1   1   28   LYS   N      N   4.030     4.878     -5.056    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3099    .   1   1   28   LYS   NZ     N   3.867     0.643     -9.002    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3100    .   1   1   28   LYS   O      O   4.541     7.071     -6.721    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3101    .   1   1   29   LEU   C      C   7.118     7.707     -8.704    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3102    .   1   1   29   LEU   CA     C   7.224     7.418     -7.229    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3103    .   1   1   29   LEU   CB     C   8.714     7.442     -6.791    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3104    .   1   1   29   LEU   CD1    C   8.346     8.572     -4.556    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3105    .   1   1   29   LEU   CD2    C   8.700     6.095     -4.621    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3106    .   1   1   29   LEU   CG     C   9.034     7.428     -5.274    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3107    .   1   1   29   LEU   H      H   7.128     5.344     -6.889    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3108    .   1   1   29   LEU   HA     H   6.697     8.195     -6.697    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3109    .   1   1   29   LEU   HB2    H   9.200     6.584     -7.232    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3110    .   1   1   29   LEU   HB3    H   9.164     8.327     -7.216    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3111    .   1   1   29   LEU   HD11   H   8.631     8.562     -3.515    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD11   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3112    .   1   1   29   LEU   HD12   H   7.275     8.455     -4.633    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD12   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3113    .   1   1   29   LEU   HD13   H   8.642     9.509     -5.002    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD13   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3114    .   1   1   29   LEU   HD21   H   9.271     5.312     -5.095    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3115    .   1   1   29   LEU   HD22   H   7.645     5.891     -4.737    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3116    .   1   1   29   LEU   HD23   H   8.945     6.135     -3.569    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD23   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3117    .   1   1   29   LEU   HG     H   10.095    7.601     -5.165    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3118    .   1   1   29   LEU   N      N   6.577     6.156     -6.912    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3119    .   1   1   29   LEU   O      O   7.028     8.864     -9.120    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3120    .   1   1   30   TRP   C      C   5.965     5.846     -11.421   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3121    .   1   1   30   TRP   CA     C   7.033     6.784     -10.914   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3122    .   1   1   30   TRP   CB     C   8.380     6.477     -11.585   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3123    .   1   1   30   TRP   CD1    C   10.411    7.214     -10.200   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3124    .   1   1   30   TRP   CD2    C   9.791     8.683     -11.770   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3125    .   1   1   30   TRP   CE2    C   10.905    9.204     -11.083   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3126    .   1   1   30   TRP   CE3    C   9.227     9.433     -12.803   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3127    .   1   1   30   TRP   CG     C   9.490     7.408     -11.188   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3128    .   1   1   30   TRP   CH2    C   10.889    11.147    -12.412   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3129    .   1   1   30   TRP   CZ2    C   11.462    10.437    -11.398   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3130    .   1   1   30   TRP   CZ3    C   9.782     10.657    -13.113   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3131    .   1   1   30   TRP   H      H   7.200     5.763     -9.101    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3132    .   1   1   30   TRP   HA     H   6.749     7.800     -11.144   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3133    .   1   1   30   TRP   HB2    H   8.681     5.475     -11.320   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3134    .   1   1   30   TRP   HB3    H   8.257     6.538     -12.656   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3135    .   1   1   30   TRP   HD1    H   10.450    6.336     -9.571    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3136    .   1   1   30   TRP   HE1    H   12.019    8.387     -9.507    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3137    .   1   1   30   TRP   HE3    H   8.375     9.069     -13.355   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3138    .   1   1   30   TRP   HH2    H   11.288    12.111    -12.687   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3139    .   1   1   30   TRP   HZ2    H   12.316    10.837    -10.870   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3140    .   1   1   30   TRP   HZ3    H   9.358     11.252    -13.909   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3141    .   1   1   30   TRP   N      N   7.128     6.661     -9.488    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3142    .   1   1   30   TRP   NE1    N   11.268    8.287     -10.136   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   NE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3143    .   1   1   30   TRP   O      O   6.261     4.662     -11.656   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   6    .   3144    .   1   1   30   TRP   OXT    O   4.804     6.269     -11.581   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   OXT    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3145    .   1   1   1    TYR   C      C   -10.999   1.296     1.748     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3146    .   1   1   1    TYR   CA     C   -12.314   1.346     2.496     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3147    .   1   1   1    TYR   CB     C   -12.895   2.767     2.370     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3148    .   1   1   1    TYR   CD1    C   -14.395   3.516     4.255     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3149    .   1   1   1    TYR   CD2    C   -15.414   2.669     2.279     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3150    .   1   1   1    TYR   CE1    C   -15.635   3.738     4.808     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3151    .   1   1   1    TYR   CE2    C   -16.659   2.883     2.827     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3152    .   1   1   1    TYR   CG     C   -14.260   2.980     2.983     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3153    .   1   1   1    TYR   CZ     C   -16.763   3.421     4.089     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3154    .   1   1   1    TYR   H1     H   -13.031   0.969     4.407     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   H1     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3155    .   1   1   1    TYR   H2     H   -11.455   1.568     4.394     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   H2     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3156    .   1   1   1    TYR   H3     H   -11.765   -0.016    3.933     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   H3     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3157    .   1   1   1    TYR   HA     H   -12.996   0.648     2.038     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3158    .   1   1   1    TYR   HB2    H   -12.220   3.469     2.837     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3159    .   1   1   1    TYR   HB3    H   -12.963   3.011     1.320     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3160    .   1   1   1    TYR   HD1    H   -13.510   3.766     4.822     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3161    .   1   1   1    TYR   HD2    H   -15.331   2.247     1.289     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3162    .   1   1   1    TYR   HE1    H   -15.710   4.157     5.801     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3163    .   1   1   1    TYR   HE2    H   -17.546   2.634     2.264     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3164    .   1   1   1    TYR   HH     H   -18.041   4.554     4.940     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HH     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3165    .   1   1   1    TYR   N      N   -12.129   0.957     3.892     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3166    .   1   1   1    TYR   O      O   -10.873   0.607     0.742     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3167    .   1   1   1    TYR   OH     O   -18.000   3.639     4.635     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   OH     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3168    .   1   1   2    CYS   C      C   -7.634    1.972     2.561     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3169    .   1   1   2    CYS   CA     C   -8.764    2.145     1.561     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3170    .   1   1   2    CYS   CB     C   -8.708    3.540     0.896     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3171    .   1   1   2    CYS   H      H   -10.101   2.494     3.090     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3172    .   1   1   2    CYS   HA     H   -8.698    1.391     0.793     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3173    .   1   1   2    CYS   HB2    H   -9.530    3.627     0.202     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3174    .   1   1   2    CYS   HB3    H   -8.820    4.281     1.672     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3175    .   1   1   2    CYS   N      N   -10.024   2.017     2.237     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3176    .   1   1   2    CYS   O      O   -7.849    2.075     3.773     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3177    .   1   1   2    CYS   SG     S   -7.183    3.939     -0.038    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3178    .   1   1   3    GLN   C      C   -4.380    2.720     2.609     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3179    .   1   1   3    GLN   CA     C   -5.276    1.542     2.867     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3180    .   1   1   3    GLN   CB     C   -4.493    0.261     2.548     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3181    .   1   1   3    GLN   CD     C   -5.646    -1.192    4.265     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3182    .   1   1   3    GLN   CG     C   -5.216    -1.046    2.824     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3183    .   1   1   3    GLN   H      H   -6.383    1.635     1.077     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3184    .   1   1   3    GLN   HA     H   -5.589    1.530     3.898     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3185    .   1   1   3    GLN   HB2    H   -4.227    0.290     1.504     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3186    .   1   1   3    GLN   HB3    H   -3.581    0.273     3.129     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3187    .   1   1   3    GLN   HE21   H   -3.890    -1.991    4.774     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HE21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3188    .   1   1   3    GLN   HE22   H   -5.039    -1.834    6.034     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HE22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3189    .   1   1   3    GLN   HG2    H   -6.099    -1.090    2.201     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3190    .   1   1   3    GLN   HG3    H   -4.561    -1.865    2.573     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3191    .   1   1   3    GLN   N      N   -6.459    1.686     2.055     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3192    .   1   1   3    GLN   NE2    N   -4.780    -1.717    5.095     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   NE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3193    .   1   1   3    GLN   O      O   -4.172    3.108     1.446     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3194    .   1   1   3    GLN   OE1    O   -6.756    -0.811    4.631     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   OE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3195    .   1   1   4    LYS   C      C   -1.552    3.920     3.477     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3196    .   1   1   4    LYS   CA     C   -2.975    4.412     3.526     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3197    .   1   1   4    LYS   CB     C   -3.119    5.404     4.679     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3198    .   1   1   4    LYS   CD     C   -4.452    7.149     5.855     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3199    .   1   1   4    LYS   CE     C   -5.791    7.851     5.954     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3200    .   1   1   4    LYS   CG     C   -4.459    6.095     4.765     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3201    .   1   1   4    LYS   H      H   -4.107    2.971     4.546     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3202    .   1   1   4    LYS   HA     H   -3.197    4.922     2.602     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3203    .   1   1   4    LYS   HB2    H   -2.965    4.870     5.605     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3204    .   1   1   4    LYS   HB3    H   -2.353    6.157     4.580     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3205    .   1   1   4    LYS   HD2    H   -4.235    6.676     6.800     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3206    .   1   1   4    LYS   HD3    H   -3.685    7.877     5.632     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3207    .   1   1   4    LYS   HE2    H   -6.051    8.253     4.985     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3208    .   1   1   4    LYS   HE3    H   -6.531    7.128     6.255     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3209    .   1   1   4    LYS   HG2    H   -4.659    6.573     3.820     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3210    .   1   1   4    LYS   HG3    H   -5.225    5.364     4.980     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3211    .   1   1   4    LYS   HZ1    H   -5.055    9.663     6.656     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3212    .   1   1   4    LYS   HZ2    H   -5.504    8.602     7.883     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3213    .   1   1   4    LYS   HZ3    H   -6.683    9.416     6.995     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3214    .   1   1   4    LYS   N      N   -3.876    3.303     3.655     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3215    .   1   1   4    LYS   NZ     N   -5.757    8.947     6.938     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3216    .   1   1   4    LYS   O      O   -1.256    2.809     3.889     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3217    .   1   1   5    TRP   C      C   1.364     4.296     4.308     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3218    .   1   1   5    TRP   CA     C   0.757     4.536     2.921     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3219    .   1   1   5    TRP   CB     C   1.423     5.759     2.271     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3220    .   1   1   5    TRP   CD1    C   2.073     7.586     3.957     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3221    .   1   1   5    TRP   CD2    C   0.065     7.889     3.022     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3222    .   1   1   5    TRP   CE2    C   0.296     8.927     3.938     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3223    .   1   1   5    TRP   CE3    C   -1.140    7.878     2.312     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3224    .   1   1   5    TRP   CG     C   1.216     7.032     3.053     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3225    .   1   1   5    TRP   CH2    C   -1.785    9.897     3.455     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3226    .   1   1   5    TRP   CZ2    C   -0.623    9.935     4.161     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3227    .   1   1   5    TRP   CZ3    C   -2.049    8.883     2.538     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3228    .   1   1   5    TRP   H      H   -1.024    5.650     2.724     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3229    .   1   1   5    TRP   HA     H   0.922     3.674     2.293     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3230    .   1   1   5    TRP   HB2    H   2.486     5.581     2.202     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3231    .   1   1   5    TRP   HB3    H   1.017     5.902     1.280     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3232    .   1   1   5    TRP   HD1    H   3.040     7.174     4.211     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3233    .   1   1   5    TRP   HE1    H   1.942     9.295     5.171     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3234    .   1   1   5    TRP   HE3    H   -1.369    7.108     1.590     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3235    .   1   1   5    TRP   HH2    H   -2.527    10.667    3.601     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3236    .   1   1   5    TRP   HZ2    H   -0.447    10.734    4.866     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3237    .   1   1   5    TRP   HZ3    H   -2.988    8.894     2.004     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3238    .   1   1   5    TRP   N      N   -0.682    4.782     3.023     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3239    .   1   1   5    TRP   NE1    N   1.521     8.719     4.493     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   NE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3240    .   1   1   5    TRP   O      O   2.383     3.644     4.454     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3241    .   1   1   6    MET   C      C   0.742     3.367     7.256     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3242    .   1   1   6    MET   CA     C   1.135     4.728     6.698     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3243    .   1   1   6    MET   CB     C   0.518     5.853     7.550     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3244    .   1   1   6    MET   CE     C   -1.040    6.897     10.176    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3245    .   1   1   6    MET   CG     C   -1.002    5.844     7.594     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3246    .   1   1   6    MET   H      H   -0.077    5.386     5.093     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3247    .   1   1   6    MET   HA     H   2.211     4.821     6.725     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3248    .   1   1   6    MET   HB2    H   0.879     5.749     8.562     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3249    .   1   1   6    MET   HB3    H   0.842     6.806     7.158     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3250    .   1   1   6    MET   HE1    H   0.037     6.953     10.135    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3251    .   1   1   6    MET   HE2    H   -1.340    5.915     10.511    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3252    .   1   1   6    MET   HE3    H   -1.413    7.641     10.863    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3253    .   1   1   6    MET   HG2    H   -1.368    5.915     6.581     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3254    .   1   1   6    MET   HG3    H   -1.331    4.910     8.025     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3255    .   1   1   6    MET   N      N   0.711     4.851     5.313     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3256    .   1   1   6    MET   O      O   1.161     2.985     8.350     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3257    .   1   1   6    MET   SD     S   -1.713    7.204     8.542     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   SD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3258    .   1   1   7    TRP   C      C   0.177     0.307     6.046     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3259    .   1   1   7    TRP   CA     C   -0.509    1.341     6.916     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3260    .   1   1   7    TRP   CB     C   -2.044    1.201     6.812     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3261    .   1   1   7    TRP   CD1    C   -2.414    2.906     8.709     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3262    .   1   1   7    TRP   CD2    C   -4.171    2.619     7.366     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3263    .   1   1   7    TRP   CE2    C   -4.499    3.589     8.326     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3264    .   1   1   7    TRP   CE3    C   -5.123    2.264     6.425     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3265    .   1   1   7    TRP   CG     C   -2.824    2.214     7.606     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3266    .   1   1   7    TRP   CH2    C   -6.659    3.837     7.422     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3267    .   1   1   7    TRP   CZ2    C   -5.744    4.207     8.362     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3268    .   1   1   7    TRP   CZ3    C   -6.360    2.872     6.461     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3269    .   1   1   7    TRP   H      H   -0.336    2.956     5.620     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3270    .   1   1   7    TRP   HA     H   -0.201    1.196     7.940     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3271    .   1   1   7    TRP   HB2    H   -2.333    1.311     5.778     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3272    .   1   1   7    TRP   HB3    H   -2.334    0.215     7.149     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3273    .   1   1   7    TRP   HD1    H   -1.433    2.813     9.155     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3274    .   1   1   7    TRP   HE1    H   -3.353    4.375     9.889     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3275    .   1   1   7    TRP   HE3    H   -4.897    1.512     5.684     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3276    .   1   1   7    TRP   HH2    H   -7.640    4.288     7.418     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3277    .   1   1   7    TRP   HZ2    H   -6.002    4.953     9.097     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3278    .   1   1   7    TRP   HZ3    H   -7.112    2.607     5.731     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3279    .   1   1   7    TRP   N      N   -0.063    2.645     6.509     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3280    .   1   1   7    TRP   NE1    N   -3.406    3.756     9.127     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   NE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3281    .   1   1   7    TRP   O      O   1.080     0.637     5.252     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3282    .   1   1   8    THR   C      C   -0.681    -2.729    4.645     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3283    .   1   1   8    THR   CA     C   0.395     -1.977    5.453     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3284    .   1   1   8    THR   CB     C   1.098     -2.927    6.465     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3285    .   1   1   8    THR   CG2    C   2.190     -2.191    7.254     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   CG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3286    .   1   1   8    THR   H      H   -0.991    -1.127    6.750     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3287    .   1   1   8    THR   HA     H   1.135     -1.536    4.802     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3288    .   1   1   8    THR   HB     H   1.547     -3.746    5.921     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3289    .   1   1   8    THR   HG1    H   -0.273    -2.711    7.865     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HG1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3290    .   1   1   8    THR   HG21   H   2.921     -1.774    6.577     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HG21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3291    .   1   1   8    THR   HG22   H   2.681     -2.880    7.924     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HG22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3292    .   1   1   8    THR   HG23   H   1.740     -1.394    7.826     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HG23   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3293    .   1   1   8    THR   N      N   -0.227    -0.913    6.172     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3294    .   1   1   8    THR   O      O   -1.879    -2.418    4.786     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3295    .   1   1   8    THR   OG1    O   0.136     -3.456    7.400     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   OG1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3296    .   1   1   9    CYS   C      C   -0.950    -5.901    2.980     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3297    .   1   1   9    CYS   CA     C   -1.331    -4.433    3.104     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3298    .   1   1   9    CYS   CB     C   -1.709    -3.808    1.758     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3299    .   1   1   9    CYS   H      H   0.626     -3.909    3.541     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3300    .   1   1   9    CYS   HA     H   -2.195    -4.394    3.752     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3301    .   1   1   9    CYS   HB2    H   -2.520    -4.374    1.323     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3302    .   1   1   9    CYS   HB3    H   -2.050    -2.797    1.934     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3303    .   1   1   9    CYS   N      N   -0.306    -3.678    3.779     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3304    .   1   1   9    CYS   O      O   0.126     -6.319    3.461     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3305    .   1   1   9    CYS   SG     S   -0.388    -3.743    0.529     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3306    .   1   1   10   ASP   C      C   -2.573    -8.563    1.103     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3307    .   1   1   10   ASP   CA     C   -1.656    -8.112    2.252     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3308    .   1   1   10   ASP   CB     C   -2.041    -8.787    3.598     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3309    .   1   1   10   ASP   CG     C   -1.780    -10.273   3.645     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3310    .   1   1   10   ASP   H      H   -2.643    -6.296    1.990     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3311    .   1   1   10   ASP   HA     H   -0.628    -8.325    2.005     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3312    .   1   1   10   ASP   HB2    H   -1.477    -8.326    4.396     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3313    .   1   1   10   ASP   HB3    H   -3.093    -8.618    3.774     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3314    .   1   1   10   ASP   N      N   -1.827    -6.680    2.390     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3315    .   1   1   10   ASP   O      O   -2.953    -7.740    0.268     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3316    .   1   1   10   ASP   OD1    O   -0.626    -10.685   3.759     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   OD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3317    .   1   1   10   ASP   OD2    O   -2.750    -11.059   3.563     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   OD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3318    .   1   1   11   SER   C      C   -5.233    -9.999    0.449     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3319    .   1   1   11   SER   CA     C   -3.793    -10.305   0.032     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3320    .   1   1   11   SER   CB     C   -3.568    -11.800   -0.131    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3321    .   1   1   11   SER   H      H   -2.547    -10.468   1.678     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3322    .   1   1   11   SER   HA     H   -3.574    -9.806    -0.900    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3323    .   1   1   11   SER   HB2    H   -3.915    -12.315   0.752     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3324    .   1   1   11   SER   HB3    H   -4.107    -12.153   -0.997    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3325    .   1   1   11   SER   HG     H   -2.028    -13.010   -0.151    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   HG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3326    .   1   1   11   SER   N      N   -2.905    -9.817    1.034     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3327    .   1   1   11   SER   O      O   -6.105    -9.782    -0.391    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3328    .   1   1   11   SER   OG     O   -2.179    -12.069   -0.313    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   OG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3329    .   1   1   12   GLU   C      C   -7.046    -8.142    2.243     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3330    .   1   1   12   GLU   CA     C   -6.786    -9.655    2.280     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3331    .   1   1   12   GLU   CB     C   -7.007    -10.258   3.681     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3332    .   1   1   12   GLU   CD     C   -6.309    -10.412   6.092     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3333    .   1   1   12   GLU   CG     C   -6.005    -9.828    4.738     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3334    .   1   1   12   GLU   H      H   -4.730    -10.163   2.377     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3335    .   1   1   12   GLU   HA     H   -7.483    -10.108   1.589     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3336    .   1   1   12   GLU   HB2    H   -7.990    -9.977    4.027     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3337    .   1   1   12   GLU   HB3    H   -6.971    -11.335   3.601     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3338    .   1   1   12   GLU   HG2    H   -5.018    -10.146   4.437     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3339    .   1   1   12   GLU   HG3    H   -6.028    -8.752    4.810     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3340    .   1   1   12   GLU   N      N   -5.466    -9.963    1.762     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3341    .   1   1   12   GLU   O      O   -8.114    -7.696    1.834     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3342    .   1   1   12   GLU   OE1    O   -5.662    -11.396   6.486     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   OE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3343    .   1   1   12   GLU   OE2    O   -7.214    -9.894    6.788     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   OE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3344    .   1   1   13   ARG   C      C   -5.406    -5.455    1.403     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3345    .   1   1   13   ARG   CA     C   -6.189    -5.914    2.579     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3346    .   1   1   13   ARG   CB     C   -5.692    -5.176    3.821     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3347    .   1   1   13   ARG   CD     C   -7.946    -4.682    4.885     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3348    .   1   1   13   ARG   CG     C   -6.554    -5.298    5.063     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3349    .   1   1   13   ARG   CZ     C   -9.883    -5.124    3.362     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   CZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3350    .   1   1   13   ARG   H      H   -5.284    -7.744    3.102     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3351    .   1   1   13   ARG   HA     H   -7.230    -5.674    2.420     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3352    .   1   1   13   ARG   HB2    H   -4.717    -5.566    4.068     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3353    .   1   1   13   ARG   HB3    H   -5.588    -4.129    3.578     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3354    .   1   1   13   ARG   HD2    H   -8.404    -4.565    5.855     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3355    .   1   1   13   ARG   HD3    H   -7.838    -3.713    4.421     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3356    .   1   1   13   ARG   HE     H   -8.525    -6.463    4.012     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3357    .   1   1   13   ARG   HG2    H   -6.674    -6.355    5.236     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3358    .   1   1   13   ARG   HG3    H   -6.043    -4.834    5.891     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3359    .   1   1   13   ARG   HH11   H   -9.795    -3.138    3.891     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HH11   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3360    .   1   1   13   ARG   HH12   H   -11.091   -3.525    2.885     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HH12   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3361    .   1   1   13   ARG   HH21   H   -10.247   -6.969    2.617     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HH21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3362    .   1   1   13   ARG   HH22   H   -11.372   -5.789    2.117     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HH22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3363    .   1   1   13   ARG   N      N   -6.083    -7.354    2.694     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3364    .   1   1   13   ARG   NE     N   -8.805    -5.518    4.042     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   NE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3365    .   1   1   13   ARG   NH1    N   -10.278   -3.853    3.378     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   NH1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3366    .   1   1   13   ARG   NH2    N   -10.549   -6.010    2.649     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   NH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3367    .   1   1   13   ARG   O      O   -4.189    -5.518    1.406     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3368    .   1   1   14   LYS   C      C   -5.129    -3.041    -0.599    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3369    .   1   1   14   LYS   CA     C   -5.423    -4.491    -0.757    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3370    .   1   1   14   LYS   CB     C   -6.241    -4.734    -2.016    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3371    .   1   1   14   LYS   CD     C   -5.039    -6.805    -2.758    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3372    .   1   1   14   LYS   CE     C   -5.172    -8.277    -3.120    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3373    .   1   1   14   LYS   CG     C   -6.379    -6.192    -2.377    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3374    .   1   1   14   LYS   H      H   -7.057    -4.964    0.502     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3375    .   1   1   14   LYS   HA     H   -4.483    -5.013    -0.846    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3376    .   1   1   14   LYS   HB2    H   -7.229    -4.321    -1.870    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3377    .   1   1   14   LYS   HB3    H   -5.767    -4.222    -2.840    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3378    .   1   1   14   LYS   HD2    H   -4.638    -6.274    -3.608    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3379    .   1   1   14   LYS   HD3    H   -4.360    -6.713    -1.924    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3380    .   1   1   14   LYS   HE2    H   -4.196    -8.656    -3.384    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3381    .   1   1   14   LYS   HE3    H   -5.540    -8.813    -2.258    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3382    .   1   1   14   LYS   HG2    H   -6.745    -6.702    -1.500    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3383    .   1   1   14   LYS   HG3    H   -7.070    -6.287    -3.199    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3384    .   1   1   14   LYS   HZ1    H   -6.108    -9.511    -4.498    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3385    .   1   1   14   LYS   HZ2    H   -5.793    -7.966    -5.097    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3386    .   1   1   14   LYS   HZ3    H   -7.059    -8.217    -4.021    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3387    .   1   1   14   LYS   N      N   -6.079    -4.990    0.421     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3388    .   1   1   14   LYS   NZ     N   -6.085    -8.499    -4.257    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3389    .   1   1   14   LYS   O      O   -5.956    -2.271    -0.099    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3390    .   1   1   15   CYS   C      C   -4.091    -0.539    -2.082    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3391    .   1   1   15   CYS   CA     C   -3.554    -1.301    -0.890    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3392    .   1   1   15   CYS   CB     C   -2.035    -1.173    -0.789    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3393    .   1   1   15   CYS   H      H   -3.388    -3.359    -1.396    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3394    .   1   1   15   CYS   HA     H   -4.013    -0.908    0.003     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3395    .   1   1   15   CYS   HB2    H   -1.660    -1.934    -0.123    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3396    .   1   1   15   CYS   HB3    H   -1.606    -1.321    -1.768    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3397    .   1   1   15   CYS   N      N   -3.963    -2.671    -1.001    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3398    .   1   1   15   CYS   O      O   -4.342    -1.128    -3.149    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3399    .   1   1   15   CYS   SG     S   -1.455    0.440     -0.167    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3400    .   1   1   16   CYS   C      C   -3.840    1.997     -3.953    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3401    .   1   1   16   CYS   CA     C   -4.864    1.547     -2.928    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3402    .   1   1   16   CYS   CB     C   -5.526    2.728     -2.261    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3403    .   1   1   16   CYS   H      H   -3.981    1.152     -1.082    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3404    .   1   1   16   CYS   HA     H   -5.628    0.968     -3.423    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3405    .   1   1   16   CYS   HB2    H   -4.770    3.352     -1.810    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3406    .   1   1   16   CYS   HB3    H   -6.078    3.300     -2.992    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3407    .   1   1   16   CYS   N      N   -4.269    0.727     -1.918    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3408    .   1   1   16   CYS   O      O   -2.620    2.000     -3.688    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3409    .   1   1   16   CYS   SG     S   -6.687    2.215     -0.961    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3410    .   1   1   17   LYS   C      C   -2.808    4.106     -5.804    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3411    .   1   1   17   LYS   CA     C   -3.497    2.809     -6.198    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3412    .   1   1   17   LYS   CB     C   -4.309    2.955     -7.483    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3413    .   1   1   17   LYS   CD     C   -5.706    1.756     -9.237    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3414    .   1   1   17   LYS   CE     C   -6.876    2.725     -9.145    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3415    .   1   1   17   LYS   CG     C   -4.946    1.639     -7.925    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3416    .   1   1   17   LYS   H      H   -5.303    2.312     -5.258    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3417    .   1   1   17   LYS   HA     H   -2.733    2.060     -6.346    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3418    .   1   1   17   LYS   HB2    H   -5.090    3.682     -7.320    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3419    .   1   1   17   LYS   HB3    H   -3.661    3.299     -8.276    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3420    .   1   1   17   LYS   HD2    H   -5.025    2.107     -9.998    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3421    .   1   1   17   LYS   HD3    H   -6.078    0.780     -9.515    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3422    .   1   1   17   LYS   HE2    H   -7.516    2.431     -8.328    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3423    .   1   1   17   LYS   HE3    H   -6.488    3.716     -8.958    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3424    .   1   1   17   LYS   HG2    H   -4.170    0.897     -8.040    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3425    .   1   1   17   LYS   HG3    H   -5.627    1.316     -7.151    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3426    .   1   1   17   LYS   HZ1    H   -7.072    3.042     -11.194   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3427    .   1   1   17   LYS   HZ2    H   -8.468    3.394     -10.328   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3428    .   1   1   17   LYS   HZ3    H   -8.027    1.798     -10.608   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3429    .   1   1   17   LYS   N      N   -4.332    2.351     -5.120    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3430    .   1   1   17   LYS   NZ     N   -7.658    2.746     -10.387   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3431    .   1   1   17   LYS   O      O   -3.382    4.945     -5.094    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3432    .   1   1   18   GLY   C      C   0.353     4.793     -4.954    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3433    .   1   1   18   GLY   CA     C   -0.751    5.332     -5.822    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3434    .   1   1   18   GLY   H      H   -1.198    3.568     -6.830    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3435    .   1   1   18   GLY   HA2    H   -0.336    5.810     -6.698    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   HA2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3436    .   1   1   18   GLY   HA3    H   -1.329    6.042     -5.251    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   HA3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3437    .   1   1   18   GLY   N      N   -1.584    4.235     -6.222    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3438    .   1   1   18   GLY   O      O   1.423     5.404     -4.802    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3439    .   1   1   19   MET   C      C   1.224     1.546     -4.202    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3440    .   1   1   19   MET   CA     C   1.056     2.919     -3.613    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3441    .   1   1   19   MET   CB     C   0.651     2.779     -2.122    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3442    .   1   1   19   MET   CE     C   -2.138    4.097     -1.096    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3443    .   1   1   19   MET   CG     C   0.621     4.072     -1.311    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3444    .   1   1   19   MET   H      H   -0.789    3.218     -4.497    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3445    .   1   1   19   MET   HA     H   1.996     3.446     -3.675    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3446    .   1   1   19   MET   HB2    H   -0.331    2.333     -2.075    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3447    .   1   1   19   MET   HB3    H   1.350     2.102     -1.651    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3448    .   1   1   19   MET   HE1    H   -2.170    3.187     -1.676    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3449    .   1   1   19   MET   HE2    H   -3.070    4.630     -1.217    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3450    .   1   1   19   MET   HE3    H   -1.997    3.856     -0.053    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3451    .   1   1   19   MET   HG2    H   0.630     3.839     -0.258    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3452    .   1   1   19   MET   HG3    H   1.518     4.625     -1.542    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3453    .   1   1   19   MET   N      N   0.096     3.633     -4.388    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3454    .   1   1   19   MET   O      O   0.441     1.126     -5.059    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3455    .   1   1   19   MET   SD     S   -0.791    5.134     -1.657    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   SD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3456    .   1   1   20   VAL   C      C   2.110     -1.334    -2.981    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3457    .   1   1   20   VAL   CA     C   2.485     -0.482    -4.156    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3458    .   1   1   20   VAL   CB     C   3.993     -0.715    -4.472    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3459    .   1   1   20   VAL   CG1    C   4.242     -2.132    -4.980    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   CG1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3460    .   1   1   20   VAL   CG2    C   4.520     0.315     -5.455    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   CG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3461    .   1   1   20   VAL   H      H   2.837     1.299     -3.124    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3462    .   1   1   20   VAL   HA     H   1.883     -0.732    -5.018    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3463    .   1   1   20   VAL   HB     H   4.535     -0.609    -3.543    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3464    .   1   1   20   VAL   HG11   H   3.658     -2.301    -5.872    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG11   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3465    .   1   1   20   VAL   HG12   H   3.953     -2.845    -4.222    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG12   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3466    .   1   1   20   VAL   HG13   H   5.291     -2.255    -5.208    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG13   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3467    .   1   1   20   VAL   HG21   H   4.435     1.297     -5.013    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3468    .   1   1   20   VAL   HG22   H   3.936     0.277     -6.363    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3469    .   1   1   20   VAL   HG23   H   5.556     0.108     -5.680    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG23   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3470    .   1   1   20   VAL   N      N   2.224     0.867     -3.760    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3471    .   1   1   20   VAL   O      O   2.477     -1.009    -1.833    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3472    .   1   1   21   CYS   C      C   2.113     -4.158    -1.841    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3473    .   1   1   21   CYS   CA     C   0.957     -3.232    -2.157    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3474    .   1   1   21   CYS   CB     C   -0.309    -4.015    -2.507    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3475    .   1   1   21   CYS   H      H   1.082     -2.580    -4.142    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3476    .   1   1   21   CYS   HA     H   0.772     -2.611    -1.292    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3477    .   1   1   21   CYS   HB2    H   -1.017    -3.359    -2.989    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3478    .   1   1   21   CYS   HB3    H   -0.042    -4.814    -3.182    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3479    .   1   1   21   CYS   N      N   1.354     -2.373    -3.224    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3480    .   1   1   21   CYS   O      O   2.771     -4.685    -2.752    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3481    .   1   1   21   CYS   SG     S   -1.138    -4.773    -1.063    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3482    .   1   1   22   ARG   C      C   3.225     -5.259    1.393     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3483    .   1   1   22   ARG   CA     C   3.483     -5.057    -0.104    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3484    .   1   1   22   ARG   CB     C   4.760     -4.197    -0.332    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3485    .   1   1   22   ARG   CD     C   6.216     -5.969    -1.348    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3486    .   1   1   22   ARG   CG     C   6.095     -4.918    -0.260    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3487    .   1   1   22   ARG   CZ     C   7.914     -7.623    -2.100    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   CZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3488    .   1   1   22   ARG   H      H   1.785     -3.926    0.102     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3489    .   1   1   22   ARG   HA     H   3.563     -5.995    -0.630    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3490    .   1   1   22   ARG   HB2    H   4.690     -3.746    -1.312    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3491    .   1   1   22   ARG   HB3    H   4.761     -3.406    0.403     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3492    .   1   1   22   ARG   HD2    H   5.491     -6.750    -1.173    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3493    .   1   1   22   ARG   HD3    H   6.019     -5.504    -2.302    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3494    .   1   1   22   ARG   HE     H   8.217     -6.083    -0.831    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3495    .   1   1   22   ARG   HG2    H   6.882     -4.191    -0.393    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3496    .   1   1   22   ARG   HG3    H   6.208     -5.388    0.705     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3497    .   1   1   22   ARG   HH11   H   6.032     -8.068    -2.764    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HH11   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3498    .   1   1   22   ARG   HH12   H   7.248     -9.121    -3.322    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HH12   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3499    .   1   1   22   ARG   HH21   H   9.902     -7.532    -1.602    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HH21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3500    .   1   1   22   ARG   HH22   H   9.504     -8.790    -2.660    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HH22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3501    .   1   1   22   ARG   N      N   2.376     -4.312    -0.582    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3502    .   1   1   22   ARG   NE     N   7.552     -6.561    -1.377    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   NE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3503    .   1   1   22   ARG   NH1    N   7.004     -8.316    -2.777    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   NH1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3504    .   1   1   22   ARG   NH2    N   9.184     -8.007    -2.119    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   NH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3505    .   1   1   22   ARG   O      O   2.115     -4.905    1.890     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3506    .   1   1   23   LEU   C      C   3.733     -4.649    4.231     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3507    .   1   1   23   LEU   CA     C   4.169     -5.960    3.566     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3508    .   1   1   23   LEU   CB     C   5.544     -6.407    4.092     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3509    .   1   1   23   LEU   CD1    C   4.755     -7.718    6.102     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3510    .   1   1   23   LEU   CD2    C   7.119     -6.900    5.985     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3511    .   1   1   23   LEU   CG     C   5.675     -6.606    5.610     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3512    .   1   1   23   LEU   H      H   4.991     -6.161    1.631     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3513    .   1   1   23   LEU   HA     H   3.439     -6.724    3.791     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3514    .   1   1   23   LEU   HB2    H   5.789     -7.343    3.615     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3515    .   1   1   23   LEU   HB3    H   6.277     -5.675    3.783     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3516    .   1   1   23   LEU   HD11   H   5.012     -8.643    5.607     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD11   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3517    .   1   1   23   LEU   HD12   H   3.729     -7.464    5.885     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD12   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3518    .   1   1   23   LEU   HD13   H   4.877     -7.838    7.169     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD13   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3519    .   1   1   23   LEU   HD21   H   7.192     -7.038    7.054     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3520    .   1   1   23   LEU   HD22   H   7.744     -6.070    5.687     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3521    .   1   1   23   LEU   HD23   H   7.447     -7.797    5.482     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD23   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3522    .   1   1   23   LEU   HG     H   5.376     -5.695    6.107     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3523    .   1   1   23   LEU   N      N   4.217     -5.803    2.112     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3524    .   1   1   23   LEU   O      O   3.091     -4.660    5.262     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3525    .   1   1   24   TRP   C      C   3.201     -1.501    2.732     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3526    .   1   1   24   TRP   CA     C   3.625     -2.239    4.005     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3527    .   1   1   24   TRP   CB     C   4.739     -1.466    4.742     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3528    .   1   1   24   TRP   CD1    C   6.046     0.168     3.307     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3529    .   1   1   24   TRP   CD2    C   7.006     -1.839    3.461     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3530    .   1   1   24   TRP   CE2    C   7.809     -1.027    2.644     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3531    .   1   1   24   TRP   CE3    C   7.407     -3.150    3.707     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3532    .   1   1   24   TRP   CG     C   5.883     -1.049    3.872     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3533    .   1   1   24   TRP   CH2    C   9.356     -2.774    2.329     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3534    .   1   1   24   TRP   CZ2    C   8.987     -1.486    2.071     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3535    .   1   1   24   TRP   CZ3    C   8.577     -3.605    3.139     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3536    .   1   1   24   TRP   H      H   4.615     -3.587    2.787     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3537    .   1   1   24   TRP   HA     H   2.779     -2.393    4.654     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3538    .   1   1   24   TRP   HB2    H   4.319     -0.572    5.175     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3539    .   1   1   24   TRP   HB3    H   5.129     -2.089    5.533     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3540    .   1   1   24   TRP   HD1    H   5.325     0.960     3.459     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3541    .   1   1   24   TRP   HE1    H   7.546     0.969     2.060     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3542    .   1   1   24   TRP   HE3    H   6.814     -3.794    4.338     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3543    .   1   1   24   TRP   HH2    H   10.264    -3.172    1.903     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3544    .   1   1   24   TRP   HZ2    H   9.604     -0.859    1.444     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3545    .   1   1   24   TRP   HZ3    H   8.905     -4.620    3.318     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3546    .   1   1   24   TRP   N      N   4.069     -3.540    3.598     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3547    .   1   1   24   TRP   NE1    N   7.206     0.196     2.565     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   NE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3548    .   1   1   24   TRP   O      O   3.580     -1.930    1.638     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3549    .   1   1   25   CYS   C      C   3.192     1.249     1.279     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3550    .   1   1   25   CYS   CA     C   2.069     0.306     1.659     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3551    .   1   1   25   CYS   CB     C   0.747     1.061     1.820     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3552    .   1   1   25   CYS   H      H   2.092     -0.142    3.714     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3553    .   1   1   25   CYS   HA     H   1.966     -0.413    0.858     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3554    .   1   1   25   CYS   HB2    H   0.732     1.533     2.792     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3555    .   1   1   25   CYS   HB3    H   0.682     1.818     1.055     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3556    .   1   1   25   CYS   N      N   2.423     -0.450    2.842     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3557    .   1   1   25   CYS   O      O   3.507     2.203     2.002     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3558    .   1   1   25   CYS   SG     S   -0.746    0.018     1.701     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3559    .   1   1   26   LYS   C      C   4.424     2.797     -1.288    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3560    .   1   1   26   LYS   CA     C   4.913     1.749     -0.312    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3561    .   1   1   26   LYS   CB     C   5.922     0.827     -1.001    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3562    .   1   1   26   LYS   CD     C   8.075     0.584     -2.304    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3563    .   1   1   26   LYS   CE     C   8.573     -0.552    -1.423    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3564    .   1   1   26   LYS   CG     C   7.159     1.536     -1.544    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3565    .   1   1   26   LYS   H      H   3.475     0.218     -0.377    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3566    .   1   1   26   LYS   HA     H   5.387     2.214     0.537     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3567    .   1   1   26   LYS   HB2    H   6.245     0.086     -0.285    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3568    .   1   1   26   LYS   HB3    H   5.428     0.327     -1.821    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3569    .   1   1   26   LYS   HD2    H   7.528     0.167     -3.135    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3570    .   1   1   26   LYS   HD3    H   8.924     1.140     -2.677    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3571    .   1   1   26   LYS   HE2    H   9.059     -0.133    -0.553    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3572    .   1   1   26   LYS   HE3    H   7.728     -1.145    -1.107    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3573    .   1   1   26   LYS   HG2    H   6.845     2.324     -2.212    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3574    .   1   1   26   LYS   HG3    H   7.705     1.966     -0.716    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3575    .   1   1   26   LYS   HZ1    H   9.864     -2.175    -1.496    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3576    .   1   1   26   LYS   HZ2    H   10.361    -0.892    -2.452    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3577    .   1   1   26   LYS   HZ3    H   9.095     -1.876    -2.955    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3578    .   1   1   26   LYS   N      N   3.800     0.975     0.161     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3579    .   1   1   26   LYS   NZ     N   9.528     -1.420    -2.127    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3580    .   1   1   26   LYS   O      O   3.788     2.459     -2.265    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3581    .   1   1   27   LYS   C      C   5.109     5.021     -3.194    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3582    .   1   1   27   LYS   CA     C   4.315     5.126     -1.925    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3583    .   1   1   27   LYS   CB     C   4.548     6.495     -1.312    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3584    .   1   1   27   LYS   CD     C   3.999     8.157     0.529     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3585    .   1   1   27   LYS   CE     C   3.777     9.312     -0.453    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3586    .   1   1   27   LYS   CG     C   3.703     6.785     -0.084    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3587    .   1   1   27   LYS   H      H   5.192     4.259     -0.196    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3588    .   1   1   27   LYS   HA     H   3.268     5.015     -2.157    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3589    .   1   1   27   LYS   HB2    H   5.597     6.562     -1.079    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3590    .   1   1   27   LYS   HB3    H   4.334     7.240     -2.065    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3591    .   1   1   27   LYS   HD2    H   3.352     8.303     1.381     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3592    .   1   1   27   LYS   HD3    H   5.028     8.171     0.860     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3593    .   1   1   27   LYS   HE2    H   4.004     10.239    0.054     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3594    .   1   1   27   LYS   HE3    H   4.460     9.194     -1.281    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3595    .   1   1   27   LYS   HG2    H   2.660     6.748     -0.360    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3596    .   1   1   27   LYS   HG3    H   3.905     6.022     0.653     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3597    .   1   1   27   LYS   HZ1    H   2.091     8.531     -1.477    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3598    .   1   1   27   LYS   HZ2    H   2.347     10.162    -1.671    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3599    .   1   1   27   LYS   HZ3    H   1.692     9.613     -0.228    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3600    .   1   1   27   LYS   N      N   4.698     4.055     -1.018    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3601    .   1   1   27   LYS   NZ     N   2.382     9.392     -0.973    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3602    .   1   1   27   LYS   O      O   6.330     4.837     -3.154    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3603    .   1   1   28   LYS   C      C   5.130     6.394     -6.217    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3604    .   1   1   28   LYS   CA     C   5.082     5.032     -5.565    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3605    .   1   1   28   LYS   CB     C   4.379     4.022     -6.475    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3606    .   1   1   28   LYS   CD     C   4.438     2.708     -8.618    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3607    .   1   1   28   LYS   CE     C   5.314     2.222     -9.769    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3608    .   1   1   28   LYS   CG     C   5.188     3.664     -7.712    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3609    .   1   1   28   LYS   H      H   3.481     5.348     -4.231    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3610    .   1   1   28   LYS   HA     H   6.094     4.702     -5.385    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3611    .   1   1   28   LYS   HB2    H   4.186     3.120     -5.915    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3612    .   1   1   28   LYS   HB3    H   3.437     4.443     -6.797    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3613    .   1   1   28   LYS   HD2    H   4.114     1.855     -8.041    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3614    .   1   1   28   LYS   HD3    H   3.575     3.217     -9.023    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3615    .   1   1   28   LYS   HE2    H   6.143     1.665     -9.360    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3616    .   1   1   28   LYS   HE3    H   4.725     1.568     -10.395   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3617    .   1   1   28   LYS   HG2    H   5.408     4.566     -8.263    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3618    .   1   1   28   LYS   HG3    H   6.113     3.201     -7.400    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3619    .   1   1   28   LYS   HZ1    H   6.475     3.967     -10.051   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3620    .   1   1   28   LYS   HZ2    H   5.096     3.903     -11.026   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3621    .   1   1   28   LYS   HZ3    H   6.421     2.933     -11.370   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3622    .   1   1   28   LYS   N      N   4.438     5.144     -4.292    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3623    .   1   1   28   LYS   NZ     N   5.849     3.330     -10.597   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3624    .   1   1   28   LYS   O      O   4.183     6.818     -6.901    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3625    .   1   1   29   LEU   C      C   7.343     8.268     -7.686    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3626    .   1   1   29   LEU   CA     C   6.414     8.413     -6.484    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3627    .   1   1   29   LEU   CB     C   7.058     9.304     -5.416    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3628    .   1   1   29   LEU   CD1    C   5.950     11.488    -5.983    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3629    .   1   1   29   LEU   CD2    C   8.116     11.462    -4.736    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3630    .   1   1   29   LEU   CG     C   7.277     10.770    -5.788    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3631    .   1   1   29   LEU   H      H   6.840     6.715     -5.318    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3632    .   1   1   29   LEU   HA     H   5.471     8.839     -6.794    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3633    .   1   1   29   LEU   HB2    H   6.434     9.272     -4.536    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3634    .   1   1   29   LEU   HB3    H   8.018     8.875     -5.163    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3635    .   1   1   29   LEU   HD11   H   6.136     12.520    -6.242    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD11   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3636    .   1   1   29   LEU   HD12   H   5.381     11.449    -5.067    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD12   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3637    .   1   1   29   LEU   HD13   H   5.391     11.014    -6.775    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD13   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3638    .   1   1   29   LEU   HD21   H   7.609     11.421    -3.783    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3639    .   1   1   29   LEU   HD22   H   8.264     12.492    -5.025    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3640    .   1   1   29   LEU   HD23   H   9.074     10.969    -4.658    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD23   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3641    .   1   1   29   LEU   HG     H   7.810     10.813    -6.726    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3642    .   1   1   29   LEU   N      N   6.178     7.100     -5.933    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3643    .   1   1   29   LEU   O      O   7.442     9.159     -8.543    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3644    .   1   1   30   TRP   C      C   8.134     6.024     -9.820    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3645    .   1   1   30   TRP   CA     C   8.921     6.791     -8.774    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3646    .   1   1   30   TRP   CB     C   10.057    5.926     -8.197    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3647    .   1   1   30   TRP   CD1    C   11.139    4.499     -10.044   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3648    .   1   1   30   TRP   CD2    C   12.407    6.196     -9.331    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3649    .   1   1   30   TRP   CE2    C   13.111    5.497     -10.329   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3650    .   1   1   30   TRP   CE3    C   13.011    7.302     -8.732    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3651    .   1   1   30   TRP   CG     C   11.141    5.549     -9.171    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3652    .   1   1   30   TRP   CH2    C   14.951    6.954     -10.133   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3653    .   1   1   30   TRP   CZ2    C   14.386    5.869     -10.737   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3654    .   1   1   30   TRP   CZ3    C   14.276    7.669     -9.138    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3655    .   1   1   30   TRP   H      H   7.889     6.499     -6.994    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3656    .   1   1   30   TRP   HA     H   9.333     7.691     -9.205    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3657    .   1   1   30   TRP   HB2    H   10.526    6.464     -7.388    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3658    .   1   1   30   TRP   HB3    H   9.629     5.016     -7.801    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3659    .   1   1   30   TRP   HD1    H   10.317    3.808     -10.160   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3660    .   1   1   30   TRP   HE1    H   12.548    3.811     -11.441   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3661    .   1   1   30   TRP   HE3    H   12.503    7.865     -7.963    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3662    .   1   1   30   TRP   HH2    H   15.941    7.276     -10.421   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3663    .   1   1   30   TRP   HZ2    H   14.923    5.331     -11.506   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3664    .   1   1   30   TRP   HZ3    H   14.757    8.522     -8.683    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3665    .   1   1   30   TRP   N      N   8.016     7.143     -7.722    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3666    .   1   1   30   TRP   NE1    N   12.317    4.468     -10.745   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   NE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3667    .   1   1   30   TRP   O      O   7.796     6.606     -10.879   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   7    .   3668    .   1   1   30   TRP   OXT    O   7.770     4.861     -9.566    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   OXT    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3669    .   1   1   1    TYR   C      C   -9.795    0.373     2.034     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3670    .   1   1   1    TYR   CA     C   -11.095   0.911     2.570     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3671    .   1   1   1    TYR   CB     C   -10.903   2.351     3.074     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3672    .   1   1   1    TYR   CD1    C   -12.421   3.181     4.908     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3673    .   1   1   1    TYR   CD2    C   -13.133   3.430     2.652     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3674    .   1   1   1    TYR   CE1    C   -13.591   3.761     5.343     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3675    .   1   1   1    TYR   CE2    C   -14.300   4.012     3.081     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3676    .   1   1   1    TYR   CG     C   -12.173   3.004     3.555     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3677    .   1   1   1    TYR   CZ     C   -14.523   4.175     4.423     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3678    .   1   1   1    TYR   H1     H   -11.673   -0.921    3.299     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   H1     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3679    .   1   1   1    TYR   H2     H   -12.450   0.362     4.058     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   H2     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3680    .   1   1   1    TYR   H3     H   -10.821   0.012     4.391     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   H3     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3681    .   1   1   1    TYR   HA     H   -11.841   0.897     1.790     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3682    .   1   1   1    TYR   HB2    H   -10.201   2.347     3.894     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3683    .   1   1   1    TYR   HB3    H   -10.499   2.949     2.271     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3684    .   1   1   1    TYR   HD1    H   -11.685   2.858     5.631     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3685    .   1   1   1    TYR   HD2    H   -12.960   3.302     1.594     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3686    .   1   1   1    TYR   HE1    H   -13.765   3.890     6.400     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3687    .   1   1   1    TYR   HE2    H   -15.031   4.337     2.356     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3688    .   1   1   1    TYR   HH     H   -15.504   5.515     5.380     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HH     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3689    .   1   1   1    TYR   N      N   -11.548   0.050     3.651     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3690    .   1   1   1    TYR   O      O   -9.402    -0.751    2.371     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3691    .   1   1   1    TYR   OH     O   -15.694   4.733     4.846     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   OH     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3692    .   1   1   2    CYS   C      C   -6.815    1.100     1.730     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3693    .   1   1   2    CYS   CA     C   -7.858    0.719     0.704     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3694    .   1   1   2    CYS   CB     C   -7.547    1.324     -0.673    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3695    .   1   1   2    CYS   H      H   -9.506    1.981     0.879     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3696    .   1   1   2    CYS   HA     H   -7.874    -0.359    0.626     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3697    .   1   1   2    CYS   HB2    H   -6.560    1.002     -0.971    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3698    .   1   1   2    CYS   HB3    H   -8.264    0.952     -1.389    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3699    .   1   1   2    CYS   N      N   -9.138    1.126     1.184     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3700    .   1   1   2    CYS   O      O   -7.031    2.026     2.540     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3701    .   1   1   2    CYS   SG     S   -7.566    3.153     -0.751    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3702    .   1   1   3    GLN   C      C   -3.836    1.796     2.256     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3703    .   1   1   3    GLN   CA     C   -4.692    0.650     2.683     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3704    .   1   1   3    GLN   CB     C   -3.851    -0.593    2.903     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3705    .   1   1   3    GLN   CD     C   -5.296    -1.531    4.729     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3706    .   1   1   3    GLN   CG     C   -4.643    -1.783    3.387     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3707    .   1   1   3    GLN   H      H   -5.613    -0.296    1.049     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3708    .   1   1   3    GLN   HA     H   -5.189    0.898     3.607     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3709    .   1   1   3    GLN   HB2    H   -3.338    -0.863    1.993     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3710    .   1   1   3    GLN   HB3    H   -3.109    -0.365    3.654     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3711    .   1   1   3    GLN   HE21   H   -3.646    -2.084    5.626     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HE21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3712    .   1   1   3    GLN   HE22   H   -4.958    -1.613    6.660     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HE22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3713    .   1   1   3    GLN   HG2    H   -5.415    -1.990    2.660     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3714    .   1   1   3    GLN   HG3    H   -3.982    -2.635    3.458     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3715    .   1   1   3    GLN   N      N   -5.719    0.413     1.721     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3716    .   1   1   3    GLN   NE2    N   -4.566    -1.765    5.772     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   NE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3717    .   1   1   3    GLN   O      O   -3.415    1.875     1.104     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3718    .   1   1   3    GLN   OE1    O   -6.446    -1.088    4.815     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   OE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3719    .   1   1   4    LYS   C      C   -1.393    3.597     3.175     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3720    .   1   1   4    LYS   CA     C   -2.861    3.874     2.935     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3721    .   1   1   4    LYS   CB     C   -3.359    4.974     3.854     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3722    .   1   1   4    LYS   CD     C   -5.311    6.303     4.692     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3723    .   1   1   4    LYS   CE     C   -6.778    6.618     4.500     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3724    .   1   1   4    LYS   CG     C   -4.837    5.276     3.690     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3725    .   1   1   4    LYS   H      H   -3.974    2.532     4.072     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3726    .   1   1   4    LYS   HA     H   -3.011    4.179     1.910     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3727    .   1   1   4    LYS   HB2    H   -3.183    4.680     4.879     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3728    .   1   1   4    LYS   HB3    H   -2.805    5.877     3.642     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3729    .   1   1   4    LYS   HD2    H   -5.164    5.916     5.690     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3730    .   1   1   4    LYS   HD3    H   -4.736    7.209     4.568     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3731    .   1   1   4    LYS   HE2    H   -6.931    6.981     3.495     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3732    .   1   1   4    LYS   HE3    H   -7.352    5.714     4.646     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3733    .   1   1   4    LYS   HG2    H   -5.007    5.655     2.692     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3734    .   1   1   4    LYS   HG3    H   -5.397    4.362     3.827     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3735    .   1   1   4    LYS   HZ1    H   -7.210    7.293     6.423     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3736    .   1   1   4    LYS   HZ2    H   -8.221    7.931     5.238     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3737    .   1   1   4    LYS   HZ3    H   -6.639    8.486     5.396     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3738    .   1   1   4    LYS   N      N   -3.618    2.687     3.174     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3739    .   1   1   4    LYS   NZ     N   -7.245    7.640     5.444     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3740    .   1   1   4    LYS   O      O   -1.048    2.589     3.784     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3741    .   1   1   5    TRP   C      C   1.443     4.125     4.217     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3742    .   1   1   5    TRP   CA     C   0.910     4.375     2.799     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3743    .   1   1   5    TRP   CB     C   1.602     5.603     2.170     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3744    .   1   1   5    TRP   CD1    C   0.320     7.510     3.322     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3745    .   1   1   5    TRP   CD2    C   2.532     7.672     3.478     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3746    .   1   1   5    TRP   CE2    C   1.953     8.764     4.149     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3747    .   1   1   5    TRP   CE3    C   3.916     7.565     3.444     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3748    .   1   1   5    TRP   CG     C   1.468     6.875     2.966     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3749    .   1   1   5    TRP   CH2    C   4.063     9.606     4.717     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3750    .   1   1   5    TRP   CZ2    C   2.712     9.737     4.773     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3751    .   1   1   5    TRP   CZ3    C   4.667     8.534     4.062     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3752    .   1   1   5    TRP   H      H   -0.924    5.323     2.340     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3753    .   1   1   5    TRP   HA     H   1.162     3.512     2.201     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3754    .   1   1   5    TRP   HB2    H   2.657     5.395     2.063     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3755    .   1   1   5    TRP   HB3    H   1.180     5.775     1.190     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3756    .   1   1   5    TRP   HD1    H   -0.668    7.151     3.082     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3757    .   1   1   5    TRP   HE1    H   -0.057    9.260     4.419     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3758    .   1   1   5    TRP   HE3    H   4.396     6.741     2.938     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3759    .   1   1   5    TRP   HH2    H   4.693     10.345    5.187     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3760    .   1   1   5    TRP   HZ2    H   2.268     10.576    5.288     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3761    .   1   1   5    TRP   HZ3    H   5.745     8.475     4.042     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3762    .   1   1   5    TRP   N      N   -0.550    4.514     2.744     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3763    .   1   1   5    TRP   NE1    N   0.604     8.638     4.043     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   NE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3764    .   1   1   5    TRP   O      O   2.449     3.441     4.389     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3765    .   1   1   6    MET   C      C   0.886     3.058     7.068     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3766    .   1   1   6    MET   CA     C   1.242     4.456     6.595     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3767    .   1   1   6    MET   CB     C   0.679     5.495     7.567     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3768    .   1   1   6    MET   CE     C   -1.149    6.092     10.193    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3769    .   1   1   6    MET   CG     C   1.220     5.323     8.982     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3770    .   1   1   6    MET   H      H   -0.024    5.204     5.066     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3771    .   1   1   6    MET   HA     H   2.315     4.553     6.556     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3772    .   1   1   6    MET   HB2    H   0.931     6.484     7.217     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3773    .   1   1   6    MET   HB3    H   -0.395    5.390     7.601     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3774    .   1   1   6    MET   HE1    H   -1.569    6.229     9.207     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3775    .   1   1   6    MET   HE2    H   -1.667    6.727     10.896    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3776    .   1   1   6    MET   HE3    H   -1.259    5.060     10.492    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3777    .   1   1   6    MET   HG2    H   0.952     4.334     9.322     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3778    .   1   1   6    MET   HG3    H   2.293     5.392     8.924     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3779    .   1   1   6    MET   N      N   0.776     4.662     5.233     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3780    .   1   1   6    MET   O      O   1.562     2.473     7.914     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3781    .   1   1   6    MET   SD     S   0.589     6.523     10.174    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   SD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3782    .   1   1   7    TRP   C      C   0.083     0.144     6.066     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3783    .   1   1   7    TRP   CA     C   -0.642    1.224     6.862     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3784    .   1   1   7    TRP   CB     C   -2.166    1.135     6.624     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3785    .   1   1   7    TRP   CD1    C   -2.617    2.906     8.455     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3786    .   1   1   7    TRP   CD2    C   -4.349    2.517     7.095     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3787    .   1   1   7    TRP   CE2    C   -4.725    3.506     8.021     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3788    .   1   1   7    TRP   CE3    C   -5.277    2.106     6.146     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3789    .   1   1   7    TRP   CG     C   -2.991    2.158     7.372     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3790    .   1   1   7    TRP   CH2    C   -6.877    3.658     7.074     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3791    .   1   1   7    TRP   CZ2    C   -5.988    4.085     8.021     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3792    .   1   1   7    TRP   CZ3    C   -6.532    2.676     6.144     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3793    .   1   1   7    TRP   H      H   -0.544    2.999     5.737     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3794    .   1   1   7    TRP   HA     H   -0.440    1.079     7.912     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3795    .   1   1   7    TRP   HB2    H   -2.355    1.281     5.571     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3796    .   1   1   7    TRP   HB3    H   -2.515    0.151     6.900     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3797    .   1   1   7    TRP   HD1    H   -1.643    2.858     8.921     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3798    .   1   1   7    TRP   HE1    H   -3.630    4.376     9.582     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3799    .   1   1   7    TRP   HE3    H   -5.021    1.341     5.430     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3800    .   1   1   7    TRP   HH2    H   -7.872    4.078     7.038     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3801    .   1   1   7    TRP   HZ2    H   -6.271    4.846     8.733     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3802    .   1   1   7    TRP   HZ3    H   -7.263    2.364     5.411     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3803    .   1   1   7    TRP   N      N   -0.137    2.522     6.491     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3804    .   1   1   7    TRP   NE1    N   -3.652    3.729     8.839     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   NE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3805    .   1   1   7    TRP   O      O   1.009     0.429     5.283     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3806    .   1   1   8    THR   C      C   -0.775    -2.860    4.742     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3807    .   1   1   8    THR   CA     C   0.298     -2.174    5.587     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3808    .   1   1   8    THR   CB     C   0.868     -3.168    6.631     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3809    .   1   1   8    THR   CG2    C   1.953     -2.507    7.479     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   CG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3810    .   1   1   8    THR   H      H   -1.022    -1.274    6.905     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3811    .   1   1   8    THR   HA     H   1.100     -1.789    4.975     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3812    .   1   1   8    THR   HB     H   1.289     -4.016    6.113     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3813    .   1   1   8    THR   HG1    H   0.115     -3.515    8.412     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HG1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3814    .   1   1   8    THR   HG21   H   2.747     -2.151    6.837     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HG21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3815    .   1   1   8    THR   HG22   H   2.351     -3.225    8.181     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HG22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3816    .   1   1   8    THR   HG23   H   1.527     -1.673    8.016     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HG23   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3817    .   1   1   8    THR   N      N   -0.302    -1.071    6.268     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3818    .   1   1   8    THR   O      O   -1.975    -2.654    5.000     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3819    .   1   1   8    THR   OG1    O   -0.187    -3.608    7.496     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   OG1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3820    .   1   1   9    CYS   C      C   -1.163    -5.821    3.039     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3821    .   1   1   9    CYS   CA     C   -1.441    -4.345    3.021     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3822    .   1   1   9    CYS   CB     C   -1.686    -3.793    1.613     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3823    .   1   1   9    CYS   H      H   0.523     -3.788    3.443     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3824    .   1   1   9    CYS   HA     H   -2.336    -4.203    3.613     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3825    .   1   1   9    CYS   HB2    H   -2.464    -4.373    1.140     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3826    .   1   1   9    CYS   HB3    H   -2.020    -2.769    1.698     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3827    .   1   1   9    CYS   N      N   -0.410    -3.639    3.731     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3828    .   1   1   9    CYS   O      O   -0.094    -6.249    3.501     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3829    .   1   1   9    CYS   SG     S   -0.259    -3.819    0.509     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3830    .   1   1   10   ASP   C      C   -2.847    -8.587    1.490     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3831    .   1   1   10   ASP   CA     C   -1.997    -8.042    2.630     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3832    .   1   1   10   ASP   CB     C   -2.522    -8.527    4.016     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3833    .   1   1   10   ASP   CG     C   -2.221    -9.987    4.312     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3834    .   1   1   10   ASP   H      H   -2.882    -6.223    2.107     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3835    .   1   1   10   ASP   HA     H   -0.966    -8.334    2.499     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3836    .   1   1   10   ASP   HB2    H   -2.066    -7.928    4.789     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3837    .   1   1   10   ASP   HB3    H   -3.592    -8.382    4.047     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3838    .   1   1   10   ASP   N      N   -2.098    -6.601    2.570     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3839    .   1   1   10   ASP   O      O   -3.216    -7.829    0.600     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3840    .   1   1   10   ASP   OD1    O   -1.174    -10.288   4.908     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   OD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3841    .   1   1   10   ASP   OD2    O   -3.025    -10.856   3.932     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   OD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3842    .   1   1   11   SER   C      C   -5.428    -10.002   0.669     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3843    .   1   1   11   SER   CA     C   -3.973    -10.441   0.493     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3844    .   1   1   11   SER   CB     C   -3.834    -11.969   0.571     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3845    .   1   1   11   SER   H      H   -2.897    -10.400   2.278     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3846    .   1   1   11   SER   HA     H   -3.613    -10.100   -0.465    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3847    .   1   1   11   SER   HB2    H   -2.790    -12.232   0.490     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3848    .   1   1   11   SER   HB3    H   -4.218    -12.313   1.520     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3849    .   1   1   11   SER   HG     H   -5.278    -13.080   -0.069    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   HG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3850    .   1   1   11   SER   N      N   -3.178    -9.841    1.515     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3851    .   1   1   11   SER   O      O   -6.159    -9.817    -0.306    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3852    .   1   1   11   SER   OG     O   -4.532    -12.617   -0.470    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   OG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3853    .   1   1   12   GLU   C      C   -7.283    -7.851    2.201     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3854    .   1   1   12   GLU   CA     C   -7.192    -9.371    2.221     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3855    .   1   1   12   GLU   CB     C   -7.597    -9.840    3.600     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3856    .   1   1   12   GLU   CD     C   -7.837    -11.677   5.240     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3857    .   1   1   12   GLU   CG     C   -7.391    -11.310   3.860     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3858    .   1   1   12   GLU   H      H   -5.197    -9.973    2.646     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3859    .   1   1   12   GLU   HA     H   -7.867    -9.792    1.492     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3860    .   1   1   12   GLU   HB2    H   -7.021    -9.290    4.329     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3861    .   1   1   12   GLU   HB3    H   -8.642    -9.613    3.747     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3862    .   1   1   12   GLU   HG2    H   -7.963    -11.879   3.143     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3863    .   1   1   12   GLU   HG3    H   -6.342    -11.545   3.759     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3864    .   1   1   12   GLU   N      N   -5.830    -9.801    1.917     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3865    .   1   1   12   GLU   O      O   -8.321    -7.275    1.883     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3866    .   1   1   12   GLU   OE1    O   -7.288    -11.126   6.216     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   OE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3867    .   1   1   12   GLU   OE2    O   -8.749    -12.507   5.378     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   OE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3868    .   1   1   13   ARG   C      C   -5.532    -5.206    1.407     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3869    .   1   1   13   ARG   CA     C   -6.180    -5.773    2.650     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3870    .   1   1   13   ARG   CB     C   -5.447    -5.315    3.919     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3871    .   1   1   13   ARG   CD     C   -5.396    -5.272    6.455     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3872    .   1   1   13   ARG   CG     C   -6.136    -5.749    5.206     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3873    .   1   1   13   ARG   CZ     C   -2.972    -5.276    7.072     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   CZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3874    .   1   1   13   ARG   H      H   -5.396    -7.723    2.773     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3875    .   1   1   13   ARG   HA     H   -7.205    -5.438    2.699     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3876    .   1   1   13   ARG   HB2    H   -4.447    -5.723    3.912     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3877    .   1   1   13   ARG   HB3    H   -5.389    -4.237    3.916     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3878    .   1   1   13   ARG   HD2    H   -5.251    -4.207    6.367     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3879    .   1   1   13   ARG   HD3    H   -6.004    -5.476    7.324     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3880    .   1   1   13   ARG   HE     H   -4.042    -6.871    6.416     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3881    .   1   1   13   ARG   HG2    H   -7.140    -5.353    5.219     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3882    .   1   1   13   ARG   HG3    H   -6.183    -6.828    5.211     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3883    .   1   1   13   ARG   HH11   H   -3.896    -3.486    7.459     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HH11   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3884    .   1   1   13   ARG   HH12   H   -2.226    -3.517    7.778     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HH12   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3885    .   1   1   13   ARG   HH21   H   -1.692    -6.893    6.967     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HH21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3886    .   1   1   13   ARG   HH22   H   -0.999    -5.427    7.494     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HH22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3887    .   1   1   13   ARG   N      N   -6.205    -7.212    2.577     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3888    .   1   1   13   ARG   NE     N   -4.076    -5.911    6.628     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   NE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3889    .   1   1   13   ARG   NH1    N   -3.044    -4.014    7.462     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   NH1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3890    .   1   1   13   ARG   NH2    N   -1.820    -5.922    7.186     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   NH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3891    .   1   1   13   ARG   O      O   -4.331    -5.355    1.212     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3892    .   1   1   14   LYS   C      C   -5.367    -2.567    -0.479    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3893    .   1   1   14   LYS   CA     C   -5.827    -4.006    -0.661    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3894    .   1   1   14   LYS   CB     C   -6.890    -4.154    -1.778    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3895    .   1   1   14   LYS   CD     C   -9.283    -3.900    -2.534    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3896    .   1   1   14   LYS   CE     C   -10.640   -3.286    -2.222    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3897    .   1   1   14   LYS   CG     C   -8.252    -3.537    -1.468    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3898    .   1   1   14   LYS   H      H   -7.244    -4.400    0.854     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3899    .   1   1   14   LYS   HA     H   -4.959    -4.592    -0.927    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3900    .   1   1   14   LYS   HB2    H   -6.511    -3.685    -2.673    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3901    .   1   1   14   LYS   HB3    H   -7.029    -5.206    -1.977    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3902    .   1   1   14   LYS   HD2    H   -8.942    -3.531    -3.489    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3903    .   1   1   14   LYS   HD3    H   -9.383    -4.974    -2.578    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3904    .   1   1   14   LYS   HE2    H   -10.926   -3.598    -1.230    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3905    .   1   1   14   LYS   HE3    H   -10.553   -2.209    -2.251    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3906    .   1   1   14   LYS   HG2    H   -8.590    -3.905    -0.511    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3907    .   1   1   14   LYS   HG3    H   -8.149    -2.463    -1.425    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3908    .   1   1   14   LYS   HZ1    H   -11.855   -4.745    -3.092    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3909    .   1   1   14   LYS   HZ2    H   -11.466   -3.498    -4.149    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3910    .   1   1   14   LYS   HZ3    H   -12.600   -3.247    -2.927    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3911    .   1   1   14   LYS   N      N   -6.311    -4.551    0.592     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3912    .   1   1   14   LYS   NZ     N   -11.701   -3.718    -3.160    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3913    .   1   1   14   LYS   O      O   -6.060    -1.758    0.123     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3914    .   1   1   15   CYS   C      C   -4.140    -0.006    -1.854    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3915    .   1   1   15   CYS   CA     C   -3.585    -0.967    -0.809    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3916    .   1   1   15   CYS   CB     C   -2.067    -1.098    -0.931    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3917    .   1   1   15   CYS   H      H   -3.721    -2.963    -1.478    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3918    .   1   1   15   CYS   HA     H   -3.835    -0.584    0.167     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3919    .   1   1   15   CYS   HB2    H   -1.741    -1.976    -0.393    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3920    .   1   1   15   CYS   HB3    H   -1.824    -1.223    -1.976    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3921    .   1   1   15   CYS   N      N   -4.195    -2.274    -0.969    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3922    .   1   1   15   CYS   O      O   -4.596    -0.440    -2.928    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3923    .   1   1   15   CYS   SG     S   -1.096    0.306     -0.307    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3924    .   1   1   16   CYS   C      C   -3.912    2.384     -3.723    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3925    .   1   1   16   CYS   CA     C   -4.672    2.295     -2.406    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3926    .   1   1   16   CYS   CB     C   -4.690    3.657     -1.703    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3927    .   1   1   16   CYS   H      H   -3.749    1.555     -0.674    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3928    .   1   1   16   CYS   HA     H   -5.691    2.019     -2.628    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3929    .   1   1   16   CYS   HB2    H   -3.679    3.927     -1.434    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3930    .   1   1   16   CYS   HB3    H   -5.079    4.399     -2.386    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3931    .   1   1   16   CYS   N      N   -4.136    1.270     -1.535    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3932    .   1   1   16   CYS   O      O   -2.698    2.129     -3.794    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3933    .   1   1   16   CYS   SG     S   -5.698    3.721     -0.176    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3934    .   1   1   17   LYS   C      C   -3.291    4.152     -6.100    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3935    .   1   1   17   LYS   CA     C   -4.071    2.859     -6.070    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3936    .   1   1   17   LYS   CB     C   -5.164    2.818     -7.129    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3937    .   1   1   17   LYS   CD     C   -7.008    1.445     -8.160    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3938    .   1   1   17   LYS   CE     C   -7.785    0.138     -8.063    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3939    .   1   1   17   LYS   CG     C   -5.936    1.513     -7.096    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3940    .   1   1   17   LYS   H      H   -5.605    2.796     -4.645    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3941    .   1   1   17   LYS   HA     H   -3.382    2.044     -6.237    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3942    .   1   1   17   LYS   HB2    H   -5.850    3.634     -6.962    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3943    .   1   1   17   LYS   HB3    H   -4.715    2.921     -8.106    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3944    .   1   1   17   LYS   HD2    H   -7.690    2.272     -8.027    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3945    .   1   1   17   LYS   HD3    H   -6.544    1.507     -9.132    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3946    .   1   1   17   LYS   HE2    H   -8.297    0.106     -7.112    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3947    .   1   1   17   LYS   HE3    H   -8.511    0.106     -8.861    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3948    .   1   1   17   LYS   HG2    H   -5.238    0.703     -7.257    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3949    .   1   1   17   LYS   HG3    H   -6.389    1.404     -6.122    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3950    .   1   1   17   LYS   HZ1    H   -6.312    -1.004    -9.024    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3951    .   1   1   17   LYS   HZ2    H   -7.446    -1.922    -8.246    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3952    .   1   1   17   LYS   HZ3    H   -6.267    -1.141    -7.345    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3953    .   1   1   17   LYS   N      N   -4.637    2.685     -4.764    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3954    .   1   1   17   LYS   NZ     N   -6.896    -1.042    -8.166    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3955    .   1   1   17   LYS   O      O   -3.787    5.202     -5.666    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3956    .   1   1   18   GLY   C      C   -0.104    4.904     -5.484    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3957    .   1   1   18   GLY   CA     C   -1.165    5.175     -6.526    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3958    .   1   1   18   GLY   H      H   -1.791    3.229     -7.012    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3959    .   1   1   18   GLY   HA2    H   -0.704    5.300     -7.495    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   HA2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3960    .   1   1   18   GLY   HA3    H   -1.701    6.073     -6.258    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   HA3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3961    .   1   1   18   GLY   N      N   -2.078    4.064     -6.579    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3962    .   1   1   18   GLY   O      O   0.823     5.686     -5.282    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3963    .   1   1   19   MET   C      C   1.165     1.952     -4.204    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3964    .   1   1   19   MET   CA     C   0.660     3.328     -3.801    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3965    .   1   1   19   MET   CB     C   -0.039    3.263     -2.431    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3966    .   1   1   19   MET   CE     C   -1.935    6.223     -0.191    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3967    .   1   1   19   MET   CG     C   -0.496    4.612     -1.913    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3968    .   1   1   19   MET   H      H   -1.056    3.240     -4.982    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3969    .   1   1   19   MET   HA     H   1.490     4.018     -3.750    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3970    .   1   1   19   MET   HB2    H   -0.904    2.622     -2.514    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3971    .   1   1   19   MET   HB3    H   0.645     2.836     -1.713    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3972    .   1   1   19   MET   HE1    H   -2.537    6.324     0.700     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3973    .   1   1   19   MET   HE2    H   -2.499    6.553     -1.050    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3974    .   1   1   19   MET   HE3    H   -1.042    6.824     -0.093    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3975    .   1   1   19   MET   HG2    H   0.397     5.175     -1.690    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3976    .   1   1   19   MET   HG3    H   -1.070    5.113     -2.678    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3977    .   1   1   19   MET   N      N   -0.264    3.792     -4.807    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3978    .   1   1   19   MET   O      O   0.663     1.369     -5.166    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3979    .   1   1   19   MET   SD     S   -1.469    4.506     -0.404    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   SD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3980    .   1   1   20   VAL   C      C   2.249     -0.771    -2.638    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3981    .   1   1   20   VAL   CA     C   2.689     0.147     -3.762    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3982    .   1   1   20   VAL   CB     C   4.243     0.174     -3.835    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3983    .   1   1   20   VAL   CG1    C   4.811     -1.221    -4.060    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   CG1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3984    .   1   1   20   VAL   CG2    C   4.713     1.116     -4.932    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   CG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3985    .   1   1   20   VAL   H      H   2.543     1.984     -2.773    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3986    .   1   1   20   VAL   HA     H   2.292     -0.214    -4.699    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3987    .   1   1   20   VAL   HB     H   4.617     0.540     -2.891    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3988    .   1   1   20   VAL   HG11   H   4.519     -1.862    -3.243    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG11   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3989    .   1   1   20   VAL   HG12   H   5.888     -1.170    -4.109    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG12   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3990    .   1   1   20   VAL   HG13   H   4.429     -1.623    -4.986    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG13   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3991    .   1   1   20   VAL   HG21   H   4.379     2.119     -4.713    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3992    .   1   1   20   VAL   HG22   H   4.297     0.800     -5.878    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3993    .   1   1   20   VAL   HG23   H   5.791     1.096     -4.990    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG23   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3994    .   1   1   20   VAL   N      N   2.149     1.457     -3.513    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3995    .   1   1   20   VAL   O      O   2.430     -0.443    -1.453    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3996    .   1   1   21   CYS   C      C   2.281     -3.840    -1.752    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3997    .   1   1   21   CYS   CA     C   1.182     -2.830    -2.032    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3998    .   1   1   21   CYS   CB     C   -0.081    -3.531    -2.538    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   3999    .   1   1   21   CYS   H      H   1.552     -2.085    -3.952    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4000    .   1   1   21   CYS   HA     H   0.954     -2.296    -1.121    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4001    .   1   1   21   CYS   HB2    H   -0.766    -2.794    -2.930    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4002    .   1   1   21   CYS   HB3    H   0.195     -4.206    -3.335    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4003    .   1   1   21   CYS   N      N   1.655     -1.881    -2.997    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4004    .   1   1   21   CYS   O      O   2.868     -4.404    -2.683    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4005    .   1   1   21   CYS   SG     S   -0.979    -4.508    -1.264    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4006    .   1   1   22   ARG   C      C   3.319     -5.148    1.473     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4007    .   1   1   22   ARG   CA     C   3.577     -4.920    -0.026    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4008    .   1   1   22   ARG   CB     C   4.907     -4.219    -0.260    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4009    .   1   1   22   ARG   CD     C   7.308     -4.445    -0.645    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4010    .   1   1   22   ARG   CG     C   6.076     -5.155    -0.277    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4011    .   1   1   22   ARG   CZ     C   7.902     -2.857    -2.472    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   CZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4012    .   1   1   22   ARG   H      H   2.001     -3.630    0.210     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4013    .   1   1   22   ARG   HA     H   3.587     -5.865    -0.548    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4014    .   1   1   22   ARG   HB2    H   4.868     -3.704    -1.208    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4015    .   1   1   22   ARG   HB3    H   5.060     -3.496    0.528     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4016    .   1   1   22   ARG   HD2    H   7.325     -3.594    0.012     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4017    .   1   1   22   ARG   HD3    H   8.122     -5.122    -0.459    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4018    .   1   1   22   ARG   HE     H   6.871     -4.594    -2.672    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4019    .   1   1   22   ARG   HG2    H   6.218     -5.572    0.707     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4020    .   1   1   22   ARG   HG3    H   5.891     -5.943    -0.993    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4021    .   1   1   22   ARG   HH11   H   8.484     -2.176    -0.626    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HH11   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4022    .   1   1   22   ARG   HH12   H   8.915     -1.167    -1.933    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HH12   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4023    .   1   1   22   ARG   HH21   H   7.498     -3.183    -4.447    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HH21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4024    .   1   1   22   ARG   HH22   H   8.342     -1.739    -4.118    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HH22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4025    .   1   1   22   ARG   N      N   2.548     -4.057    -0.487    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4026    .   1   1   22   ARG   NE     N   7.313     -3.983    -2.036    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   NE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4027    .   1   1   22   ARG   NH1    N   8.472     -2.009    -1.615    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   NH1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4028    .   1   1   22   ARG   NH2    N   7.915     -2.577    -3.765    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   NH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4029    .   1   1   22   ARG   O      O   2.214     -4.747    1.980     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4030    .   1   1   23   LEU   C      C   3.729     -4.743    4.326     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4031    .   1   1   23   LEU   CA     C   4.229     -6.000    3.640     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4032    .   1   1   23   LEU   CB     C   5.618     -6.379    4.182     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4033    .   1   1   23   LEU   CD1    C   4.848     -7.842    6.093     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4034    .   1   1   23   LEU   CD2    C   7.149     -6.852    6.123     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4035    .   1   1   23   LEU   CG     C   5.705     -6.646    5.695     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4036    .   1   1   23   LEU   H      H   5.039     -6.188    1.700     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4037    .   1   1   23   LEU   HA     H   3.539     -6.807    3.832     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4038    .   1   1   23   LEU   HB2    H   5.952     -7.265    3.664     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4039    .   1   1   23   LEU   HB3    H   6.298     -5.573    3.946     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4040    .   1   1   23   LEU   HD11   H   5.181     -8.720    5.559     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD11   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4041    .   1   1   23   LEU   HD12   H   3.813     -7.645    5.854     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD12   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4042    .   1   1   23   LEU   HD13   H   4.942     -8.013    7.156     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD13   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4043    .   1   1   23   LEU   HD21   H   7.564     -7.701    5.600     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4044    .   1   1   23   LEU   HD22   H   7.185     -7.033    7.187     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4045    .   1   1   23   LEU   HD23   H   7.723     -5.969    5.889     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD23   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4046    .   1   1   23   LEU   HG     H   5.316     -5.785    6.218     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4047    .   1   1   23   LEU   N      N   4.284     -5.789    2.182     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4048    .   1   1   23   LEU   O      O   2.885     -4.810    5.208     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4049    .   1   1   24   TRP   C      C   3.512     -1.506    3.039     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4050    .   1   1   24   TRP   CA     C   3.722     -2.342    4.300     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4051    .   1   1   24   TRP   CB     C   4.644     -1.635    5.325     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4052    .   1   1   24   TRP   CD1    C   6.161     0.047     4.179     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4053    .   1   1   24   TRP   CD2    C   7.233     -1.782    4.876     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4054    .   1   1   24   TRP   CE2    C   8.167     -0.920    4.266     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4055    .   1   1   24   TRP   CE3    C   7.679     -2.998    5.396     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4056    .   1   1   24   TRP   CG     C   5.954     -1.137    4.798     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4057    .   1   1   24   TRP   CH2    C   9.924     -2.436    4.683     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4058    .   1   1   24   TRP   CZ2    C   9.515     -1.238    4.163     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4059    .   1   1   24   TRP   CZ3    C   9.021     -3.313    5.294     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4060    .   1   1   24   TRP   H      H   4.952     -3.618    3.220     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4061    .   1   1   24   TRP   HA     H   2.765     -2.560    4.747     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4062    .   1   1   24   TRP   HB2    H   4.123     -0.780    5.729     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4063    .   1   1   24   TRP   HB3    H   4.850     -2.325    6.132     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4064    .   1   1   24   TRP   HD1    H   5.348     0.735     3.992     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4065    .   1   1   24   TRP   HE1    H   7.875     0.968     3.383     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4066    .   1   1   24   TRP   HE3    H   6.993     -3.685    5.872     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4067    .   1   1   24   TRP   HH2    H   10.964    -2.723    4.624     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4068    .   1   1   24   TRP   HZ2    H   10.230    -0.575    3.696     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4069    .   1   1   24   TRP   HZ3    H   9.386     -4.249    5.690     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4070    .   1   1   24   TRP   N      N   4.233     -3.609    3.885     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4071    .   1   1   24   TRP   NE1    N   7.484     0.188     3.844     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   NE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4072    .   1   1   24   TRP   O      O   4.209     -1.741    2.031     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4073    .   1   1   25   CYS   C      C   3.350     1.307     1.702     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4074    .   1   1   25   CYS   CA     C   2.305     0.232     1.883     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4075    .   1   1   25   CYS   CB     C   0.903     0.842     1.897     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4076    .   1   1   25   CYS   H      H   2.048     -0.397    3.869     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4077    .   1   1   25   CYS   HA     H   2.378     -0.429    1.030     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4078    .   1   1   25   CYS   HB2    H   0.710     1.257     2.876     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4079    .   1   1   25   CYS   HB3    H   0.864     1.635     1.164     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4080    .   1   1   25   CYS   N      N   2.568     -0.586    3.057     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4081    .   1   1   25   CYS   O      O   4.041     1.695     2.653     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4082    .   1   1   25   CYS   SG     S   -0.445    -0.322    1.526     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4083    .   1   1   26   LYS   C      C   3.851     3.559     -1.002    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4084    .   1   1   26   LYS   CA     C   4.443     2.765     0.136     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4085    .   1   1   26   LYS   CB     C   5.711     2.023     -0.311    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4086    .   1   1   26   LYS   CD     C   8.132     2.066     -0.867    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4087    .   1   1   26   LYS   CE     C   9.380     2.924     -1.005    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4088    .   1   1   26   LYS   CG     C   6.885     2.901     -0.638    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4089    .   1   1   26   LYS   H      H   2.861     1.467     -0.213    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4090    .   1   1   26   LYS   HA     H   4.663     3.397     0.982     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4091    .   1   1   26   LYS   HB2    H   6.010     1.355     0.484     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4092    .   1   1   26   LYS   HB3    H   5.472     1.432     -1.182    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4093    .   1   1   26   LYS   HD2    H   8.263     1.396     -0.029    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4094    .   1   1   26   LYS   HD3    H   7.999     1.487     -1.767    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4095    .   1   1   26   LYS   HE2    H   9.505     3.498     -0.099    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4096    .   1   1   26   LYS   HE3    H   10.233    2.275     -1.134    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4097    .   1   1   26   LYS   HG2    H   6.652     3.455     -1.536    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4098    .   1   1   26   LYS   HG3    H   7.025     3.585     0.180     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4099    .   1   1   26   LYS   HZ1    H   9.201     3.351     -3.042    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4100    .   1   1   26   LYS   HZ2    H   10.186    4.414     -2.181    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4101    .   1   1   26   LYS   HZ3    H   8.524     4.530     -2.025    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4102    .   1   1   26   LYS   N      N   3.468     1.780     0.497     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4103    .   1   1   26   LYS   NZ     N   9.308     3.859     -2.141    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4104    .   1   1   26   LYS   O      O   2.961     3.075     -1.641    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4105    .   1   1   27   LYS   C      C   4.469     5.090     -3.602    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4106    .   1   1   27   LYS   CA     C   3.785     5.529     -2.312    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4107    .   1   1   27   LYS   CB     C   4.034     7.005     -2.031    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4108    .   1   1   27   LYS   CD     C   2.119     7.933     -3.376    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4109    .   1   1   27   LYS   CE     C   1.725     8.792     -4.579    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4110    .   1   1   27   LYS   CG     C   3.631     7.937     -3.134    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4111    .   1   1   27   LYS   H      H   4.965     5.222     -0.694    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4112    .   1   1   27   LYS   HA     H   2.722     5.362     -2.385    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4113    .   1   1   27   LYS   HB2    H   3.466     7.274     -1.155    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4114    .   1   1   27   LYS   HB3    H   5.087     7.135     -1.841    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4115    .   1   1   27   LYS   HD2    H   1.796     6.920     -3.559    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4116    .   1   1   27   LYS   HD3    H   1.624     8.313     -2.495    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4117    .   1   1   27   LYS   HE2    H   2.248     8.424     -5.449    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4118    .   1   1   27   LYS   HE3    H   0.662     8.694     -4.740    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4119    .   1   1   27   LYS   HG2    H   3.990     8.920     -2.876    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4120    .   1   1   27   LYS   HG3    H   4.150     7.547     -3.996    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4121    .   1   1   27   LYS   HZ1    H   3.082     10.352    -4.265    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4122    .   1   1   27   LYS   HZ2    H   1.588     10.620    -3.564    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4123    .   1   1   27   LYS   HZ3    H   1.773     10.783    -5.222    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4124    .   1   1   27   LYS   N      N   4.285     4.767     -1.232    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4125    .   1   1   27   LYS   NZ     N   2.060     10.219    -4.398    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4126    .   1   1   27   LYS   O      O   5.621     4.644     -3.594    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4127    .   1   1   28   LYS   C      C   4.794     6.105     -6.625    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4128    .   1   1   28   LYS   CA     C   4.272     4.841     -5.971    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4129    .   1   1   28   LYS   CB     C   3.173     4.200     -6.822    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4130    .   1   1   28   LYS   CD     C   2.396     3.299     -9.034    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4131    .   1   1   28   LYS   CE     C   2.031     1.900     -8.548    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4132    .   1   1   28   LYS   CG     C   3.562     3.899     -8.258    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4133    .   1   1   28   LYS   H      H   2.832     5.507     -4.600    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4134    .   1   1   28   LYS   HA     H   5.083     4.139     -5.844    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4135    .   1   1   28   LYS   HB2    H   2.883     3.273     -6.348    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4136    .   1   1   28   LYS   HB3    H   2.320     4.861     -6.829    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4137    .   1   1   28   LYS   HD2    H   1.536     3.940     -8.919    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4138    .   1   1   28   LYS   HD3    H   2.667     3.251     -10.079   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4139    .   1   1   28   LYS   HE2    H   1.863     1.923     -7.482    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4140    .   1   1   28   LYS   HE3    H   1.120     1.592     -9.038    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4141    .   1   1   28   LYS   HG2    H   3.871     4.818     -8.733    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4142    .   1   1   28   LYS   HG3    H   4.386     3.202     -8.260    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4143    .   1   1   28   LYS   HZ1    H   3.265     0.864     -9.869    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4144    .   1   1   28   LYS   HZ2    H   2.779     -0.032    -8.541    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4145    .   1   1   28   LYS   HZ3    H   3.986     1.129     -8.364    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4146    .   1   1   28   LYS   N      N   3.752     5.173     -4.675    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4147    .   1   1   28   LYS   NZ     N   3.091     0.912     -8.844    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4148    .   1   1   28   LYS   O      O   4.029     7.030     -6.901    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4149    .   1   1   29   LEU   C      C   6.882     7.046     -8.913    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4150    .   1   1   29   LEU   CA     C   6.698     7.325     -7.441    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4151    .   1   1   29   LEU   CB     C   8.064     7.697     -6.804    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4152    .   1   1   29   LEU   CD1    C   7.060     9.229     -5.040    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4153    .   1   1   29   LEU   CD2    C   7.920     6.963     -4.366    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4154    .   1   1   29   LEU   CG     C   8.083     8.139     -5.319    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4155    .   1   1   29   LEU   H      H   6.648     5.420     -6.522    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4156    .   1   1   29   LEU   HA     H   6.018     8.157     -7.335    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4157    .   1   1   29   LEU   HB2    H   8.712     6.838     -6.893    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4158    .   1   1   29   LEU   HB3    H   8.491     8.494     -7.395    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4159    .   1   1   29   LEU   HD11   H   7.262     10.084    -5.668    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD11   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4160    .   1   1   29   LEU   HD12   H   7.126     9.522     -4.002    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD12   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4161    .   1   1   29   LEU   HD13   H   6.067     8.855     -5.244    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD13   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4162    .   1   1   29   LEU   HD21   H   7.936     7.328     -3.350    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4163    .   1   1   29   LEU   HD22   H   8.732     6.264     -4.512    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4164    .   1   1   29   LEU   HD23   H   6.981     6.469     -4.559    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD23   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4165    .   1   1   29   LEU   HG     H   9.048     8.588     -5.135    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4166    .   1   1   29   LEU   N      N   6.084     6.171     -6.809    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4167    .   1   1   29   LEU   O      O   6.808     7.954     -9.756    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4168    .   1   1   30   TRP   C      C   6.501     4.096     -10.750   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4169    .   1   1   30   TRP   CA     C   7.306     5.346     -10.562   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4170    .   1   1   30   TRP   CB     C   8.797     5.092     -10.861   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4171    .   1   1   30   TRP   CD1    C   10.455    6.645     -9.660    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4172    .   1   1   30   TRP   CD2    C   9.772     7.393     -11.655   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4173    .   1   1   30   TRP   CE2    C   10.667    8.330     -11.111   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4174    .   1   1   30   TRP   CE3    C   9.211     7.649     -12.903   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4175    .   1   1   30   TRP   CG     C   9.655     6.317     -10.718   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4176    .   1   1   30   TRP   CH2    C   10.437    9.727     -12.995   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4177    .   1   1   30   TRP   CZ2    C   11.008    9.504     -11.774   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4178    .   1   1   30   TRP   CZ3    C   9.546     8.814     -13.559   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4179    .   1   1   30   TRP   H      H   7.125     5.109     -8.516    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4180    .   1   1   30   TRP   HA     H   6.930     6.108     -11.229   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4181    .   1   1   30   TRP   HB2    H   9.171     4.342     -10.180   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4182    .   1   1   30   TRP   HB3    H   8.896     4.727     -11.873   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4183    .   1   1   30   TRP   HD1    H   10.577    6.029     -8.781    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4184    .   1   1   30   TRP   HE1    H   11.700    8.317     -9.297    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4185    .   1   1   30   TRP   HE3    H   8.521     6.949     -13.349   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4186    .   1   1   30   TRP   HH2    H   10.671    10.629    -13.541   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4187    .   1   1   30   TRP   HZ2    H   11.696    10.222    -11.355   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4188    .   1   1   30   TRP   HZ3    H   9.114     9.029     -14.526   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4189    .   1   1   30   TRP   N      N   7.107     5.792     -9.220    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4190    .   1   1   30   TRP   NE1    N   11.073    7.852     -9.897    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   NE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4191    .   1   1   30   TRP   O      O   5.424     4.163     -11.346   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   8    .   4192    .   1   1   30   TRP   OXT    O   6.893     3.050     -10.217   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   OXT    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4193    .   1   1   1    TYR   C      C   -10.477   0.832     1.618     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4194    .   1   1   1    TYR   CA     C   -11.879   0.639     2.173     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4195    .   1   1   1    TYR   CB     C   -12.887   1.635     1.559     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4196    .   1   1   1    TYR   CD1    C   -13.538   0.577     -0.655    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4197    .   1   1   1    TYR   CD2    C   -12.529   2.732     -0.686    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4198    .   1   1   1    TYR   CE1    C   -13.642   0.605     -2.034    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4199    .   1   1   1    TYR   CE2    C   -12.624   2.763     -2.058    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4200    .   1   1   1    TYR   CG     C   -12.978   1.640     0.043     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4201    .   1   1   1    TYR   CZ     C   -13.181   1.701     -2.729    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4202    .   1   1   1    TYR   H1     H   -12.806   0.669     4.034     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   H1     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4203    .   1   1   1    TYR   H2     H   -11.474   1.685     3.914     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   H2     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4204    .   1   1   1    TYR   H3     H   -11.247   0.037     4.043     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   H3     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4205    .   1   1   1    TYR   HA     H   -12.189   -0.370    1.942     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4206    .   1   1   1    TYR   HB2    H   -13.874   1.404     1.929     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4207    .   1   1   1    TYR   HB3    H   -12.627   2.633     1.876     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4208    .   1   1   1    TYR   HD1    H   -13.897   -0.285    -0.112    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4209    .   1   1   1    TYR   HD2    H   -12.090   3.570     -0.164    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4210    .   1   1   1    TYR   HE1    H   -14.080   -0.234    -2.555    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4211    .   1   1   1    TYR   HE2    H   -12.261   3.628     -2.595    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4212    .   1   1   1    TYR   HH     H   -12.490   2.133     -4.471    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HH     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4213    .   1   1   1    TYR   N      N   -11.857   0.766     3.622     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4214    .   1   1   1    TYR   O      O   -9.835    -0.128    1.179     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4215    .   1   1   1    TYR   OH     O   -13.293   1.742     -4.101    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   OH     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4216    .   1   1   2    CYS   C      C   -7.638    2.243     2.296     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4217    .   1   1   2    CYS   CA     C   -8.661    2.315     1.170     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4218    .   1   1   2    CYS   CB     C   -8.633    3.690     0.487     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4219    .   1   1   2    CYS   H      H   -10.457   2.778     2.105     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4220    .   1   1   2    CYS   HA     H   -8.427    1.555     0.440     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4221    .   1   1   2    CYS   HB2    H   -9.447    3.745     -0.220    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4222    .   1   1   2    CYS   HB3    H   -8.767    4.451     1.241     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4223    .   1   1   2    CYS   N      N   -9.970    2.036     1.688     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4224    .   1   1   2    CYS   O      O   -7.984    2.363     3.481     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4225    .   1   1   2    CYS   SG     S   -7.084    4.062     -0.416    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4226    .   1   1   3    GLN   C      C   -4.658    3.276     3.018     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4227    .   1   1   3    GLN   CA     C   -5.333    1.937     2.883     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4228    .   1   1   3    GLN   CB     C   -4.290    0.895     2.453     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4229    .   1   1   3    GLN   CD     C   -5.322    -1.014    3.723     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4230    .   1   1   3    GLN   CG     C   -4.795    -0.534    2.395     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4231    .   1   1   3    GLN   H      H   -6.213    1.981     0.973     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4232    .   1   1   3    GLN   HA     H   -5.750    1.642     3.832     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4233    .   1   1   3    GLN   HB2    H   -3.929    1.158     1.469     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4234    .   1   1   3    GLN   HB3    H   -3.463    0.935     3.145     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4235    .   1   1   3    GLN   HE21   H   -3.532    -1.687    4.251     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HE21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4236    .   1   1   3    GLN   HE22   H   -4.797    -1.878    5.409     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HE22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4237    .   1   1   3    GLN   HG2    H   -5.591    -0.595    1.668     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4238    .   1   1   3    GLN   HG3    H   -3.983    -1.179    2.093     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4239    .   1   1   3    GLN   N      N   -6.407    2.031     1.933     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4240    .   1   1   3    GLN   NE2    N   -4.469    -1.584    4.530     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   NE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4241    .   1   1   3    GLN   O      O   -4.690    4.088     2.096     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4242    .   1   1   3    GLN   OE1    O   -6.498    -0.875    4.014     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   OE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4243    .   1   1   4    LYS   C      C   -1.880    4.339     4.151     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4244    .   1   1   4    LYS   CA     C   -3.321    4.698     4.387     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4245    .   1   1   4    LYS   CB     C   -3.503    5.210     5.818     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4246    .   1   1   4    LYS   CD     C   -5.220    6.994     5.392     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4247    .   1   1   4    LYS   CE     C   -6.593    7.551     5.758     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4248    .   1   1   4    LYS   CG     C   -4.903    5.708     6.133     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4249    .   1   1   4    LYS   H      H   -4.208    2.874     4.891     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4250    .   1   1   4    LYS   HA     H   -3.627    5.460     3.685     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4251    .   1   1   4    LYS   HB2    H   -3.269    4.409     6.504     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4252    .   1   1   4    LYS   HB3    H   -2.810    6.022     5.981     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4253    .   1   1   4    LYS   HD2    H   -4.475    7.728     5.654     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4254    .   1   1   4    LYS   HD3    H   -5.183    6.810     4.329     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4255    .   1   1   4    LYS   HE2    H   -6.618    7.736     6.820     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4256    .   1   1   4    LYS   HE3    H   -6.732    8.485     5.235     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4257    .   1   1   4    LYS   HG2    H   -5.570    4.944     5.767     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4258    .   1   1   4    LYS   HG3    H   -5.024    5.846     7.197     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4259    .   1   1   4    LYS   HZ1    H   -7.714    6.385     4.407     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4260    .   1   1   4    LYS   HZ2    H   -8.612    7.097     5.614     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4261    .   1   1   4    LYS   HZ3    H   -7.695    5.758     5.978     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4262    .   1   1   4    LYS   N      N   -4.106    3.521     4.163     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4263    .   1   1   4    LYS   NZ     N   -7.703    6.632     5.418     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4264    .   1   1   4    LYS   O      O   -1.509    3.170     4.272     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4265    .   1   1   5    TRP   C      C   1.080     4.536     4.814     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4266    .   1   1   5    TRP   CA     C   0.375     5.123     3.591     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4267    .   1   1   5    TRP   CB     C   1.055     6.456     3.202     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4268    .   1   1   5    TRP   CD1    C   0.188     8.142     4.952     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4269    .   1   1   5    TRP   CD2    C   2.402     7.858     4.991     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4270    .   1   1   5    TRP   CE2    C   2.054     8.802     5.975     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4271    .   1   1   5    TRP   CE3    C   3.744     7.518     4.834     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4272    .   1   1   5    TRP   CG     C   1.188     7.451     4.340     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4273    .   1   1   5    TRP   CH2    C   4.307     9.051     6.620     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4274    .   1   1   5    TRP   CZ2    C   3.000     9.407     6.796     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4275    .   1   1   5    TRP   CZ3    C   4.683     8.117     5.651     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4276    .   1   1   5    TRP   H      H   -1.476    6.215     3.776     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4277    .   1   1   5    TRP   HA     H   0.473     4.425     2.774     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4278    .   1   1   5    TRP   HB2    H   2.049     6.247     2.834     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4279    .   1   1   5    TRP   HB3    H   0.482     6.923     2.415     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4280    .   1   1   5    TRP   HD1    H   -0.852    8.045     4.691     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4281    .   1   1   5    TRP   HE1    H   0.174     9.563     6.504     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4282    .   1   1   5    TRP   HE3    H   4.049     6.796     4.093     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4283    .   1   1   5    TRP   HH2    H   5.075     9.496     7.235     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4284    .   1   1   5    TRP   HZ2    H   2.732     10.134    7.551     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4285    .   1   1   5    TRP   HZ3    H   5.728     7.864     5.543     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4286    .   1   1   5    TRP   N      N   -1.071    5.323     3.858     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4287    .   1   1   5    TRP   NE1    N   0.700     8.959     5.929     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   NE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4288    .   1   1   5    TRP   O      O   2.143     3.927     4.710     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4289    .   1   1   6    MET   C      C   0.648     2.787     7.458     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4290    .   1   1   6    MET   CA     C   1.022     4.253     7.203     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4291    .   1   1   6    MET   CB     C   0.562     5.138     8.370     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4292    .   1   1   6    MET   CE     C   -3.227    6.054     9.844     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4293    .   1   1   6    MET   CG     C   -0.940    5.161     8.584     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4294    .   1   1   6    MET   H      H   -0.379    5.205     5.946     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4295    .   1   1   6    MET   HA     H   2.090     4.360     7.094     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4296    .   1   1   6    MET   HB2    H   1.021     4.777     9.278     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4297    .   1   1   6    MET   HB3    H   0.895     6.150     8.190     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4298    .   1   1   6    MET   HE1    H   -3.694    6.656     10.609    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4299    .   1   1   6    MET   HE2    H   -3.481    5.015     9.998     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4300    .   1   1   6    MET   HE3    H   -3.577    6.369     8.872     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4301    .   1   1   6    MET   HG2    H   -1.412    5.497     7.673     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4302    .   1   1   6    MET   HG3    H   -1.274    4.160     8.808     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4303    .   1   1   6    MET   N      N   0.472     4.722     5.961     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4304    .   1   1   6    MET   O      O   1.132     2.170     8.397     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4305    .   1   1   6    MET   SD     S   -1.443    6.255     9.923     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   SD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4306    .   1   1   7    TRP   C      C   0.122     -0.050    5.834     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4307    .   1   1   7    TRP   CA     C   -0.643    0.859     6.781     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4308    .   1   1   7    TRP   CB     C   -2.166    0.706     6.583     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4309    .   1   1   7    TRP   CD1    C   -2.602    1.969     8.789     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4310    .   1   1   7    TRP   CD2    C   -4.388    1.789     7.460     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4311    .   1   1   7    TRP   CE2    C   -4.755    2.512     8.612     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4312    .   1   1   7    TRP   CE3    C   -5.349    1.545     6.485     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4313    .   1   1   7    TRP   CG     C   -3.001    1.468     7.581     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4314    .   1   1   7    TRP   CH2    C   -6.966    2.734     7.827     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4315    .   1   1   7    TRP   CZ2    C   -6.045    2.990     8.804     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4316    .   1   1   7    TRP   CZ3    C   -6.629    2.016     6.679     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4317    .   1   1   7    TRP   H      H   -0.530    2.731     5.832     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4318    .   1   1   7    TRP   HA     H   -0.388    0.569     7.789     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4319    .   1   1   7    TRP   HB2    H   -2.426    1.067     5.600     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4320    .   1   1   7    TRP   HB3    H   -2.431    -0.339    6.651     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4321    .   1   1   7    TRP   HD1    H   -1.600    1.881     9.182     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4322    .   1   1   7    TRP   HE1    H   -3.592    3.059     10.278    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4323    .   1   1   7    TRP   HE3    H   -5.105    0.983     5.596     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4324    .   1   1   7    TRP   HH2    H   -7.982    3.082     7.937     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4325    .   1   1   7    TRP   HZ2    H   -6.328    3.549     9.684     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4326    .   1   1   7    TRP   HZ3    H   -7.388    1.834     5.931     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4327    .   1   1   7    TRP   N      N   -0.208    2.233     6.615     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4328    .   1   1   7    TRP   NE1    N   -3.647    2.611     9.403     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   NE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4329    .   1   1   7    TRP   O      O   1.049     0.394     5.133     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4330    .   1   1   8    THR   C      C   -0.615    -3.095    4.250     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4331    .   1   1   8    THR   CA     C   0.445     -2.303    5.041     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4332    .   1   1   8    THR   CB     C   1.209     -3.267    5.998     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4333    .   1   1   8    THR   CG2    C   2.176     -2.495    6.912     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   CG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4334    .   1   1   8    THR   H      H   -0.985    -1.605    6.381     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4335    .   1   1   8    THR   HA     H   1.143     -1.812    4.381     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4336    .   1   1   8    THR   HB     H   1.772     -3.975    5.409     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4337    .   1   1   8    THR   HG1    H   0.543     -4.902    6.789     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HG1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4338    .   1   1   8    THR   HG21   H   1.609     -1.823    7.539     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HG21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4339    .   1   1   8    THR   HG22   H   2.871     -1.912    6.324     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HG22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4340    .   1   1   8    THR   HG23   H   2.721     -3.189    7.536     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HG23   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4341    .   1   1   8    THR   N      N   -0.232    -1.304    5.830     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4342    .   1   1   8    THR   O      O   -1.827    -2.806    4.394     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4343    .   1   1   8    THR   OG1    O   0.272     -3.975    6.835     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   OG1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4344    .   1   1   9    CYS   C      C   -0.886    -6.341    2.857     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4345    .   1   1   9    CYS   CA     C   -1.247    -4.874    2.796     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4346    .   1   1   9    CYS   CB     C   -1.526    -4.443    1.364     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4347    .   1   1   9    CYS   H      H   0.716     -4.262    3.187     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4348    .   1   1   9    CYS   HA     H   -2.144    -4.737    3.380     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4349    .   1   1   9    CYS   HB2    H   -2.390    -4.979    1.004     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4350    .   1   1   9    CYS   HB3    H   -1.743    -3.384    1.355     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4351    .   1   1   9    CYS   N      N   -0.225    -4.065    3.420     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4352    .   1   1   9    CYS   O      O   0.234     -6.698    3.258     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4353    .   1   1   9    CYS   SG     S   -0.187    -4.744    0.196     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4354    .   1   1   10   ASP   C      C   -2.717    -9.196    1.520     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4355    .   1   1   10   ASP   CA     C   -1.654    -8.619    2.485     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4356    .   1   1   10   ASP   CB     C   -1.806    -9.167    3.927     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4357    .   1   1   10   ASP   CG     C   -1.330    -10.600   4.085     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4358    .   1   1   10   ASP   H      H   -2.697    -6.830    2.176     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4359    .   1   1   10   ASP   HA     H   -0.668    -8.837    2.099     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4360    .   1   1   10   ASP   HB2    H   -1.240    -8.546    4.608     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4361    .   1   1   10   ASP   HB3    H   -2.850    -9.123    4.198     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4362    .   1   1   10   ASP   N      N   -1.829    -7.181    2.490     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4363    .   1   1   10   ASP   O      O   -2.931    -8.627    0.442     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4364    .   1   1   10   ASP   OD1    O   -0.139    -10.819   4.330     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   OD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4365    .   1   1   10   ASP   OD2    O   -2.147    -11.537   3.944     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   OD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4366    .   1   1   11   SER   C      C   -5.711    -10.172   1.086     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4367    .   1   1   11   SER   CA     C   -4.351    -10.886   1.013     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4368    .   1   1   11   SER   CB     C   -4.469    -12.370   1.347     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4369    .   1   1   11   SER   H      H   -3.175    -10.726   2.732     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4370    .   1   1   11   SER   HA     H   -3.984    -10.798   0.002     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4371    .   1   1   11   SER   HB2    H   -5.344    -12.779   0.863     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4372    .   1   1   11   SER   HB3    H   -3.588    -12.891   1.002     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4373    .   1   1   11   SER   HG     H   -3.804    -13.035   3.052     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   HG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4374    .   1   1   11   SER   N      N   -3.366    -10.282   1.872     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4375    .   1   1   11   SER   O      O   -6.323    -9.883    0.047     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4376    .   1   1   11   SER   OG     O   -4.591    -12.557   2.758     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   OG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4377    .   1   1   12   GLU   C      C   -7.303    -7.704    2.126     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4378    .   1   1   12   GLU   CA     C   -7.443    -9.182    2.456     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4379    .   1   1   12   GLU   CB     C   -7.993    -9.365    3.878     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4380    .   1   1   12   GLU   CD     C   -9.275    -11.455   3.337     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4381    .   1   1   12   GLU   CG     C   -8.271    -10.810   4.259     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4382    .   1   1   12   GLU   H      H   -5.634    -10.109   3.075     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4383    .   1   1   12   GLU   HA     H   -8.133    -9.624    1.752     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4384    .   1   1   12   GLU   HB2    H   -7.287    -8.959    4.587     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4385    .   1   1   12   GLU   HB3    H   -8.917    -8.812    3.960     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4386    .   1   1   12   GLU   HG2    H   -7.346    -11.364   4.213     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4387    .   1   1   12   GLU   HG3    H   -8.657    -10.837   5.268     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4388    .   1   1   12   GLU   N      N   -6.163    -9.861    2.290     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4389    .   1   1   12   GLU   O      O   -8.054    -7.155    1.327     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4390    .   1   1   12   GLU   OE1    O   -10.492   -11.223   3.509     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   OE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4391    .   1   1   12   GLU   OE2    O   -8.873    -12.183   2.414     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   OE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4392    .   1   1   13   ARG   C      C   -5.143    -5.472    1.390     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4393    .   1   1   13   ARG   CA     C   -6.095    -5.681    2.514     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4394    .   1   1   13   ARG   CB     C   -5.550    -5.035    3.779     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4395    .   1   1   13   ARG   CD     C   -7.616    -3.895    4.662     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4396    .   1   1   13   ARG   CG     C   -6.532    -4.932    4.925     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4397    .   1   1   13   ARG   CZ     C   -8.968    -3.355    2.643     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   CZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4398    .   1   1   13   ARG   H      H   -5.742    -7.584    3.324     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4399    .   1   1   13   ARG   HA     H   -7.037    -5.210    2.275     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4400    .   1   1   13   ARG   HB2    H   -4.742    -5.658    4.123     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4401    .   1   1   13   ARG   HB3    H   -5.175    -4.047    3.550     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4402    .   1   1   13   ARG   HD2    H   -8.236    -3.810    5.540     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4403    .   1   1   13   ARG   HD3    H   -7.134    -2.945    4.478     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4404    .   1   1   13   ARG   HE     H   -8.627    -5.199    3.412     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4405    .   1   1   13   ARG   HG2    H   -6.995    -5.903    5.022     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4406    .   1   1   13   ARG   HG3    H   -5.990    -4.684    5.825     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4407    .   1   1   13   ARG   HH11   H   -8.053    -1.693    3.438     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HH11   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4408    .   1   1   13   ARG   HH12   H   -9.061    -1.373    2.114     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HH12   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4409    .   1   1   13   ARG   HH21   H   -9.954    -4.757    1.556     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HH21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4410    .   1   1   13   ARG   HH22   H   -10.174   -3.168    1.000     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HH22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4411    .   1   1   13   ARG   N      N   -6.335    -7.081    2.725     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4412    .   1   1   13   ARG   NE     N   -8.452    -4.235    3.508     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   NE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4413    .   1   1   13   ARG   NH1    N   -8.670    -2.063    2.734     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   NH1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4414    .   1   1   13   ARG   NH2    N   -9.742    -3.782    1.665     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   NH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4415    .   1   1   13   ARG   O      O   -4.042    -5.965    1.431     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4416    .   1   1   14   LYS   C      C   -4.482    -2.926    -0.650    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4417    .   1   1   14   LYS   CA     C   -4.745    -4.414    -0.735    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4418    .   1   1   14   LYS   CB     C   -5.385    -4.755    -2.082    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4419    .   1   1   14   LYS   CD     C   -6.080    -6.501    -3.736    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4420    .   1   1   14   LYS   CE     C   -6.105    -7.982    -4.046    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4421    .   1   1   14   LYS   CG     C   -5.502    -6.240    -2.356    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4422    .   1   1   14   LYS   H      H   -6.535    -4.541    0.365     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4423    .   1   1   14   LYS   HA     H   -3.807    -4.940    -0.639    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4424    .   1   1   14   LYS   HB2    H   -6.378    -4.331    -2.106    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4425    .   1   1   14   LYS   HB3    H   -4.797    -4.306    -2.868    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4426    .   1   1   14   LYS   HD2    H   -7.091    -6.119    -3.773    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4427    .   1   1   14   LYS   HD3    H   -5.475    -5.996    -4.474    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4428    .   1   1   14   LYS   HE2    H   -5.093    -8.358    -4.003    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4429    .   1   1   14   LYS   HE3    H   -6.705    -8.490    -3.305    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4430    .   1   1   14   LYS   HG2    H   -4.519    -6.684    -2.299    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4431    .   1   1   14   LYS   HG3    H   -6.144    -6.688    -1.612    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4432    .   1   1   14   LYS   HZ1    H   -6.608    -9.291    -5.568    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4433    .   1   1   14   LYS   HZ2    H   -6.094    -7.792    -6.126    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4434    .   1   1   14   LYS   HZ3    H   -7.638    -7.970    -5.467    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4435    .   1   1   14   LYS   N      N   -5.593    -4.807    0.372     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4436    .   1   1   14   LYS   NZ     N   -6.646    -8.267    -5.385    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4437    .   1   1   14   LYS   O      O   -5.381    -2.168    -0.274    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4438    .   1   1   15   CYS   C      C   -3.622    -0.444    -2.201    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4439    .   1   1   15   CYS   CA     C   -2.975    -1.072    -0.974    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4440    .   1   1   15   CYS   CB     C   -1.458    -0.784    -0.965    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4441    .   1   1   15   CYS   H      H   -2.585    -3.150    -1.211    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4442    .   1   1   15   CYS   HA     H   -3.432    -0.641    -0.095    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4443    .   1   1   15   CYS   HB2    H   -1.013    -1.226    -1.845    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4444    .   1   1   15   CYS   HB3    H   -1.305    0.285     -0.996    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4445    .   1   1   15   CYS   N      N   -3.273    -2.499    -0.963    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4446    .   1   1   15   CYS   O      O   -3.761    -1.097    -3.244    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4447    .   1   1   15   CYS   SG     S   -0.551    -1.436    0.488     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4448    .   1   1   16   CYS   C      C   -3.705    1.883     -4.246    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4449    .   1   1   16   CYS   CA     C   -4.702    1.476     -3.158    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4450    .   1   1   16   CYS   CB     C   -5.430    2.695     -2.595    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4451    .   1   1   16   CYS   H      H   -3.901    1.263     -1.237    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4452    .   1   1   16   CYS   HA     H   -5.431    0.801     -3.577    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4453    .   1   1   16   CYS   HB2    H   -4.702    3.398     -2.219    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4454    .   1   1   16   CYS   HB3    H   -6.015    3.160     -3.375    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4455    .   1   1   16   CYS   N      N   -4.034    0.782     -2.079    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4456    .   1   1   16   CYS   O      O   -2.489    1.956     -3.996    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4457    .   1   1   16   CYS   SG     S   -6.559    2.273     -1.223    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4458    .   1   1   17   LYS   C      C   -2.771    3.869     -6.257    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4459    .   1   1   17   LYS   CA     C   -3.429    2.529     -6.587    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4460    .   1   1   17   LYS   CB     C   -4.339    2.647     -7.806    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4461    .   1   1   17   LYS   CD     C   -4.624    3.119     -10.254   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4462    .   1   1   17   LYS   CE     C   -5.337    1.801     -10.543   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4463    .   1   1   17   LYS   CG     C   -3.632    2.987     -9.109    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4464    .   1   1   17   LYS   H      H   -5.180    1.954     -5.575    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4465    .   1   1   17   LYS   HA     H   -2.664    1.789     -6.776    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4466    .   1   1   17   LYS   HB2    H   -4.839    1.699     -7.928    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4467    .   1   1   17   LYS   HB3    H   -5.082    3.406     -7.609    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4468    .   1   1   17   LYS   HD2    H   -5.360    3.861     -9.989    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4469    .   1   1   17   LYS   HD3    H   -4.093    3.437     -11.139   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4470    .   1   1   17   LYS   HE2    H   -4.611    1.099     -10.921   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4471    .   1   1   17   LYS   HE3    H   -5.770    1.416     -9.633    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4472    .   1   1   17   LYS   HG2    H   -3.101    3.919     -8.990    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4473    .   1   1   17   LYS   HG3    H   -2.932    2.197     -9.339    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4474    .   1   1   17   LYS   HZ1    H   -6.861    1.049     -11.747   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4475    .   1   1   17   LYS   HZ2    H   -6.020    2.331     -12.442   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4476    .   1   1   17   LYS   HZ3    H   -7.125    2.621     -11.211   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4477    .   1   1   17   LYS   N      N   -4.217    2.098     -5.447    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4478    .   1   1   17   LYS   NZ     N   -6.398    1.958     -11.548   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4479    .   1   1   17   LYS   O      O   -3.404    4.747     -5.662    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4480    .   1   1   18   GLY   C      C   0.214     4.780     -5.136    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4481    .   1   1   18   GLY   CA     C   -0.770    5.179     -6.207    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4482    .   1   1   18   GLY   H      H   -1.087    3.328     -7.164    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4483    .   1   1   18   GLY   HA2    H   -0.244    5.578     -7.062    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   HA2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4484    .   1   1   18   GLY   HA3    H   -1.441    5.925     -5.807    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   HA3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4485    .   1   1   18   GLY   N      N   -1.523    4.010     -6.607    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4486    .   1   1   18   GLY   O      O   1.159     5.515     -4.804    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4487    .   1   1   19   MET   C      C   1.119     1.590     -4.167    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4488    .   1   1   19   MET   CA     C   0.813     2.969     -3.637    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4489    .   1   1   19   MET   CB     C   0.157     2.860     -2.239    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4490    .   1   1   19   MET   CE     C   -2.338    3.467     -0.226    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4491    .   1   1   19   MET   CG     C   0.048     4.177     -1.485    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4492    .   1   1   19   MET   H      H   -0.857    3.138     -4.838    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4493    .   1   1   19   MET   HA     H   1.731     3.532     -3.564    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4494    .   1   1   19   MET   HB2    H   -0.838    2.462     -2.363    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4495    .   1   1   19   MET   HB3    H   0.736     2.170     -1.641    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4496    .   1   1   19   MET   HE1    H   -2.300    2.535     -0.769    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4497    .   1   1   19   MET   HE2    H   -2.829    4.217     -0.827    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4498    .   1   1   19   MET   HE3    H   -2.892    3.325     0.690     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4499    .   1   1   19   MET   HG2    H   1.051     4.552     -1.352    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4500    .   1   1   19   MET   HG3    H   -0.539    4.875     -2.061    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4501    .   1   1   19   MET   N      N   -0.038    3.617     -4.585    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4502    .   1   1   19   MET   O      O   0.464     1.123     -5.106    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4503    .   1   1   19   MET   SD     S   -0.677    4.007     0.167     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   SD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4504    .   1   1   20   VAL   C      C   1.985     -1.299    -2.921    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4505    .   1   1   20   VAL   CA     C   2.464     -0.373    -4.002    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4506    .   1   1   20   VAL   CB     C   4.005     -0.540    -4.095    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4507    .   1   1   20   VAL   CG1    C   4.368     -1.836    -4.794    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   CG1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4508    .   1   1   20   VAL   CG2    C   4.670     0.644     -4.767    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   CG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4509    .   1   1   20   VAL   H      H   2.584     1.408     -2.881    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4510    .   1   1   20   VAL   HA     H   2.010     -0.617    -4.950    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4511    .   1   1   20   VAL   HB     H   4.377     -0.616    -3.083    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4512    .   1   1   20   VAL   HG11   H   4.004     -1.812    -5.811    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG11   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4513    .   1   1   20   VAL   HG12   H   3.908     -2.665    -4.276    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG12   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4514    .   1   1   20   VAL   HG13   H   5.441     -1.959    -4.797    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG13   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4515    .   1   1   20   VAL   HG21   H   5.740     0.493     -4.783    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4516    .   1   1   20   VAL   HG22   H   4.437     1.548     -4.225    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4517    .   1   1   20   VAL   HG23   H   4.305     0.723     -5.780    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG23   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4518    .   1   1   20   VAL   N      N   2.089     0.958     -3.602    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4519    .   1   1   20   VAL   O      O   2.144     -0.983    -1.730    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4520    .   1   1   21   CYS   C      C   2.089     -4.256    -1.988    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4521    .   1   1   21   CYS   CA     C   0.942     -3.323    -2.307    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4522    .   1   1   21   CYS   CB     C   -0.294    -4.088    -2.799    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4523    .   1   1   21   CYS   H      H   1.273     -2.613    -4.242    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4524    .   1   1   21   CYS   HA     H   0.693     -2.765    -1.417    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4525    .   1   1   21   CYS   HB2    H   -1.030    -3.366    -3.118    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4526    .   1   1   21   CYS   HB3    H   -0.015    -4.704    -3.641    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4527    .   1   1   21   CYS   N      N   1.393     -2.398    -3.290    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4528    .   1   1   21   CYS   O      O   2.437     -5.144    -2.772    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4529    .   1   1   21   CYS   SG     S   -1.121    -5.161    -1.554    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4530    .   1   1   22   ARG   C      C   3.585     -5.090    1.092     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4531    .   1   1   22   ARG   CA     C   3.797     -4.778    -0.365    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4532    .   1   1   22   ARG   CB     C   5.086     -3.961    -0.514    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4533    .   1   1   22   ARG   CD     C   6.923     -3.136    -1.948    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4534    .   1   1   22   ARG   CG     C   5.602     -3.863    -1.917    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4535    .   1   1   22   ARG   CZ     C   8.670     -2.498    -3.635    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   CZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4536    .   1   1   22   ARG   H      H   2.344     -3.307    -0.276    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4537    .   1   1   22   ARG   HA     H   3.905     -5.684    -0.940    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4538    .   1   1   22   ARG   HB2    H   4.885     -2.956    -0.171    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4539    .   1   1   22   ARG   HB3    H   5.861     -4.378    0.109     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4540    .   1   1   22   ARG   HD2    H   6.790     -2.180    -1.464    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4541    .   1   1   22   ARG   HD3    H   7.619     -3.738    -1.385    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4542    .   1   1   22   ARG   HE     H   6.789     -3.125    -4.037    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4543    .   1   1   22   ARG   HG2    H   5.748     -4.879    -2.253    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4544    .   1   1   22   ARG   HG3    H   4.878     -3.356    -2.536    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4545    .   1   1   22   ARG   HH11   H   9.450     -2.607    -1.732    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HH11   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4546    .   1   1   22   ARG   HH12   H   10.530    -2.053    -2.915    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HH12   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4547    .   1   1   22   ARG   HH21   H   8.311     -2.348    -5.646    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HH21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4548    .   1   1   22   ARG   HH22   H   9.889     -1.924    -5.188    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HH22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4549    .   1   1   22   ARG   N      N   2.682     -4.027    -0.852    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4550    .   1   1   22   ARG   NE     N   7.434     -2.940    -3.318    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   NE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4551    .   1   1   22   ARG   NH1    N   9.604     -2.375    -2.696    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   NH1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4552    .   1   1   22   ARG   NH2    N   8.977     -2.234    -4.903    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   NH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4553    .   1   1   22   ARG   O      O   2.438     -4.972    1.630     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4554    .   1   1   23   LEU   C      C   4.158     -4.480    3.914     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4555    .   1   1   23   LEU   CA     C   4.705     -5.707    3.183     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4556    .   1   1   23   LEU   CB     C   6.138     -6.006    3.641     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4557    .   1   1   23   LEU   CD1    C   5.636     -7.601    5.516     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4558    .   1   1   23   LEU   CD2    C   7.807     -6.374    5.464     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4559    .   1   1   23   LEU   CG     C   6.333     -6.308    5.129     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4560    .   1   1   23   LEU   H      H   5.500     -5.615    1.222     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4561    .   1   1   23   LEU   HA     H   4.075     -6.556    3.399     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4562    .   1   1   23   LEU   HB2    H   6.486     -6.864    3.086     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4563    .   1   1   23   LEU   HB3    H   6.761     -5.162    3.383     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4564    .   1   1   23   LEU   HD11   H   6.041     -8.417    4.937     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD11   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4565    .   1   1   23   LEU   HD12   H   4.577     -7.513    5.328     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD12   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4566    .   1   1   23   LEU   HD13   H   5.800     -7.791    6.567     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD13   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4567    .   1   1   23   LEU   HD21   H   7.926     -6.576    6.518     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4568    .   1   1   23   LEU   HD22   H   8.276     -5.432    5.222     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4569    .   1   1   23   LEU   HD23   H   8.270     -7.166    4.894     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD23   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4570    .   1   1   23   LEU   HG     H   5.890     -5.511    5.706     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4571    .   1   1   23   LEU   N      N   4.679     -5.470    1.744     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4572    .   1   1   23   LEU   O      O   3.624     -4.590    4.994     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4573    .   1   1   24   TRP   C      C   3.181     -1.357    2.541     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4574    .   1   1   24   TRP   CA     C   3.734     -2.100    3.767     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4575    .   1   1   24   TRP   CB     C   4.794     -1.251    4.509     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4576    .   1   1   24   TRP   CD1    C   5.743     0.713     3.204     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4577    .   1   1   24   TRP   CD2    C   6.989     -1.130    3.048     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4578    .   1   1   24   TRP   CE2    C   7.600     -0.113    2.287     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4579    .   1   1   24   TRP   CE3    C   7.597     -2.383    3.104     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4580    .   1   1   24   TRP   CG     C   5.798     -0.573    3.621     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4581    .   1   1   24   TRP   CH2    C   9.356     -1.554    1.661     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4582    .   1   1   24   TRP   CZ2    C   8.784     -0.315    1.587     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4583    .   1   1   24   TRP   CZ3    C   8.774     -2.584    2.411     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4584    .   1   1   24   TRP   H      H   4.776     -3.283    2.433     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4585    .   1   1   24   TRP   HA     H   2.934     -2.370    4.435     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4586    .   1   1   24   TRP   HB2    H   4.292     -0.484    5.079     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4587    .   1   1   24   TRP   HB3    H   5.331     -1.892    5.192     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4588    .   1   1   24   TRP   HD1    H   4.933     1.369     3.490     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4589    .   1   1   24   TRP   HE1    H   6.992     1.872     1.971     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4590    .   1   1   24   TRP   HE3    H   7.159     -3.184    3.681     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4591    .   1   1   24   TRP   HH2    H   10.278    -1.755    1.134     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4592    .   1   1   24   TRP   HZ2    H   9.250     0.466     1.004     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4593    .   1   1   24   TRP   HZ3    H   9.257     -3.550    2.442     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4594    .   1   1   24   TRP   N      N   4.297     -3.321    3.287     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4595    .   1   1   24   TRP   NE1    N   6.816     1.002     2.396     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   NE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4596    .   1   1   24   TRP   O      O   3.501     -1.745    1.407     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4597    .   1   1   25   CYS   C      C   2.942     1.458     1.252     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4598    .   1   1   25   CYS   CA     C   1.898     0.421     1.588     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4599    .   1   1   25   CYS   CB     C   0.531     1.077     1.838     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4600    .   1   1   25   CYS   H      H   2.040     -0.086    3.620     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4601    .   1   1   25   CYS   HA     H   1.821     -0.263    0.754     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4602    .   1   1   25   CYS   HB2    H   0.579     1.642     2.759     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4603    .   1   1   25   CYS   HB3    H   0.311     1.750     1.024     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4604    .   1   1   25   CYS   N      N   2.352     -0.349    2.727     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4605    .   1   1   25   CYS   O      O   3.191     2.394     2.026     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4606    .   1   1   25   CYS   SG     S   -0.867    -0.097    1.989     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4607    .   1   1   26   LYS   C      C   4.036     3.220     -1.210    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4608    .   1   1   26   LYS   CA     C   4.608     2.182     -0.290    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4609    .   1   1   26   LYS   CB     C   5.740     1.424     -0.993    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4610    .   1   1   26   LYS   CD     C   7.943     1.561     -2.204    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4611    .   1   1   26   LYS   CE     C   9.050     2.494     -2.677    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4612    .   1   1   26   LYS   CG     C   6.876     2.326     -1.453    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4613    .   1   1   26   LYS   H      H   3.295     0.544     -0.454    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4614    .   1   1   26   LYS   HA     H   4.998     2.654     0.598     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4615    .   1   1   26   LYS   HB2    H   6.142     0.687     -0.313    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4616    .   1   1   26   LYS   HB3    H   5.336     0.921     -1.859    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4617    .   1   1   26   LYS   HD2    H   8.367     0.813     -1.549    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4618    .   1   1   26   LYS   HD3    H   7.493     1.082     -3.061    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4619    .   1   1   26   LYS   HE2    H   9.492     2.974     -1.817    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4620    .   1   1   26   LYS   HE3    H   9.802     1.907     -3.182    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4621    .   1   1   26   LYS   HG2    H   6.477     3.091     -2.101    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4622    .   1   1   26   LYS   HG3    H   7.322     2.790     -0.584    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4623    .   1   1   26   LYS   HZ1    H   9.338     4.160     -3.894    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4624    .   1   1   26   LYS   HZ2    H   7.856     4.182     -3.168    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4625    .   1   1   26   LYS   HZ3    H   8.152     3.139     -4.477    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4626    .   1   1   26   LYS   N      N   3.565     1.290     0.122     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4627    .   1   1   26   LYS   NZ     N   8.552     3.545     -3.603    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4628    .   1   1   26   LYS   O      O   3.494     2.882     -2.255    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4629    .   1   1   27   LYS   C      C   4.591     5.852     -2.771    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4630    .   1   1   27   LYS   CA     C   3.624     5.520     -1.661    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4631    .   1   1   27   LYS   CB     C   3.222     6.756     -0.840    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4632    .   1   1   27   LYS   CD     C   3.828     8.539     0.820     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4633    .   1   1   27   LYS   CE     C   4.891     9.090     1.772     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4634    .   1   1   27   LYS   CG     C   4.314     7.318     0.049     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4635    .   1   1   27   LYS   H      H   4.605     4.670     0.003     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4636    .   1   1   27   LYS   HA     H   2.744     5.124     -2.145    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4637    .   1   1   27   LYS   HB2    H   2.923     7.533     -1.528    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4638    .   1   1   27   LYS   HB3    H   2.373     6.493     -0.229    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4639    .   1   1   27   LYS   HD2    H   3.571     9.312     0.111     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4640    .   1   1   27   LYS   HD3    H   2.951     8.267     1.389     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4641    .   1   1   27   LYS   HE2    H   4.460     9.899     2.342     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4642    .   1   1   27   LYS   HE3    H   5.183     8.302     2.450     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4643    .   1   1   27   LYS   HG2    H   4.630     6.550     0.740     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4644    .   1   1   27   LYS   HG3    H   5.135     7.593     -0.594    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4645    .   1   1   27   LYS   HZ1    H   6.548     8.854     0.503     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4646    .   1   1   27   LYS   HZ2    H   6.789     9.918     1.768     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4647    .   1   1   27   LYS   HZ3    H   5.872     10.403    0.453     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4648    .   1   1   27   LYS   N      N   4.140     4.463     -0.837    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4649    .   1   1   27   LYS   NZ     N   6.091     9.595     1.071     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4650    .   1   1   27   LYS   O      O   5.805     5.954     -2.559    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4651    .   1   1   28   LYS   C      C   4.800     7.724     -5.399    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4652    .   1   1   28   LYS   CA     C   4.836     6.246     -5.129    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4653    .   1   1   28   LYS   CB     C   4.240     5.562     -6.358    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4654    .   1   1   28   LYS   CD     C   3.510     3.577     -7.617    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4655    .   1   1   28   LYS   CE     C   3.369     2.076     -7.703    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4656    .   1   1   28   LYS   CG     C   4.124     4.052     -6.316    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4657    .   1   1   28   LYS   H      H   3.085     5.852     -4.018    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4658    .   1   1   28   LYS   HA     H   5.851     5.904     -4.993    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4659    .   1   1   28   LYS   HB2    H   3.247     5.955     -6.512    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4660    .   1   1   28   LYS   HB3    H   4.842     5.832     -7.214    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4661    .   1   1   28   LYS   HD2    H   2.527     4.016     -7.716    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4662    .   1   1   28   LYS   HD3    H   4.133     3.921     -8.430    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4663    .   1   1   28   LYS   HE2    H   4.349     1.634     -7.622    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4664    .   1   1   28   LYS   HE3    H   2.740     1.734     -6.894    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4665    .   1   1   28   LYS   HG2    H   5.104     3.615     -6.194    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4666    .   1   1   28   LYS   HG3    H   3.482     3.764     -5.496    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4667    .   1   1   28   LYS   HZ1    H   1.839     2.104     -9.114    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4668    .   1   1   28   LYS   HZ2    H   2.679     0.631     -9.023    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4669    .   1   1   28   LYS   HZ3    H   3.382     1.956     -9.778    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4670    .   1   1   28   LYS   N      N   4.058     5.957     -3.949    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4671    .   1   1   28   LYS   NZ     N   2.772     1.666     -8.988    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4672    .   1   1   28   LYS   O      O   3.885     8.432     -4.932    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4673    .   1   1   29   LEU   C      C   5.423     9.553     -8.092    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4674    .   1   1   29   LEU   CA     C   5.747     9.556     -6.596    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4675    .   1   1   29   LEU   CB     C   7.049     10.322    -6.214    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4676    .   1   1   29   LEU   CD1    C   8.747     9.850     -8.056    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4677    .   1   1   29   LEU   CD2    C   9.509     10.293    -5.711    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4678    .   1   1   29   LEU   CG     C   8.413     9.698     -6.578    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4679    .   1   1   29   LEU   H      H   6.537     7.622     -6.322    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4680    .   1   1   29   LEU   HA     H   4.902     10.016    -6.105    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4681    .   1   1   29   LEU   HB2    H   7.006     11.294    -6.683    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4682    .   1   1   29   LEU   HB3    H   7.030     10.477    -5.145    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4683    .   1   1   29   LEU   HD11   H   7.978     9.377     -8.649    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD11   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4684    .   1   1   29   LEU   HD12   H   9.698     9.385     -8.262    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD12   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4685    .   1   1   29   LEU   HD13   H   8.801     10.900    -8.307    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD13   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4686    .   1   1   29   LEU   HD21   H   9.548     11.359    -5.867    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4687    .   1   1   29   LEU   HD22   H   10.460    9.853     -5.973    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4688    .   1   1   29   LEU   HD23   H   9.294     10.091    -4.672    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD23   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4689    .   1   1   29   LEU   HG     H   8.367     8.640     -6.369    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4690    .   1   1   29   LEU   N      N   5.770     8.200     -6.118    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4691    .   1   1   29   LEU   O      O   4.872     10.513    -8.636    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4692    .   1   1   30   TRP   C      C   5.844     6.724     -10.360   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4693    .   1   1   30   TRP   CA     C   5.445     8.154     -10.114   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4694    .   1   1   30   TRP   CB     C   6.194     9.100     -11.087   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4695    .   1   1   30   TRP   CD1    C   6.803     8.263     -13.451   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4696    .   1   1   30   TRP   CD2    C   4.701     9.017     -13.262   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4697    .   1   1   30   TRP   CE2    C   4.906     8.592     -14.588   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4698    .   1   1   30   TRP   CE3    C   3.451     9.526     -12.906   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4699    .   1   1   30   TRP   CG     C   5.929     8.805     -12.548   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4700    .   1   1   30   TRP   CH2    C   2.700     9.166     -15.174   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4701    .   1   1   30   TRP   CZ2    C   3.910     8.665     -15.552   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4702    .   1   1   30   TRP   CZ3    C   2.464     9.595     -13.868   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4703    .   1   1   30   TRP   H      H   6.206     7.728     -8.235    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4704    .   1   1   30   TRP   HA     H   4.379     8.239     -10.257   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4705    .   1   1   30   TRP   HB2    H   5.886     10.117    -10.894   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4706    .   1   1   30   TRP   HB3    H   7.257     9.015     -10.913   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4707    .   1   1   30   TRP   HD1    H   7.821     7.988     -13.218   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4708    .   1   1   30   TRP   HE1    H   6.626     7.782     -15.495   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4709    .   1   1   30   TRP   HE3    H   3.258     9.862     -11.899   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4710    .   1   1   30   TRP   HH2    H   1.898     9.238     -15.895   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4711    .   1   1   30   TRP   HZ2    H   4.065     8.339     -16.572   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4712    .   1   1   30   TRP   HZ3    H   1.488     9.984     -13.614   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4713    .   1   1   30   TRP   N      N   5.734     8.437     -8.721    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4714    .   1   1   30   TRP   NE1    N   6.197     8.142     -14.683   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   NE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4715    .   1   1   30   TRP   O      O   4.978     5.838     -10.329   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   9    .   4716    .   1   1   30   TRP   OXT    O   7.057     6.461     -10.478   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   OXT    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4717    .   1   1   1    TYR   C      C   -10.857   1.419     1.447     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4718    .   1   1   1    TYR   CA     C   -12.125   1.017     2.173     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4719    .   1   1   1    TYR   CB     C   -12.471   2.000     3.320     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4720    .   1   1   1    TYR   CD1    C   -13.525   3.933     2.061     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4721    .   1   1   1    TYR   CD2    C   -11.623   4.368     3.422     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4722    .   1   1   1    TYR   CE1    C   -13.587   5.268     1.717     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4723    .   1   1   1    TYR   CE2    C   -11.678   5.697     3.083     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4724    .   1   1   1    TYR   CG     C   -12.540   3.462     2.919     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4725    .   1   1   1    TYR   CZ     C   -12.659   6.146     2.233     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4726    .   1   1   1    TYR   H1     H   -11.868   -1.020    1.886     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   H1     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4727    .   1   1   1    TYR   H2     H   -12.890   -0.626    3.154     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   H2     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4728    .   1   1   1    TYR   H3     H   -11.227   -0.446    3.333     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   H3     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4729    .   1   1   1    TYR   HA     H   -12.922   1.033     1.446     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4730    .   1   1   1    TYR   HB2    H   -13.432   1.741     3.736     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4731    .   1   1   1    TYR   HB3    H   -11.729   1.914     4.098     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4732    .   1   1   1    TYR   HD1    H   -14.252   3.246     1.656     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4733    .   1   1   1    TYR   HD2    H   -10.850   4.021     4.092     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4734    .   1   1   1    TYR   HE1    H   -14.362   5.613     1.048     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4735    .   1   1   1    TYR   HE2    H   -10.947   6.378     3.494     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4736    .   1   1   1    TYR   HH     H   -13.631   7.771     1.963     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HH     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4737    .   1   1   1    TYR   N      N   -12.017   -0.347    2.665     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4738    .   1   1   1    TYR   O      O   -10.848   1.499     0.212     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4739    .   1   1   1    TYR   OH     O   -12.713   7.479     1.901     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   OH     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4740    .   1   1   2    CYS   C      C   -7.445    1.886     2.607     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4741    .   1   1   2    CYS   CA     C   -8.540    2.051     1.583     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4742    .   1   1   2    CYS   CB     C   -8.616    3.527     1.123     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4743    .   1   1   2    CYS   H      H   -9.782    1.517     3.158     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4744    .   1   1   2    CYS   HA     H   -8.338    1.420     0.731     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4745    .   1   1   2    CYS   HB2    H   -9.523    3.679     0.559     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4746    .   1   1   2    CYS   HB3    H   -8.630    4.150     2.005     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4747    .   1   1   2    CYS   N      N   -9.785    1.640     2.181     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4748    .   1   1   2    CYS   O      O   -7.716    1.897     3.809     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4749    .   1   1   2    CYS   SG     S   -7.218    4.076     0.082     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4750    .   1   1   3    GLN   C      C   -4.239    2.815     2.844     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4751    .   1   1   3    GLN   CA     C   -5.092    1.582     2.999     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4752    .   1   1   3    GLN   CB     C   -4.247    0.355     2.640     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4753    .   1   1   3    GLN   CD     C   -5.474    -1.294    4.131     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4754    .   1   1   3    GLN   CG     C   -4.937    -1.000    2.747     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4755    .   1   1   3    GLN   H      H   -6.114    1.767     1.171     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4756    .   1   1   3    GLN   HA     H   -5.447    1.497     4.014     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4757    .   1   1   3    GLN   HB2    H   -3.907    0.477     1.623     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4758    .   1   1   3    GLN   HB3    H   -3.380    0.345     3.284     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4759    .   1   1   3    GLN   HE21   H   -3.729    -2.066    4.715     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HE21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4760    .   1   1   3    GLN   HE22   H   -4.993    -2.037    5.882     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HE22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4761    .   1   1   3    GLN   HG2    H   -5.765    -1.022    2.052     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4762    .   1   1   3    GLN   HG3    H   -4.231    -1.770    2.478     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4763    .   1   1   3    GLN   N      N   -6.241    1.723     2.143     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4764    .   1   1   3    GLN   NE2    N   -4.653    -1.853    4.980     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   NE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4765    .   1   1   3    GLN   O      O   -4.114    3.340     1.746     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4766    .   1   1   3    GLN   OE1    O   -6.627    -1.005    4.434     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   OE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4767    .   1   1   4    LYS   C      C   -1.369    4.005     3.773     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4768    .   1   1   4    LYS   CA     C   -2.829    4.452     3.875     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4769    .   1   1   4    LYS   CB     C   -3.042    5.309     5.127     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4770    .   1   1   4    LYS   CD     C   -4.632    6.613     6.577     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4771    .   1   1   4    LYS   CE     C   -6.051    7.156     6.728     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4772    .   1   1   4    LYS   CG     C   -4.470    5.813     5.294     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4773    .   1   1   4    LYS   H      H   -3.851    2.842     4.775     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4774    .   1   1   4    LYS   HA     H   -3.089    5.029     3.002     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4775    .   1   1   4    LYS   HB2    H   -2.789    4.720     5.995     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4776    .   1   1   4    LYS   HB3    H   -2.385    6.164     5.075     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4777    .   1   1   4    LYS   HD2    H   -4.414    5.970     7.418     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4778    .   1   1   4    LYS   HD3    H   -3.936    7.439     6.569     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4779    .   1   1   4    LYS   HE2    H   -6.743    6.327     6.707     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4780    .   1   1   4    LYS   HE3    H   -6.125    7.655     7.681     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4781    .   1   1   4    LYS   HG2    H   -4.726    6.442     4.454     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4782    .   1   1   4    LYS   HG3    H   -5.137    4.964     5.322     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4783    .   1   1   4    LYS   HZ1    H   -5.743    8.909     5.635     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4784    .   1   1   4    LYS   HZ2    H   -7.362    8.499     5.786     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4785    .   1   1   4    LYS   HZ3    H   -6.388    7.663     4.710     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4786    .   1   1   4    LYS   N      N   -3.689    3.293     3.922     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4787    .   1   1   4    LYS   NZ     N   -6.408    8.109     5.649     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4788    .   1   1   4    LYS   O      O   -1.052    2.863     4.074     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4789    .   1   1   5    TRP   C      C   1.611     4.363     4.632     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4790    .   1   1   5    TRP   CA     C   0.974     4.623     3.259     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4791    .   1   1   5    TRP   CB     C   1.700     5.800     2.571     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4792    .   1   1   5    TRP   CD1    C   2.466     7.445     4.406     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4793    .   1   1   5    TRP   CD2    C   0.770     8.191     3.166     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4794    .   1   1   5    TRP   CE2    C   1.087     9.159     4.139     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4795    .   1   1   5    TRP   CE3    C   -0.264    8.452     2.269     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4796    .   1   1   5    TRP   CG     C   1.657     7.090     3.361     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4797    .   1   1   5    TRP   CH2    C   -0.598    10.588    3.349     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4798    .   1   1   5    TRP   CZ2    C   0.409     10.356    4.240     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4799    .   1   1   5    TRP   CZ3    C   -0.936    9.650     2.369     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4800    .   1   1   5    TRP   H      H   -0.798    5.825     3.197     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4801    .   1   1   5    TRP   HA     H   1.078     3.738     2.650     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4802    .   1   1   5    TRP   HB2    H   2.735     5.541     2.410     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4803    .   1   1   5    TRP   HB3    H   1.232     5.983     1.615     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4804    .   1   1   5    TRP   HD1    H   3.251     6.823     4.811     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4805    .   1   1   5    TRP   HE1    H   2.544     9.132     5.642     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4806    .   1   1   5    TRP   HE3    H   -0.544    7.746     1.501     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4807    .   1   1   5    TRP   HH2    H   -1.151    11.514    3.389     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4808    .   1   1   5    TRP   HZ2    H   0.663     11.082    4.999     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4809    .   1   1   5    TRP   HZ3    H   -1.739    9.871     1.682     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4810    .   1   1   5    TRP   N      N   -0.477    4.922     3.402     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4811    .   1   1   5    TRP   NE1    N   2.114     8.671     4.884     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   NE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4812    .   1   1   5    TRP   O      O   2.745     3.882     4.759     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4813    .   1   1   6    MET   C      C   0.761     3.254     7.559     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4814    .   1   1   6    MET   CA     C   1.294     4.582     7.018     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4815    .   1   1   6    MET   CB     C   0.773     5.775     7.834     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4816    .   1   1   6    MET   CE     C   -0.668    8.651     7.536     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4817    .   1   1   6    MET   CG     C   -0.742    5.885     7.853     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4818    .   1   1   6    MET   H      H   0.020     5.145     5.430     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4819    .   1   1   6    MET   HA     H   2.372     4.574     7.047     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4820    .   1   1   6    MET   HB2    H   1.125     5.693     8.850     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4821    .   1   1   6    MET   HB3    H   1.167     6.682     7.396     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4822    .   1   1   6    MET   HE1    H   -1.011    8.480     6.525     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4823    .   1   1   6    MET   HE2    H   0.410     8.620     7.564     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4824    .   1   1   6    MET   HE3    H   -1.005    9.623     7.865     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4825    .   1   1   6    MET   HG2    H   -1.098    5.861     6.833     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4826    .   1   1   6    MET   HG3    H   -1.145    5.036     8.386     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4827    .   1   1   6    MET   N      N   0.882     4.737     5.642     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4828    .   1   1   6    MET   O      O   0.963     2.903     8.729     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4829    .   1   1   6    MET   SD     S   -1.352    7.393     8.621     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   SD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4830    .   1   1   7    TRP   C      C   0.199     0.206     6.108     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4831    .   1   1   7    TRP   CA     C   -0.480    1.233     6.992     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4832    .   1   1   7    TRP   CB     C   -2.002    1.198     6.755     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4833    .   1   1   7    TRP   CD1    C   -2.400    2.819     8.719     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4834    .   1   1   7    TRP   CD2    C   -4.206    2.376     7.500     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4835    .   1   1   7    TRP   CE2    C   -4.563    3.280     8.515     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4836    .   1   1   7    TRP   CE3    C   -5.182    1.946     6.613     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4837    .   1   1   7    TRP   CG     C   -2.817    2.108     7.633     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4838    .   1   1   7    TRP   CH2    C   -6.789    3.318     7.771     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4839    .   1   1   7    TRP   CZ2    C   -5.855    3.759     8.660     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4840    .   1   1   7    TRP   CZ3    C   -6.464    2.417     6.756     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4841    .   1   1   7    TRP   H      H   -0.018    2.840     5.763     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4842    .   1   1   7    TRP   HA     H   -0.267    1.007     8.027     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4843    .   1   1   7    TRP   HB2    H   -2.197    1.486     5.732     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4844    .   1   1   7    TRP   HB3    H   -2.354    0.187     6.900     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4845    .   1   1   7    TRP   HD1    H   -1.383    2.820     9.089     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4846    .   1   1   7    TRP   HE1    H   -3.393    4.136     10.022    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4847    .   1   1   7    TRP   HE3    H   -4.942    1.241     5.833     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4848    .   1   1   7    TRP   HH2    H   -7.809    3.661     7.848     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4849    .   1   1   7    TRP   HZ2    H   -6.131    4.456     9.437     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4850    .   1   1   7    TRP   HZ3    H   -7.232    2.090     6.069     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4851    .   1   1   7    TRP   N      N   0.082     2.528     6.689     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4852    .   1   1   7    TRP   NE1    N   -3.442    3.539     9.241     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   NE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4853    .   1   1   7    TRP   O      O   1.143     0.533     5.364     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4854    .   1   1   8    THR   C      C   -0.708    -2.873    4.667     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4855    .   1   1   8    THR   CA     C   0.362     -2.082    5.451     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4856    .   1   1   8    THR   CB     C   1.085     -2.978    6.481     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4857    .   1   1   8    THR   CG2    C   2.207     -2.218    7.192     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   CG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4858    .   1   1   8    THR   H      H   -1.062    -1.233    6.683     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4859    .   1   1   8    THR   HA     H   1.083     -1.661    4.770     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4860    .   1   1   8    THR   HB     H   1.504     -3.831    5.969     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4861    .   1   1   8    THR   HG1    H   -0.263    -4.207    7.160     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HG1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4862    .   1   1   8    THR   HG21   H   2.904     -1.812    6.472     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HG21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4863    .   1   1   8    THR   HG22   H   2.734     -2.886    7.854     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HG22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4864    .   1   1   8    THR   HG23   H   1.778     -1.407    7.764     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HG23   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4865    .   1   1   8    THR   N      N   -0.262    -1.006    6.162     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4866    .   1   1   8    THR   O      O   -1.909    -2.580    4.822     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4867    .   1   1   8    THR   OG1    O   0.147     -3.396    7.477     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   OG1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4868    .   1   1   9    CYS   C      C   -1.234    -6.075    3.315     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4869    .   1   1   9    CYS   CA     C   -1.405    -4.574    3.156     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4870    .   1   1   9    CYS   CB     C   -1.564    -4.186    1.692     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4871    .   1   1   9    CYS   H      H   0.596     -4.072    3.578     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4872    .   1   1   9    CYS   HA     H   -2.311    -4.306    3.682     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4873    .   1   1   9    CYS   HB2    H   -2.485    -4.605    1.315     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4874    .   1   1   9    CYS   HB3    H   -1.616    -3.109    1.620     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4875    .   1   1   9    CYS   N      N   -0.336    -3.840    3.806     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4876    .   1   1   9    CYS   O      O   -0.277    -6.541    3.949     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4877    .   1   1   9    CYS   SG     S   -0.236    -4.746    0.604     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4878    .   1   1   10   ASP   C      C   -2.679    -8.768    1.492     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4879    .   1   1   10   ASP   CA     C   -2.197    -8.271    2.837     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4880    .   1   1   10   ASP   CB     C   -3.221    -8.723    3.911     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4881    .   1   1   10   ASP   CG     C   -2.936    -8.229    5.306     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4882    .   1   1   10   ASP   H      H   -2.859    -6.398    2.205     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4883    .   1   1   10   ASP   HA     H   -1.218    -8.660    3.070     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4884    .   1   1   10   ASP   HB2    H   -4.204    -8.375    3.633     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4885    .   1   1   10   ASP   HB3    H   -3.228    -9.802    3.930     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4886    .   1   1   10   ASP   N      N   -2.157    -6.823    2.752     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4887    .   1   1   10   ASP   O      O   -2.619    -8.037    0.505     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4888    .   1   1   10   ASP   OD1    O   -2.324    -8.965    6.102     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   OD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4889    .   1   1   10   ASP   OD2    O   -3.334    -7.096    5.639     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   OD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4890    .   1   1   11   SER   C      C   -5.214    -10.018   0.179     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4891    .   1   1   11   SER   CA     C   -3.746    -10.478   0.221     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4892    .   1   1   11   SER   CB     C   -3.652    -11.997   0.168     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4893    .   1   1   11   SER   H      H   -3.052    -10.588   2.201     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4894    .   1   1   11   SER   HA     H   -3.218    -10.050   -0.618    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4895    .   1   1   11   SER   HB2    H   -4.283    -12.422   0.936     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4896    .   1   1   11   SER   HB3    H   -3.977    -12.345   -0.800    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4897    .   1   1   11   SER   HG     H   -1.839    -12.386   -0.462    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   HG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4898    .   1   1   11   SER   N      N   -3.143    -9.986    1.433     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4899    .   1   1   11   SER   O      O   -5.773    -9.749    -0.894    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4900    .   1   1   11   SER   OG     O   -2.310    -12.425   0.383     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   OG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4901    .   1   1   12   GLU   C      C   -7.309    -7.940    1.368     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4902    .   1   1   12   GLU   CA     C   -7.208    -9.467    1.482     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4903    .   1   1   12   GLU   CB     C   -7.842    -9.974    2.793     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4904    .   1   1   12   GLU   CD     C   -7.813    -10.057   5.315     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4905    .   1   1   12   GLU   CG     C   -7.100    -9.591    4.073     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4906    .   1   1   12   GLU   H      H   -5.329    -10.169   2.171     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4907    .   1   1   12   GLU   HA     H   -7.745    -9.894    0.648     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4908    .   1   1   12   GLU   HB2    H   -8.844    -9.577    2.860     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4909    .   1   1   12   GLU   HB3    H   -7.903    -11.050   2.749     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4910    .   1   1   12   GLU   HG2    H   -6.114    -10.027   4.055     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4911    .   1   1   12   GLU   HG3    H   -7.009    -8.515    4.107     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4912    .   1   1   12   GLU   N      N   -5.824    -9.915    1.362     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4913    .   1   1   12   GLU   O      O   -8.192    -7.411    0.704     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4914    .   1   1   12   GLU   OE1    O   -7.658    -11.229   5.702     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   OE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4915    .   1   1   12   GLU   OE2    O   -8.552    -9.254    5.927     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   OE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4916    .   1   1   13   ARG   C      C   -5.282    -5.390    1.035     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4917    .   1   1   13   ARG   CA     C   -6.358    -5.803    1.988     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4918    .   1   1   13   ARG   CB     C   -6.051    -5.227    3.370     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4919    .   1   1   13   ARG   CD     C   -6.760    -4.947    5.756     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4920    .   1   1   13   ARG   CG     C   -7.142    -5.459    4.382     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4921    .   1   1   13   ARG   CZ     C   -5.490    -5.940    7.652     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   CZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4922    .   1   1   13   ARG   H      H   -5.757    -7.731    2.576     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4923    .   1   1   13   ARG   HA     H   -7.312    -5.428    1.653     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4924    .   1   1   13   ARG   HB2    H   -5.144    -5.681    3.742     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4925    .   1   1   13   ARG   HB3    H   -5.894    -4.162    3.276     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4926    .   1   1   13   ARG   HD2    H   -6.496    -3.902    5.686     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4927    .   1   1   13   ARG   HD3    H   -7.621    -5.061    6.397     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4928    .   1   1   13   ARG   HE     H   -4.940    -6.051    5.742     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4929    .   1   1   13   ARG   HG2    H   -8.032    -4.945    4.053     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4930    .   1   1   13   ARG   HG3    H   -7.333    -6.519    4.439     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4931    .   1   1   13   ARG   HH11   H   -7.127    -4.869    8.272     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HH11   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4932    .   1   1   13   ARG   HH12   H   -6.255    -5.634    9.520     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HH12   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4933    .   1   1   13   ARG   HH21   H   -3.832    -7.033    7.367     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HH21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4934    .   1   1   13   ARG   HH22   H   -4.324    -6.944    9.010     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HH22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4935    .   1   1   13   ARG   N      N   -6.418    -7.250    2.038     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4936    .   1   1   13   ARG   NE     N   -5.634    -5.690    6.347     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   NE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4937    .   1   1   13   ARG   NH1    N   -6.347    -5.444    8.538     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   NH1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4938    .   1   1   13   ARG   NH2    N   -4.480    -6.680    8.055     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   NH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4939    .   1   1   13   ARG   O      O   -4.133    -5.706    1.264     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4940    .   1   1   14   LYS   C      C   -4.440    -2.767    -0.745    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4941    .   1   1   14   LYS   CA     C   -4.617    -4.255    -0.936    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4942    .   1   1   14   LYS   CB     C   -4.984    -4.553    -2.404    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4943    .   1   1   14   LYS   CD     C   -6.492    -4.072    -4.395    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4944    .   1   1   14   LYS   CE     C   -5.365    -3.586    -5.310    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4945    .   1   1   14   LYS   CG     C   -6.208    -3.791    -2.921    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4946    .   1   1   14   LYS   H      H   -6.569    -4.517    -0.188    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4947    .   1   1   14   LYS   HA     H   -3.690    -4.751    -0.692    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4948    .   1   1   14   LYS   HB2    H   -4.136    -4.291    -3.019    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4949    .   1   1   14   LYS   HB3    H   -5.173    -5.611    -2.506    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4950    .   1   1   14   LYS   HD2    H   -6.615    -5.136    -4.527    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4951    .   1   1   14   LYS   HD3    H   -7.409    -3.573    -4.671    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4952    .   1   1   14   LYS   HE2    H   -4.440    -4.050    -5.005    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4953    .   1   1   14   LYS   HE3    H   -5.587    -3.891    -6.321    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4954    .   1   1   14   LYS   HG2    H   -7.071    -4.067    -2.335    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4955    .   1   1   14   LYS   HG3    H   -6.020    -2.734    -2.794    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4956    .   1   1   14   LYS   HZ1    H   -6.053    -1.624    -5.574    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4957    .   1   1   14   LYS   HZ2    H   -4.413    -1.837    -5.916    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4958    .   1   1   14   LYS   HZ3    H   -4.924    -1.767    -4.330    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4959    .   1   1   14   LYS   N      N   -5.625    -4.725    -0.019    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4960    .   1   1   14   LYS   NZ     N   -5.184    -2.116    -5.278    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4961    .   1   1   14   LYS   O      O   -5.382    -2.077    -0.324    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4962    .   1   1   15   CYS   C      C   -3.788    -0.190    -2.108    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4963    .   1   1   15   CYS   CA     C   -3.022    -0.845    -0.967    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4964    .   1   1   15   CYS   CB     C   -1.530    -0.544    -1.072    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4965    .   1   1   15   CYS   H      H   -2.529    -2.876    -1.258    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4966    .   1   1   15   CYS   HA     H   -3.407    -0.480    -0.029    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4967    .   1   1   15   CYS   HB2    H   -1.173    -0.845    -2.046    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4968    .   1   1   15   CYS   HB3    H   -1.376    0.517     -0.949    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4969    .   1   1   15   CYS   N      N   -3.262    -2.272    -1.020    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4970    .   1   1   15   CYS   O      O   -4.072    -0.849    -3.124    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4971    .   1   1   15   CYS   SG     S   -0.521    -1.401    0.179     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4972    .   1   1   16   CYS   C      C   -4.117    2.130     -4.150    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4973    .   1   1   16   CYS   CA     C   -4.940    1.740     -2.934    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4974    .   1   1   16   CYS   CB     C   -5.633    2.927     -2.282    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4975    .   1   1   16   CYS   H      H   -3.853    1.545     -1.151    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4976    .   1   1   16   CYS   HA     H   -5.696    1.044     -3.260    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4977    .   1   1   16   CYS   HB2    H   -4.891    3.601     -1.876    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4978    .   1   1   16   CYS   HB3    H   -6.235    3.445     -3.012    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4979    .   1   1   16   CYS   N      N   -4.141    1.050     -1.948    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4980    .   1   1   16   CYS   O      O   -2.887    2.124     -4.097    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4981    .   1   1   16   CYS   SG     S   -6.729    2.393     -0.928    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4982    .   1   1   17   LYS   C      C   -3.287    4.023     -6.287    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4983    .   1   1   17   LYS   CA     C   -4.147    2.784     -6.500    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4984    .   1   1   17   LYS   CB     C   -5.200    3.002     -7.595    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4985    .   1   1   17   LYS   CD     C   -5.732    3.346     -10.046   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4986    .   1   1   17   LYS   CE     C   -6.457    2.002     -10.211   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4987    .   1   1   17   LYS   CG     C   -4.635    3.297     -8.978    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4988    .   1   1   17   LYS   H      H   -5.779    2.396     -5.230    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4989    .   1   1   17   LYS   HA     H   -3.502    1.964     -6.785    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4990    .   1   1   17   LYS   HB2    H   -5.809    2.115     -7.657    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4991    .   1   1   17   LYS   HB3    H   -5.826    3.833     -7.303    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4992    .   1   1   17   LYS   HD2    H   -6.458    4.094     -9.764    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4993    .   1   1   17   LYS   HD3    H   -5.286    3.622     -10.990   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4994    .   1   1   17   LYS   HE2    H   -6.922    1.726     -9.277    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4995    .   1   1   17   LYS   HE3    H   -7.223    2.121     -10.962   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4996    .   1   1   17   LYS   HG2    H   -4.131    4.251     -8.949    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4997    .   1   1   17   LYS   HG3    H   -3.926    2.525     -9.232    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4998    .   1   1   17   LYS   HZ1    H   -5.112    1.119     -11.556   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   4999    .   1   1   17   LYS   HZ2    H   -6.042    0.006     -10.716   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5000    .   1   1   17   LYS   HZ3    H   -4.768    0.778     -9.949    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5001    .   1   1   17   LYS   N      N   -4.798    2.418     -5.253    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5002    .   1   1   17   LYS   NZ     N   -5.540    0.912     -10.632   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5003    .   1   1   17   LYS   O      O   -3.784    5.075     -5.860    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5004    .   1   1   18   GLY   C      C   -0.145    4.521     -5.169    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5005    .   1   1   18   GLY   CA     C   -1.076    4.938     -6.287    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5006    .   1   1   18   GLY   H      H   -1.706    3.050     -6.971    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5007    .   1   1   18   GLY   HA2    H   -0.503    5.145     -7.179    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   HA2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5008    .   1   1   18   GLY   HA3    H   -1.608    5.828     -5.986    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   HA3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5009    .   1   1   18   GLY   N      N   -2.018    3.886     -6.562    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5010    .   1   1   18   GLY   O      O   0.603     5.323     -4.637    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5011    .   1   1   19   MET   C      C   0.925     1.257     -4.249    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5012    .   1   1   19   MET   CA     C   0.593     2.647     -3.779    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5013    .   1   1   19   MET   CB     C   -0.150    2.520     -2.439    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5014    .   1   1   19   MET   CE     C   -1.897    5.304     0.084     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5015    .   1   1   19   MET   CG     C   -0.509    3.822     -1.773    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5016    .   1   1   19   MET   H      H   -0.947    2.696     -5.177    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5017    .   1   1   19   MET   HA     H   1.492     3.229     -3.644    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5018    .   1   1   19   MET   HB2    H   -1.070    1.981     -2.614    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5019    .   1   1   19   MET   HB3    H   0.462     1.944     -1.761    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5020    .   1   1   19   MET   HE1    H   -2.554    5.344     0.939     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5021    .   1   1   19   MET   HE2    H   -2.363    5.809     -0.750    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5022    .   1   1   19   MET   HE3    H   -0.964    5.791     0.323     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5023    .   1   1   19   MET   HG2    H   0.418     4.237     -1.404    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5024    .   1   1   19   MET   HG3    H   -0.977    4.488     -2.480    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5025    .   1   1   19   MET   N      N   -0.249    3.267     -4.787    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5026    .   1   1   19   MET   O      O   0.207     0.706     -5.077    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5027    .   1   1   19   MET   SD     S   -1.584    3.594     -0.351    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   SD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5028    .   1   1   20   VAL   C      C   2.006     -1.521    -2.846    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5029    .   1   1   20   VAL   CA     C   2.310     -0.659    -4.066    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5030    .   1   1   20   VAL   CB     C   3.789     -0.823    -4.562    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5031    .   1   1   20   VAL   CG1    C   4.804     -0.364    -3.531    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   CG1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5032    .   1   1   20   VAL   CG2    C   4.071     -2.249    -5.001    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   CG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5033    .   1   1   20   VAL   H      H   2.553     1.221     -3.146    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5034    .   1   1   20   VAL   HA     H   1.630     -0.962    -4.852    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5035    .   1   1   20   VAL   HB     H   3.907     -0.182    -5.426    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5036    .   1   1   20   VAL   HG11   H   4.646     0.685     -3.327    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG11   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5037    .   1   1   20   VAL   HG12   H   5.804     -0.515    -3.911    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG12   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5038    .   1   1   20   VAL   HG13   H   4.672     -0.931    -2.621    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG13   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5039    .   1   1   20   VAL   HG21   H   3.426     -2.508    -5.827    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5040    .   1   1   20   VAL   HG22   H   3.879     -2.918    -4.175    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5041    .   1   1   20   VAL   HG23   H   5.104     -2.339    -5.303    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG23   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5042    .   1   1   20   VAL   N      N   1.976     0.697     -3.750    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5043    .   1   1   20   VAL   O      O   2.307     -1.134    -1.700    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5044    .   1   1   21   CYS   C      C   2.013     -4.484    -1.644    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5045    .   1   1   21   CYS   CA     C   0.925     -3.507    -2.019    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5046    .   1   1   21   CYS   CB     C   -0.351    -4.243    -2.438    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5047    .   1   1   21   CYS   H      H   1.215     -2.922    -4.008    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5048    .   1   1   21   CYS   HA     H   0.700     -2.890    -1.161    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5049    .   1   1   21   CYS   HB2    H   -1.074    -3.521    -2.789    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5050    .   1   1   21   CYS   HB3    H   -0.102    -4.910    -3.250    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5051    .   1   1   21   CYS   N      N   1.371     -2.642    -3.079    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5052    .   1   1   21   CYS   O      O   2.330     -5.407    -2.397    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5053    .   1   1   21   CYS   SG     S   -1.175    -5.241    -1.128    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5054    .   1   1   22   ARG   C      C   3.512     -5.159    1.572     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5055    .   1   1   22   ARG   CA     C   3.648     -5.068    0.057     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5056    .   1   1   22   ARG   CB     C   5.001     -4.478    -0.323    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5057    .   1   1   22   ARG   CD     C   6.607     -4.049    -2.146    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5058    .   1   1   22   ARG   CG     C   5.313     -4.670    -1.769    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5059    .   1   1   22   ARG   CZ     C   7.947     -3.751    -4.208    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   CZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5060    .   1   1   22   ARG   H      H   2.307     -3.480    0.048     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5061    .   1   1   22   ARG   HA     H   3.576     -6.051    -0.385    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5062    .   1   1   22   ARG   HB2    H   4.998     -3.419    -0.112    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5063    .   1   1   22   ARG   HB3    H   5.784     -4.949    0.250     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5064    .   1   1   22   ARG   HD2    H   6.580     -3.011    -1.850    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5065    .   1   1   22   ARG   HD3    H   7.380     -4.574    -1.607    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5066    .   1   1   22   ARG   HE     H   6.103     -4.561    -4.091    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5067    .   1   1   22   ARG   HG2    H   5.388     -5.738    -1.907    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5068    .   1   1   22   ARG   HG3    H   4.509     -4.268    -2.365    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5069    .   1   1   22   ARG   HH11   H   8.972     -3.196    -2.511    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HH11   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5070    .   1   1   22   ARG   HH12   H   9.813     -2.938    -3.958    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HH12   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5071    .   1   1   22   ARG   HH21   H   7.277     -4.218    -6.081    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HH21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5072    .   1   1   22   ARG   HH22   H   8.841     -3.559    -6.036    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HH22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5073    .   1   1   22   ARG   N      N   2.601     -4.250    -0.488    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5074    .   1   1   22   ARG   NE     N   6.847     -4.164    -3.584    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   NE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5075    .   1   1   22   ARG   NH1    N   8.975     -3.266    -3.513    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   NH1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5076    .   1   1   22   ARG   NH2    N   8.026     -3.847    -5.527    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   NH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5077    .   1   1   22   ARG   O      O   2.373     -4.986    2.147     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5078    .   1   1   23   LEU   C      C   4.098     -4.309    4.280     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5079    .   1   1   23   LEU   CA     C   4.756     -5.528    3.684     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5080    .   1   1   23   LEU   CB     C   6.224     -5.599    4.120     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5081    .   1   1   23   LEU   CD1    C   5.843     -6.871    6.263     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5082    .   1   1   23   LEU   CD2    C   7.979     -5.630    5.910     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5083    .   1   1   23   LEU   CG     C   6.488     -5.647    5.633     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5084    .   1   1   23   LEU   H      H   5.434     -5.696    1.679     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5085    .   1   1   23   LEU   HA     H   4.237     -6.412    4.023     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5086    .   1   1   23   LEU   HB2    H   6.669     -6.475    3.675     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5087    .   1   1   23   LEU   HB3    H   6.727     -4.728    3.725     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5088    .   1   1   23   LEU   HD11   H   6.071     -6.895    7.318     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD11   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5089    .   1   1   23   LEU   HD12   H   6.223     -7.762    5.788     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD12   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5090    .   1   1   23   LEU   HD13   H   4.773     -6.821    6.129     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD13   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5091    .   1   1   23   LEU   HD21   H   8.150     -5.670    6.975     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5092    .   1   1   23   LEU   HD22   H   8.408     -4.723    5.511     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5093    .   1   1   23   LEU   HD23   H   8.441     -6.484    5.437     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD23   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5094    .   1   1   23   LEU   HG     H   6.050     -4.774    6.091     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5095    .   1   1   23   LEU   N      N   4.646     -5.472    2.224     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5096    .   1   1   23   LEU   O      O   3.371     -4.412    5.256     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5097    .   1   1   24   TRP   C      C   3.162     -1.320    2.731     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5098    .   1   1   24   TRP   CA     C   3.656     -1.973    4.008     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5099    .   1   1   24   TRP   CB     C   4.519     -1.009    4.852     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5100    .   1   1   24   TRP   CD1    C   5.671     0.764     3.428     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5101    .   1   1   24   TRP   CD2    C   7.043     -0.842    4.153     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5102    .   1   1   24   TRP   CE2    C   7.794     0.079     3.396     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5103    .   1   1   24   TRP   CE3    C   7.693     -1.941    4.713     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5104    .   1   1   24   TRP   CG     C   5.687     -0.384    4.153     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5105    .   1   1   24   TRP   CH2    C   9.767     -1.153    3.754     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5106    .   1   1   24   TRP   CZ2    C   9.158     -0.069    3.190     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5107    .   1   1   24   TRP   CZ3    C   9.049     -2.084    4.509     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5108    .   1   1   24   TRP   H      H   4.971     -3.141    2.913     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5109    .   1   1   24   TRP   HA     H   2.806     -2.300    4.584     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5110    .   1   1   24   TRP   HB2    H   3.897     -0.201    5.204     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5111    .   1   1   24   TRP   HB3    H   4.896     -1.549    5.707     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5112    .   1   1   24   TRP   HD1    H   4.764     1.331     3.269     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5113    .   1   1   24   TRP   HE1    H   7.182     1.834     2.418     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5114    .   1   1   24   TRP   HE3    H   7.154     -2.671    5.300     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5115    .   1   1   24   TRP   HH2    H   10.828    -1.306    3.622     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5116    .   1   1   24   TRP   HZ2    H   9.737     0.638     2.612     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5117    .   1   1   24   TRP   HZ3    H   9.575     -2.927    4.936     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5118    .   1   1   24   TRP   N      N   4.337     -3.171    3.660     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5119    .   1   1   24   TRP   NE1    N   6.935     1.053     2.968     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   NE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5120    .   1   1   24   TRP   O      O   3.578     -1.727    1.633     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5121    .   1   1   25   CYS   C      C   2.750     1.448     1.336     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5122    .   1   1   25   CYS   CA     C   1.800     0.349     1.690     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5123    .   1   1   25   CYS   CB     C   0.388     0.888     1.896     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5124    .   1   1   25   CYS   H      H   1.948     -0.090    3.732     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5125    .   1   1   25   CYS   HA     H   1.789     -0.357    0.872     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5126    .   1   1   25   CYS   HB2    H   0.340     1.409     2.841     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5127    .   1   1   25   CYS   HB3    H   0.149     1.573     1.096     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5128    .   1   1   25   CYS   N      N   2.280     -0.363    2.848     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5129    .   1   1   25   CYS   O      O   2.927     2.407     2.088     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5130    .   1   1   25   CYS   SG     S   -0.879    -0.411    1.915     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5131    .   1   1   26   LYS   C      C   3.734     3.088     -1.302    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5132    .   1   1   26   LYS   CA     C   4.336     2.259     -0.210    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5133    .   1   1   26   LYS   CB     C   5.632     1.569     -0.631    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5134    .   1   1   26   LYS   CD     C   8.049     1.768     -1.172    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5135    .   1   1   26   LYS   CE     C   9.203     2.701     -1.481    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5136    .   1   1   26   LYS   CG     C   6.738     2.510     -1.058    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5137    .   1   1   26   LYS   H      H   3.151     0.550     -0.370    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5138    .   1   1   26   LYS   HA     H   4.532     2.898     0.637     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5139    .   1   1   26   LYS   HB2    H   5.993     0.989     0.206     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5140    .   1   1   26   LYS   HB3    H   5.422     0.895     -1.447    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5141    .   1   1   26   LYS   HD2    H   8.250     1.275     -0.232    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5142    .   1   1   26   LYS   HD3    H   7.968     1.029     -1.956    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5143    .   1   1   26   LYS   HE2    H   9.050     3.154     -2.449    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5144    .   1   1   26   LYS   HE3    H   9.233     3.477     -0.731    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5145    .   1   1   26   LYS   HG2    H   6.483     2.933     -2.019    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5146    .   1   1   26   LYS   HG3    H   6.830     3.299     -0.329    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5147    .   1   1   26   LYS   HZ1    H   10.489    1.220     -2.192    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5148    .   1   1   26   LYS   HZ2    H   10.643    1.533     -0.558    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5149    .   1   1   26   LYS   HZ3    H   11.290    2.616     -1.667    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5150    .   1   1   26   LYS   N      N   3.376     1.307     0.212     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5151    .   1   1   26   LYS   NZ     N   10.490    1.981     -1.485    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5152    .   1   1   26   LYS   O      O   3.308     2.564     -2.321    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5153    .   1   1   27   LYS   C      C   3.792     5.599     -3.212    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5154    .   1   1   27   LYS   CA     C   3.000     5.294     -1.949    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5155    .   1   1   27   LYS   CB     C   2.648     6.579     -1.194    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5156    .   1   1   27   LYS   CD     C   3.437     8.439     0.300     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5157    .   1   1   27   LYS   CE     C   4.633     9.004     1.044     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5158    .   1   1   27   LYS   CG     C   3.839     7.242     -0.532    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5159    .   1   1   27   LYS   H      H   4.119     4.683     -0.254    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5160    .   1   1   27   LYS   HA     H   2.076     4.834     -2.262    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5161    .   1   1   27   LYS   HB2    H   2.220     7.279     -1.898    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5162    .   1   1   27   LYS   HB3    H   1.915     6.350     -0.434    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5163    .   1   1   27   LYS   HD2    H   3.032     9.200     -0.350    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5164    .   1   1   27   LYS   HD3    H   2.687     8.136     1.017     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5165    .   1   1   27   LYS   HE2    H   5.384     9.282     0.320     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5166    .   1   1   27   LYS   HE3    H   4.320     9.878     1.596     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5167    .   1   1   27   LYS   HG2    H   4.315     6.525     0.117     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5168    .   1   1   27   LYS   HG3    H   4.534     7.558     -1.295    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5169    .   1   1   27   LYS   HZ1    H   6.058     8.445     2.441     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5170    .   1   1   27   LYS   HZ2    H   5.583     7.171     1.498     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5171    .   1   1   27   LYS   HZ3    H   4.567     7.742     2.732     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5172    .   1   1   27   LYS   N      N   3.669     4.359     -1.063    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5173    .   1   1   27   LYS   NZ     N   5.227     8.022     1.982     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5174    .   1   1   27   LYS   O      O   4.934     5.162     -3.383    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5175    .   1   1   28   LYS   C      C   4.797     7.798     -5.131    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5176    .   1   1   28   LYS   CA     C   3.733     6.730     -5.329    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5177    .   1   1   28   LYS   CB     C   2.636     7.206     -6.299    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5178    .   1   1   28   LYS   CD     C   1.991     8.351     -8.446    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5179    .   1   1   28   LYS   CE     C   1.505     7.201     -9.310    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5180    .   1   1   28   LYS   CG     C   3.139     7.948     -7.536    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5181    .   1   1   28   LYS   H      H   2.221     6.545     -3.917    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5182    .   1   1   28   LYS   HA     H   4.206     5.864     -5.768    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5183    .   1   1   28   LYS   HB2    H   2.074     6.346     -6.630    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5184    .   1   1   28   LYS   HB3    H   1.968     7.861     -5.759    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5185    .   1   1   28   LYS   HD2    H   1.169     8.697     -7.836    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5186    .   1   1   28   LYS   HD3    H   2.330     9.156     -9.080    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5187    .   1   1   28   LYS   HE2    H   1.376     6.325     -8.691    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5188    .   1   1   28   LYS   HE3    H   0.554     7.475     -9.741    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5189    .   1   1   28   LYS   HG2    H   3.664     8.836     -7.219    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5190    .   1   1   28   LYS   HG3    H   3.815     7.306     -8.082    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5191    .   1   1   28   LYS   HZ1    H   2.485     7.660     -11.094   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5192    .   1   1   28   LYS   HZ2    H   2.213     6.006     -10.902   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5193    .   1   1   28   LYS   HZ3    H   3.436     6.775     -10.048   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5194    .   1   1   28   LYS   N      N   3.158     6.314     -4.095    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5195    .   1   1   28   LYS   NZ     N   2.459     6.883     -10.402   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5196    .   1   1   28   LYS   O      O   4.494     8.975     -4.877    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5197    .   1   1   29   LEU   C      C   7.679     8.214     -6.665    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5198    .   1   1   29   LEU   CA     C   7.164     8.252     -5.234    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5199    .   1   1   29   LEU   CB     C   8.310     7.872     -4.251    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5200    .   1   1   29   LEU   CD1    C   7.467     9.381     -2.381    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5201    .   1   1   29   LEU   CD2    C   7.237     6.886     -2.159    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5202    .   1   1   29   LEU   CG     C   8.061     8.024     -2.729    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5203    .   1   1   29   LEU   H      H   6.183     6.391     -5.088    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5204    .   1   1   29   LEU   HA     H   6.810     9.251     -5.024    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5205    .   1   1   29   LEU   HB2    H   8.566     6.839     -4.434    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5206    .   1   1   29   LEU   HB3    H   9.168     8.474     -4.509    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5207    .   1   1   29   LEU   HD11   H   7.332     9.449     -1.311    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD11   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5208    .   1   1   29   LEU   HD12   H   6.510     9.493     -2.868    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD12   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5209    .   1   1   29   LEU   HD13   H   8.132     10.167    -2.711    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD13   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5210    .   1   1   29   LEU   HD21   H   7.762     5.952     -2.302    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5211    .   1   1   29   LEU   HD22   H   6.286     6.842     -2.668    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5212    .   1   1   29   LEU   HD23   H   7.074     7.051     -1.104    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD23   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5213    .   1   1   29   LEU   HG     H   9.032     8.007     -2.253    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5214    .   1   1   29   LEU   N      N   6.028     7.359     -5.160    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5215    .   1   1   29   LEU   O      O   8.710     8.796     -6.996    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5216    .   1   1   30   TRP   C      C   6.026     7.794     -9.690    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5217    .   1   1   30   TRP   CA     C   7.236     7.331     -8.903    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5218    .   1   1   30   TRP   CB     C   7.472     5.849     -9.233    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5219    .   1   1   30   TRP   CD1    C   9.768     4.983     -8.494    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5220    .   1   1   30   TRP   CD2    C   8.079     4.388     -7.156    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5221    .   1   1   30   TRP   CE2    C   9.265     3.839     -6.645    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5222    .   1   1   30   TRP   CE3    C   6.878     4.151     -6.480    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5223    .   1   1   30   TRP   CG     C   8.423     5.119     -8.339    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5224    .   1   1   30   TRP   CH2    C   8.094     2.849     -4.856    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5225    .   1   1   30   TRP   CZ2    C   9.286     3.064     -5.493    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5226    .   1   1   30   TRP   CZ3    C   6.898     3.383     -5.338    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5227    .   1   1   30   TRP   H      H   6.099     7.119     -7.167    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5228    .   1   1   30   TRP   HA     H   8.105     7.915     -9.166    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5229    .   1   1   30   TRP   HB2    H   6.528     5.330     -9.182    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5230    .   1   1   30   TRP   HB3    H   7.844     5.780     -10.245   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5231    .   1   1   30   TRP   HD1    H   10.335    5.420     -9.305    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5232    .   1   1   30   TRP   HE1    H   11.231    3.969     -7.373    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5233    .   1   1   30   TRP   HE3    H   5.944     4.555     -6.844    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5234    .   1   1   30   TRP   HH2    H   8.056     2.248     -3.959    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5235    .   1   1   30   TRP   HZ2    H   10.201    2.640     -5.102    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5236    .   1   1   30   TRP   HZ3    H   5.980     3.190     -4.802    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5237    .   1   1   30   TRP   N      N   6.928     7.514     -7.505    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5238    .   1   1   30   TRP   NE1    N   10.282    4.210     -7.481    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   NE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5239    .   1   1   30   TRP   O      O   5.118     6.967     -9.948    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   10   .   5240    .   1   1   30   TRP   OXT    O   5.931     8.984     -10.007   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   OXT    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5241    .   1   1   1    TYR   C      C   -9.880    0.232     2.003     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5242    .   1   1   1    TYR   CA     C   -11.159   0.760     2.550     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5243    .   1   1   1    TYR   CB     C   -10.835   1.708     3.722     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5244    .   1   1   1    TYR   CD1    C   -12.543   1.710     5.562     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5245    .   1   1   1    TYR   CD2    C   -12.668   3.410     3.907     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5246    .   1   1   1    TYR   CE1    C   -13.645   2.230     6.187     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5247    .   1   1   1    TYR   CE2    C   -13.767   3.939     4.526     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5248    .   1   1   1    TYR   CG     C   -12.037   2.288     4.410     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5249    .   1   1   1    TYR   CZ     C   -14.251   3.346     5.664     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5250    .   1   1   1    TYR   H1     H   -12.195   -0.970    2.169     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   H1     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5251    .   1   1   1    TYR   H2     H   -12.843   -0.082    3.471     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   H2     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5252    .   1   1   1    TYR   H3     H   -11.392   -0.949    3.629     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   H3     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5253    .   1   1   1    TYR   HA     H   -11.679   1.305     1.777     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5254    .   1   1   1    TYR   HB2    H   -10.261   1.176     4.464     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5255    .   1   1   1    TYR   HB3    H   -10.236   2.527     3.354     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5256    .   1   1   1    TYR   HD1    H   -12.063   0.833     5.972     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5257    .   1   1   1    TYR   HD2    H   -12.287   3.875     3.011     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5258    .   1   1   1    TYR   HE1    H   -14.021   1.761     7.083     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5259    .   1   1   1    TYR   HE2    H   -14.246   4.816     4.116     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5260    .   1   1   1    TYR   HH     H   -15.199   3.823     7.226     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HH     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5261    .   1   1   1    TYR   N      N   -11.971   -0.371    2.988     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5262    .   1   1   1    TYR   O      O   -9.584    -0.961    2.155     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5263    .   1   1   1    TYR   OH     O   -15.343   3.863     6.274     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   OH     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5264    .   1   1   2    CYS   C      C   -6.820    1.121     1.947     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5265    .   1   1   2    CYS   CA     C   -7.840    0.694     0.908     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5266    .   1   1   2    CYS   CB     C   -7.537    1.288     -0.478    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5267    .   1   1   2    CYS   H      H   -9.435    1.996     1.216     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5268    .   1   1   2    CYS   HA     H   -7.829    -0.385    0.849     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5269    .   1   1   2    CYS   HB2    H   -6.542    0.986     -0.768    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5270    .   1   1   2    CYS   HB3    H   -8.244    0.886     -1.190    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5271    .   1   1   2    CYS   N      N   -9.130    1.075     1.367     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5272    .   1   1   2    CYS   O      O   -7.069    2.050     2.734     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5273    .   1   1   2    CYS   SG     S   -7.603    3.117     -0.591    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5274    .   1   1   3    GLN   C      C   -3.846    1.902     2.437     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5275    .   1   1   3    GLN   CA     C   -4.687    0.759     2.936     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5276    .   1   1   3    GLN   CB     C   -3.829    -0.470    3.184     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5277    .   1   1   3    GLN   CD     C   -5.134    -1.418    5.098     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5278    .   1   1   3    GLN   CG     C   -4.621    -1.650    3.694     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5279    .   1   1   3    GLN   H      H   -5.594    -0.294    1.360     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5280    .   1   1   3    GLN   HA     H   -5.176    1.035     3.857     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5281    .   1   1   3    GLN   HB2    H   -3.307    -0.754    2.283     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5282    .   1   1   3    GLN   HB3    H   -3.094    -0.220    3.934     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5283    .   1   1   3    GLN   HE21   H   -3.480    -2.187    5.825     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HE21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5284    .   1   1   3    GLN   HE22   H   -4.647    -1.679    6.994     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HE22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5285    .   1   1   3    GLN   HG2    H   -5.469    -1.776    3.037     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5286    .   1   1   3    GLN   HG3    H   -4.009    -2.538    3.654     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5287    .   1   1   3    GLN   N      N   -5.712    0.457     1.981     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5288    .   1   1   3    GLN   NE2    N   -4.348    -1.790    6.069     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   NE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5289    .   1   1   3    GLN   O      O   -3.390    1.900     1.306     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5290    .   1   1   3    GLN   OE1    O   -6.229    -0.888    5.301     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   OE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5291    .   1   1   4    LYS   C      C   -1.458    3.785     3.138     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5292    .   1   1   4    LYS   CA     C   -2.935    4.058     2.910     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5293    .   1   1   4    LYS   CB     C   -3.428    5.240     3.747     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5294    .   1   1   4    LYS   CD     C   -5.456    6.576     4.493     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5295    .   1   1   4    LYS   CE     C   -6.971    6.629     4.411     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5296    .   1   1   4    LYS   CG     C   -4.931    5.452     3.618     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5297    .   1   1   4    LYS   H      H   -4.088    2.823     4.154     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5298    .   1   1   4    LYS   HA     H   -3.104    4.265     1.864     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5299    .   1   1   4    LYS   HB2    H   -3.188    5.063     4.784     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5300    .   1   1   4    LYS   HB3    H   -2.931    6.137     3.410     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5301    .   1   1   4    LYS   HD2    H   -5.165    6.390     5.516     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5302    .   1   1   4    LYS   HD3    H   -5.048    7.518     4.157     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5303    .   1   1   4    LYS   HE2    H   -7.250    6.775     3.379     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5304    .   1   1   4    LYS   HE3    H   -7.364    5.682     4.753     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5305    .   1   1   4    LYS   HG2    H   -5.161    5.685     2.588     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5306    .   1   1   4    LYS   HG3    H   -5.430    4.532     3.888     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5307    .   1   1   4    LYS   HZ1    H   -8.603    7.622     5.172     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5308    .   1   1   4    LYS   HZ2    H   -7.341    8.646     4.804     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5309    .   1   1   4    LYS   HZ3    H   -7.274    7.692     6.206     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5310    .   1   1   4    LYS   N      N   -3.688    2.887     3.263     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5311    .   1   1   4    LYS   NZ     N   -7.566    7.715     5.209     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5312    .   1   1   4    LYS   O      O   -1.110    2.802     3.788     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5313    .   1   1   5    TRP   C      C   1.367     4.401     4.145     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5314    .   1   1   5    TRP   CA     C   0.875     4.491     2.716     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5315    .   1   1   5    TRP   CB     C   1.618     5.631     2.010     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5316    .   1   1   5    TRP   CD1    C   0.452     7.793     2.714     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5317    .   1   1   5    TRP   CD2    C   2.521     7.612     3.510     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5318    .   1   1   5    TRP   CE2    C   1.984     8.834     3.938     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5319    .   1   1   5    TRP   CE3    C   3.814     7.278     3.900     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5320    .   1   1   5    TRP   CG     C   1.517     6.966     2.708     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5321    .   1   1   5    TRP   CH2    C   3.953     9.367     5.104     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5322    .   1   1   5    TRP   CZ2    C   2.691     9.722     4.735     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5323    .   1   1   5    TRP   CZ3    C   4.517     8.158     4.695     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5324    .   1   1   5    TRP   H      H   -0.956    5.484     2.233     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5325    .   1   1   5    TRP   HA     H   1.113     3.565     2.215     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5326    .   1   1   5    TRP   HB2    H   2.664     5.371     1.950     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5327    .   1   1   5    TRP   HB3    H   1.225     5.743     1.010     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5328    .   1   1   5    TRP   HD1    H   -0.471    7.569     2.209     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5329    .   1   1   5    TRP   HE1    H   0.115     9.675     3.576     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5330    .   1   1   5    TRP   HE3    H   4.269     6.349     3.595     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5331    .   1   1   5    TRP   HH2    H   4.540     10.027    5.727     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5332    .   1   1   5    TRP   HZ2    H   2.273     10.663    5.062     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5333    .   1   1   5    TRP   HZ3    H   5.522     7.917     5.011     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5334    .   1   1   5    TRP   N      N   -0.596    4.674     2.649     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5335    .   1   1   5    TRP   NE1    N   0.726     8.920     3.430     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   NE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5336    .   1   1   5    TRP   O      O   2.431     3.865     4.410     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5337    .   1   1   6    MET   C      C   0.827     3.529     7.013     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5338    .   1   1   6    MET   CA     C   0.949     4.948     6.439     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5339    .   1   1   6    MET   CB     C   0.026     5.887     7.199     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5340    .   1   1   6    MET   CE     C   1.860     6.763     10.836    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5341    .   1   1   6    MET   CG     C   0.301     5.987     8.682     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5342    .   1   1   6    MET   H      H   -0.230    5.387     4.761     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5343    .   1   1   6    MET   HA     H   1.947     5.354     6.452     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5344    .   1   1   6    MET   HB2    H   0.130     6.876     6.779     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5345    .   1   1   6    MET   HB3    H   -0.992    5.553     7.062     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5346    .   1   1   6    MET   HE1    H   1.706     5.767     11.225    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5347    .   1   1   6    MET   HE2    H   1.049     7.403     11.148    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5348    .   1   1   6    MET   HE3    H   2.792     7.156     11.214    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5349    .   1   1   6    MET   HG2    H   -0.482    6.586     9.116     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5350    .   1   1   6    MET   HG3    H   0.256     4.993     9.101     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5351    .   1   1   6    MET   N      N   0.597     4.950     5.051     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5352    .   1   1   6    MET   O      O   1.528     3.138     7.949     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5353    .   1   1   6    MET   SD     S   1.922     6.706     9.046     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   SD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5354    .   1   1   7    TRP   C      C   0.335     0.377     6.038     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5355    .   1   1   7    TRP   CA     C   -0.388    1.442     6.875     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5356    .   1   1   7    TRP   CB     C   -1.916    1.244     6.818     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5357    .   1   1   7    TRP   CD1    C   -2.272    2.929     8.733     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5358    .   1   1   7    TRP   CD2    C   -4.024    2.714     7.363     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5359    .   1   1   7    TRP   CE2    C   -4.338    3.669     8.347     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5360    .   1   1   7    TRP   CE3    C   -4.976    2.411     6.398     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5361    .   1   1   7    TRP   CG     C   -2.691    2.264     7.616     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5362    .   1   1   7    TRP   CH2    C   -6.480    3.999     7.423     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5363    .   1   1   7    TRP   CZ2    C   -5.565    4.320     8.387     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5364    .   1   1   7    TRP   CZ3    C   -6.196    3.053     6.436     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5365    .   1   1   7    TRP   H      H   -0.500    3.126     5.623     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5366    .   1   1   7    TRP   HA     H   -0.072    1.355     7.904     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5367    .   1   1   7    TRP   HB2    H   -2.235    1.328     5.790     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5368    .   1   1   7    TRP   HB3    H   -2.176    0.264     7.181     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5369    .   1   1   7    TRP   HD1    H   -1.299    2.804     9.186     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5370    .   1   1   7    TRP   HE1    H   -3.183    4.385     9.945     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5371    .   1   1   7    TRP   HE3    H   -4.767    1.675     5.637     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5372    .   1   1   7    TRP   HH2    H   -7.449    4.478     7.417     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5373    .   1   1   7    TRP   HZ2    H   -5.804    5.055     9.141     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5374    .   1   1   7    TRP   HZ3    H   -6.945    2.825     5.690     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5375    .   1   1   7    TRP   N      N   -0.058    2.772     6.424     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5376    .   1   1   7    TRP   NE1    N   -3.253    3.786     9.168     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   NE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5377    .   1   1   7    TRP   O      O   1.271     0.678     5.277     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5378    .   1   1   8    THR   C      C   -0.614    -2.702    4.771     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5379    .   1   1   8    THR   CA     C   0.518     -1.976    5.497     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5380    .   1   1   8    THR   CB     C   1.195     -2.939    6.513     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5381    .   1   1   8    THR   CG2    C   2.296     -2.230    7.295     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   CG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5382    .   1   1   8    THR   H      H   -0.829    -1.041    6.796     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5383    .   1   1   8    THR   HA     H   1.250     -1.589    4.801     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5384    .   1   1   8    THR   HB     H   1.621     -3.780    5.983     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5385    .   1   1   8    THR   HG1    H   -0.156    -2.623    7.869     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HG1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5386    .   1   1   8    THR   HG21   H   3.055     -1.855    6.623     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HG21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5387    .   1   1   8    THR   HG22   H   2.743     -2.920    7.995     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HG22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5388    .   1   1   8    THR   HG23   H   1.856     -1.405    7.835     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HG23   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5389    .   1   1   8    THR   N      N   -0.071    -0.855    6.200     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5390    .   1   1   8    THR   O      O   -1.782    -2.442    5.086     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5391    .   1   1   8    THR   OG1    O   0.220     -3.407    7.449     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   OG1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5392    .   1   1   9    CYS   C      C   -1.221    -5.739    3.059     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5393    .   1   1   9    CYS   CA     C   -1.456    -4.261    3.188     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5394    .   1   1   9    CYS   CB     C   -1.765    -3.628    1.853     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5395    .   1   1   9    CYS   H      H   0.569     -3.858    3.537     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5396    .   1   1   9    CYS   HA     H   -2.309    -4.125    3.837     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5397    .   1   1   9    CYS   HB2    H   -2.585    -4.156    1.389     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5398    .   1   1   9    CYS   HB3    H   -2.049    -2.598    2.011     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5399    .   1   1   9    CYS   N      N   -0.337    -3.599    3.833     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5400    .   1   1   9    CYS   O      O   -0.154    -6.235    3.429     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5401    .   1   1   9    CYS   SG     S   -0.381    -3.647    0.704     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5402    .   1   1   10   ASP   C      C   -2.791    -8.292    1.136     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5403    .   1   1   10   ASP   CA     C   -2.140    -7.891    2.431     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5404    .   1   1   10   ASP   CB     C   -2.908    -8.573    3.595     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5405    .   1   1   10   ASP   CG     C   -2.373    -8.256    4.974     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5406    .   1   1   10   ASP   H      H   -2.992    -6.002    2.158     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5407    .   1   1   10   ASP   HA     H   -1.107    -8.199    2.456     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5408    .   1   1   10   ASP   HB2    H   -3.938    -8.250    3.565     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5409    .   1   1   10   ASP   HB3    H   -2.879    -9.642    3.453     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5410    .   1   1   10   ASP   N      N   -2.200    -6.448    2.540     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5411    .   1   1   10   ASP   O      O   -3.113    -7.436    0.314     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5412    .   1   1   10   ASP   OD1    O   -1.333    -8.823    5.380     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   OD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5413    .   1   1   10   ASP   OD2    O   -3.002    -7.470    5.695     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   OD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5414    .   1   1   11   SER   C      C   -5.223    -9.815    0.023     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5415    .   1   1   11   SER   CA     C   -3.731    -10.043   -0.212    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5416    .   1   1   11   SER   CB     C   -3.431    -11.529   -0.433    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5417    .   1   1   11   SER   H      H   -2.641    -10.243   1.568     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5418    .   1   1   11   SER   HA     H   -3.420    -9.477    -1.075    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5419    .   1   1   11   SER   HB2    H   -4.065    -11.909   -1.219    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5420    .   1   1   11   SER   HB3    H   -2.395    -11.651   -0.712    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5421    .   1   1   11   SER   HG     H   -4.628    -12.477   0.816     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   HG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5422    .   1   1   11   SER   N      N   -3.001    -9.573    0.945     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5423    .   1   1   11   SER   O      O   -6.021    -9.673    -0.906    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5424    .   1   1   11   SER   OG     O   -3.676    -12.278   0.762     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   OG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5425    .   1   1   12   GLU   C      C   -7.257    -8.114    1.824     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5426    .   1   1   12   GLU   CA     C   -6.942    -9.599    1.703     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5427    .   1   1   12   GLU   CB     C   -7.151    -10.288   3.048     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5428    .   1   1   12   GLU   CD     C   -7.021    -12.613   2.040     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5429    .   1   1   12   GLU   CG     C   -6.547    -11.693   3.131     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5430    .   1   1   12   GLU   H      H   -4.862    -9.848    1.955     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5431    .   1   1   12   GLU   HA     H   -7.586    -10.054   0.966     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5432    .   1   1   12   GLU   HB2    H   -6.699    -9.679    3.817     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5433    .   1   1   12   GLU   HB3    H   -8.211    -10.363   3.241     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5434    .   1   1   12   GLU   HG2    H   -5.473    -11.614   3.060     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5435    .   1   1   12   GLU   HG3    H   -6.810    -12.125   4.085     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5436    .   1   1   12   GLU   N      N   -5.575    -9.760    1.291     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5437    .   1   1   12   GLU   O      O   -8.278    -7.634    1.338     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5438    .   1   1   12   GLU   OE1    O   -8.129    -13.165   2.156     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   OE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5439    .   1   1   12   GLU   OE2    O   -6.294    -12.811   1.042     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   OE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5440    .   1   1   13   ARG   C      C   -5.849    -5.270    1.482     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5441    .   1   1   13   ARG   CA     C   -6.520    -5.983    2.638     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5442    .   1   1   13   ARG   CB     C   -5.871    -5.553    3.937     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5443    .   1   1   13   ARG   CD     C   -6.144    -5.526    6.390     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5444    .   1   1   13   ARG   CG     C   -6.340    -6.337    5.148     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5445    .   1   1   13   ARG   CZ     C   -7.301    -3.516    7.264     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   CZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5446    .   1   1   13   ARG   H      H   -5.591    -7.798    2.898     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5447    .   1   1   13   ARG   HA     H   -7.569    -5.739    2.673     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5448    .   1   1   13   ARG   HB2    H   -4.804    -5.695    3.841     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5449    .   1   1   13   ARG   HB3    H   -6.062    -4.505    4.106     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5450    .   1   1   13   ARG   HD2    H   -6.445    -6.103    7.252     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5451    .   1   1   13   ARG   HD3    H   -5.106    -5.243    6.475     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5452    .   1   1   13   ARG   HE     H   -7.257    -4.174    5.354     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5453    .   1   1   13   ARG   HG2    H   -7.389    -6.567    5.035     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5454    .   1   1   13   ARG   HG3    H   -5.770    -7.251    5.223     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5455    .   1   1   13   ARG   HH11   H   -6.217    -4.448    8.731     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HH11   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5456    .   1   1   13   ARG   HH12   H   -7.086    -3.082    9.253     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HH12   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5457    .   1   1   13   ARG   HH21   H   -8.450    -2.354    6.070     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HH21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5458    .   1   1   13   ARG   HH22   H   -8.430    -1.887    7.718     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HH22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5459    .   1   1   13   ARG   N      N   -6.374    -7.393    2.477     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5460    .   1   1   13   ARG   NE     N   -6.950    -4.329    6.278     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   NE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5461    .   1   1   13   ARG   NH1    N   -6.838    -3.695    8.501     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   NH1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5462    .   1   1   13   ARG   NH2    N   -8.109    -2.512    7.002     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   NH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5463    .   1   1   13   ARG   O      O   -4.618    -5.295    1.374     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5464    .   1   1   14   LYS   C      C   -5.519    -2.607    -0.141    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5465    .   1   1   14   LYS   CA     C   -6.078    -3.963    -0.525    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5466    .   1   1   14   LYS   CB     C   -7.108    -3.806    -1.665    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5467    .   1   1   14   LYS   CD     C   -9.212    -2.674    -2.531    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5468    .   1   1   14   LYS   CE     C   -9.712    -3.941    -3.208    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5469    .   1   1   14   LYS   CG     C   -8.345    -2.975    -1.306    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5470    .   1   1   14   LYS   H      H   -7.596    -4.612    0.804     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5471    .   1   1   14   LYS   HA     H   -5.259    -4.571    -0.882    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5472    .   1   1   14   LYS   HB2    H   -6.623    -3.334    -2.507    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5473    .   1   1   14   LYS   HB3    H   -7.436    -4.790    -1.960    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5474    .   1   1   14   LYS   HD2    H   -10.066   -2.089    -2.222    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5475    .   1   1   14   LYS   HD3    H   -8.628    -2.105    -3.239    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5476    .   1   1   14   LYS   HE2    H   -8.862    -4.509    -3.551    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5477    .   1   1   14   LYS   HE3    H   -10.266   -4.526    -2.488    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5478    .   1   1   14   LYS   HG2    H   -8.935    -3.521    -0.586    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5479    .   1   1   14   LYS   HG3    H   -8.019    -2.042    -0.869    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5480    .   1   1   14   LYS   HZ1    H   -11.410   -3.088    -4.082    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5481    .   1   1   14   LYS   HZ2    H   -10.942   -4.540    -4.769    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5482    .   1   1   14   LYS   HZ3    H   -10.081   -3.140    -5.119    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5483    .   1   1   14   LYS   N      N   -6.630    -4.641    0.633     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5484    .   1   1   14   LYS   NZ     N   -10.583   -3.652    -4.367    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5485    .   1   1   14   LYS   O      O   -6.086    -1.900    0.680     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5486    .   1   1   15   CYS   C      C   -4.352    -0.007    -1.496    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5487    .   1   1   15   CYS   CA     C   -3.779    -1.001    -0.499    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5488    .   1   1   15   CYS   CB     C   -2.272    -1.149    -0.696    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5489    .   1   1   15   CYS   H      H   -3.989    -2.910    -1.320    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5490    .   1   1   15   CYS   HA     H   -3.986    -0.661    0.502     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5491    .   1   1   15   CYS   HB2    H   -1.922    -2.006    -0.141    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5492    .   1   1   15   CYS   HB3    H   -2.089    -1.318    -1.747    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5493    .   1   1   15   CYS   N      N   -4.414    -2.272    -0.712    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5494    .   1   1   15   CYS   O      O   -4.968    -0.408    -2.494    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5495    .   1   1   15   CYS   SG     S   -1.261    0.275     -0.185    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5496    .   1   1   16   CYS   C      C   -3.808    2.305     -3.347    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5497    .   1   1   16   CYS   CA     C   -4.667    2.284     -2.103    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5498    .   1   1   16   CYS   CB     C   -4.677    3.646     -1.413    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5499    .   1   1   16   CYS   H      H   -3.764    1.525     -0.372    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5500    .   1   1   16   CYS   HA     H   -5.676    2.033     -2.397    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5501    .   1   1   16   CYS   HB2    H   -3.675    3.886     -1.094    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5502    .   1   1   16   CYS   HB3    H   -5.008    4.389     -2.123    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5503    .   1   1   16   CYS   N      N   -4.207    1.259     -1.212    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5504    .   1   1   16   CYS   O      O   -2.580    2.144     -3.288    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5505    .   1   1   16   CYS   SG     S   -5.772    3.751     0.057     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5506    .   1   1   17   LYS   C      C   -3.078    3.788     -5.918    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5507    .   1   1   17   LYS   CA     C   -3.762    2.460     -5.711    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5508    .   1   1   17   LYS   CB     C   -4.710    2.073     -6.831    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5509    .   1   1   17   LYS   CD     C   -6.263    0.248     -7.676    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5510    .   1   1   17   LYS   CE     C   -5.580    0.080     -9.021    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5511    .   1   1   17   LYS   CG     C   -5.305    0.688     -6.593    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5512    .   1   1   17   LYS   H      H   -5.413    2.626     -4.449    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5513    .   1   1   17   LYS   HA     H   -2.989    1.710     -5.628    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5514    .   1   1   17   LYS   HB2    H   -5.507    2.798     -6.878    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5515    .   1   1   17   LYS   HB3    H   -4.176    2.060     -7.768    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5516    .   1   1   17   LYS   HD2    H   -6.702    -0.695    -7.387    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5517    .   1   1   17   LYS   HD3    H   -7.044    0.989     -7.768    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5518    .   1   1   17   LYS   HE2    H   -5.251    1.047     -9.373    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5519    .   1   1   17   LYS   HE3    H   -4.724    -0.568    -8.899    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5520    .   1   1   17   LYS   HG2    H   -4.500    -0.030    -6.541    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5521    .   1   1   17   LYS   HG3    H   -5.823    0.700     -5.644    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5522    .   1   1   17   LYS   HZ1    H   -6.704    -1.494    -9.761    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5523    .   1   1   17   LYS   HZ2    H   -6.092    -0.466    -10.976   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5524    .   1   1   17   LYS   HZ3    H   -7.396    0.009     -10.018   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5525    .   1   1   17   LYS   N      N   -4.444    2.467     -4.466    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5526    .   1   1   17   LYS   NZ     N   -6.494    -0.509    -10.020   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5527    .   1   1   17   LYS   O      O   -3.678    4.859     -5.731    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5528    .   1   1   18   GLY   C      C   0.126     4.586     -5.343    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5529    .   1   1   18   GLY   CA     C   -0.980    4.846     -6.337    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5530    .   1   1   18   GLY   H      H   -1.510    2.856     -6.670    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5531    .   1   1   18   GLY   HA2    H   -0.569    4.985     -7.325    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   HA2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5532    .   1   1   18   GLY   HA3    H   -1.524    5.728     -6.032    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   HA3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5533    .   1   1   18   GLY   N      N   -1.854    3.714     -6.336    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5534    .   1   1   18   GLY   O      O   1.147     5.275     -5.328    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5535    .   1   1   19   MET   C      C   1.263     1.683     -4.090    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5536    .   1   1   19   MET   CA     C   0.912     3.070     -3.614    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5537    .   1   1   19   MET   CB     C   0.448     2.958     -2.143    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5538    .   1   1   19   MET   CE     C   -1.165    6.540     -0.697    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5539    .   1   1   19   MET   CG     C   0.258     4.256     -1.385    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5540    .   1   1   19   MET   H      H   -0.992    3.184     -4.456    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5541    .   1   1   19   MET   HA     H   1.784     3.704     -3.676    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5542    .   1   1   19   MET   HB2    H   -0.497    2.439     -2.127    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5543    .   1   1   19   MET   HB3    H   1.172     2.357     -1.611    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5544    .   1   1   19   MET   HE1    H   -0.257    7.099     -0.872    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5545    .   1   1   19   MET   HE2    H   -1.169    6.173     0.320     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5546    .   1   1   19   MET   HE3    H   -2.018    7.184     -0.849    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5547    .   1   1   19   MET   HG2    H   0.272     4.019     -0.331    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5548    .   1   1   19   MET   HG3    H   1.112     4.882     -1.596    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5549    .   1   1   19   MET   N      N   -0.102    3.594     -4.499    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5550    .   1   1   19   MET   O      O   0.585     1.135     -4.974    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5551    .   1   1   19   MET   SD     S   -1.250    5.154     -1.833    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   SD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5552    .   1   1   20   VAL   C      C   2.254     -1.122    -2.689    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5553    .   1   1   20   VAL   CA     C   2.666     -0.246    -3.848    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5554    .   1   1   20   VAL   CB     C   4.204     -0.394    -4.042    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5555    .   1   1   20   VAL   CG1    C   4.564     -1.782    -4.563    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   CG1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5556    .   1   1   20   VAL   CG2    C   4.763     0.685     -4.943    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   CG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5557    .   1   1   20   VAL   H      H   2.789     1.616     -2.845    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5558    .   1   1   20   VAL   HA     H   2.152     -0.551    -4.746    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5559    .   1   1   20   VAL   HB     H   4.663     -0.307    -3.070    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5560    .   1   1   20   VAL   HG11   H   4.223     -2.528    -3.863    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG11   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5561    .   1   1   20   VAL   HG12   H   5.635     -1.858    -4.677    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG12   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5562    .   1   1   20   VAL   HG13   H   4.090     -1.942    -5.521    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG13   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5563    .   1   1   20   VAL   HG21   H   5.833     0.561     -5.028    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5564    .   1   1   20   VAL   HG22   H   4.543     1.657     -4.527    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5565    .   1   1   20   VAL   HG23   H   4.317     0.600     -5.922    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG23   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5566    .   1   1   20   VAL   N      N   2.281     1.108     -3.518    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5567    .   1   1   20   VAL   O      O   2.635     -0.856    -1.541    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5568    .   1   1   21   CYS   C      C   2.037     -4.080    -1.668    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5569    .   1   1   21   CYS   CA     C   0.998     -3.008    -1.931    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5570    .   1   1   21   CYS   CB     C   -0.344    -3.644    -2.302    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5571    .   1   1   21   CYS   H      H   1.172     -2.282    -3.890    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5572    .   1   1   21   CYS   HA     H   0.872     -2.421    -1.033    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5573    .   1   1   21   CYS   HB2    H   -1.026    -2.878    -2.635    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5574    .   1   1   21   CYS   HB3    H   -0.181    -4.347    -3.103    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5575    .   1   1   21   CYS   N      N   1.460     -2.126    -2.966    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5576    .   1   1   21   CYS   O      O   2.442     -4.816    -2.583    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5577    .   1   1   21   CYS   SG     S   -1.141    -4.546    -0.939    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5578    .   1   1   22   ARG   C      C   3.247     -5.285    1.509     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5579    .   1   1   22   ARG   CA     C   3.466     -5.077    0.031     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5580    .   1   1   22   ARG   CB     C   4.906     -4.566    -0.195    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5581    .   1   1   22   ARG   CD     C   5.584     -6.162    -2.071    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5582    .   1   1   22   ARG   CG     C   5.466     -4.701    -1.591    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5583    .   1   1   22   ARG   CZ     C   4.111     -8.183    -2.169    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   CZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5584    .   1   1   22   ARG   H      H   2.163     -3.477    0.213     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5585    .   1   1   22   ARG   HA     H   3.334     -6.009    -0.497    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5586    .   1   1   22   ARG   HB2    H   4.912     -3.510    0.034     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5587    .   1   1   22   ARG   HB3    H   5.600     -5.039    0.482     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5588    .   1   1   22   ARG   HD2    H   6.093     -6.175    -3.024    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5589    .   1   1   22   ARG   HD3    H   6.178     -6.702    -1.351    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5590    .   1   1   22   ARG   HE     H   3.522     -6.247    -2.400    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5591    .   1   1   22   ARG   HG2    H   4.872     -4.124    -2.279    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5592    .   1   1   22   ARG   HG3    H   6.459     -4.296    -1.481    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5593    .   1   1   22   ARG   HH11   H   6.074     -8.649    -1.792    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HH11   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5594    .   1   1   22   ARG   HH12   H   5.011     -9.983    -1.858    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HH12   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5595    .   1   1   22   ARG   HH21   H   2.097     -8.136    -2.513    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HH21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5596    .   1   1   22   ARG   HH22   H   2.750     -9.694    -2.319    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HH22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5597    .   1   1   22   ARG   N      N   2.501     -4.123    -0.449    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5598    .   1   1   22   ARG   NE     N   4.288     -6.850    -2.232    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   NE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5599    .   1   1   22   ARG   NH1    N   5.139     -8.986    -1.928    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   NH1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5600    .   1   1   22   ARG   NH2    N   2.908     -8.702    -2.341    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   NH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5601    .   1   1   22   ARG   O      O   2.143     -4.975    2.058     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5602    .   1   1   23   LEU   C      C   4.000     -4.630    4.335     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5603    .   1   1   23   LEU   CA     C   4.321     -5.962    3.624     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5604    .   1   1   23   LEU   CB     C   5.693     -6.510    4.064     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5605    .   1   1   23   LEU   CD1    C   4.913     -7.952    5.984     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5606    .   1   1   23   LEU   CD2    C   7.306     -7.246    5.835     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5607    .   1   1   23   LEU   CG     C   5.871     -6.849    5.551     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5608    .   1   1   23   LEU   H      H   5.101     -5.978    1.629     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5609    .   1   1   23   LEU   HA     H   3.550     -6.679    3.862     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5610    .   1   1   23   LEU   HB2    H   5.881     -7.413    3.503     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5611    .   1   1   23   LEU   HB3    H   6.447     -5.785    3.794     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5612    .   1   1   23   LEU   HD11   H   5.093     -8.839    5.394     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD11   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5613    .   1   1   23   LEU   HD12   H   3.894     -7.623    5.844     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD12   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5614    .   1   1   23   LEU   HD13   H   5.076     -8.177    7.027     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD13   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5615    .   1   1   23   LEU   HD21   H   7.563     -8.118    5.251     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5616    .   1   1   23   LEU   HD22   H   7.416     -7.469    6.886     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5617    .   1   1   23   LEU   HD23   H   7.963     -6.432    5.570     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD23   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5618    .   1   1   23   LEU   HG     H   5.642     -5.970    6.132     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5619    .   1   1   23   LEU   N      N   4.306     -5.759    2.168     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5620    .   1   1   23   LEU   O      O   3.613     -4.601    5.499     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5621    .   1   1   24   TRP   C      C   3.273     -1.539    2.769     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5622    .   1   1   24   TRP   CA     C   3.776     -2.246    4.027     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5623    .   1   1   24   TRP   CB     C   4.951     -1.466    4.665     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5624    .   1   1   24   TRP   CD1    C   6.012     0.404     3.301     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5625    .   1   1   24   TRP   CD2    C   6.977     -1.583    2.971     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5626    .   1   1   24   TRP   CE2    C   7.632     -0.626    2.168     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5627    .   1   1   24   TRP   CE3    C   7.411     -2.906    2.929     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5628    .   1   1   24   TRP   CG     C   5.941     -0.893    3.687     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5629    .   1   1   24   TRP   CH2    C   9.099     -2.258    1.319     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5630    .   1   1   24   TRP   CZ2    C   8.695     -0.954    1.339     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5631    .   1   1   24   TRP   CZ3    C   8.468     -3.230    2.103     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5632    .   1   1   24   TRP   H      H   4.556     -3.613    2.709     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5633    .   1   1   24   TRP   HA     H   2.972     -2.373    4.734     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5634    .   1   1   24   TRP   HB2    H   4.550     -0.643    5.239     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5635    .   1   1   24   TRP   HB3    H   5.479     -2.129    5.333     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5636    .   1   1   24   TRP   HD1    H   5.335     1.156     3.682     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5637    .   1   1   24   TRP   HE1    H   7.273     1.428     1.963     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5638    .   1   1   24   TRP   HE3    H   6.936     -3.665    3.532     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5639    .   1   1   24   TRP   HH2    H   9.920     -2.557    0.685     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5640    .   1   1   24   TRP   HZ2    H   9.197     -0.220    0.726     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5641    .   1   1   24   TRP   HZ3    H   8.821     -4.249    2.053     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5642    .   1   1   24   TRP   N      N   4.172     -3.545    3.610     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5643    .   1   1   24   TRP   NE1    N   7.025     0.577     2.390     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   NE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5644    .   1   1   24   TRP   O      O   3.559     -2.010    1.659     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5645    .   1   1   25   CYS   C      C   3.165     1.297     1.448     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5646    .   1   1   25   CYS   CA     C   2.117     0.273     1.752     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5647    .   1   1   25   CYS   CB     C   0.760     0.929     1.929     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5648    .   1   1   25   CYS   H      H   2.224     -0.176    3.792     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5649    .   1   1   25   CYS   HA     H   2.074     -0.417    0.921     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5650    .   1   1   25   CYS   HB2    H   0.691     1.342     2.925     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5651    .   1   1   25   CYS   HB3    H   0.664     1.727     1.208     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5652    .   1   1   25   CYS   N      N   2.516     -0.490    2.909     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5653    .   1   1   25   CYS   O      O   3.450     2.174     2.267     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5654    .   1   1   25   CYS   SG     S   -0.647    -0.188    1.703     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5655    .   1   1   26   LYS   C      C   4.249     3.245     -0.817    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5656    .   1   1   26   LYS   CA     C   4.813     2.066     -0.083    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5657    .   1   1   26   LYS   CB     C   5.828     1.354     -0.981    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5658    .   1   1   26   LYS   CD     C   7.848     1.603     -2.465    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5659    .   1   1   26   LYS   CE     C   8.912     2.577     -2.940    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5660    .   1   1   26   LYS   CG     C   6.966     2.259     -1.430    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5661    .   1   1   26   LYS   H      H   3.421     0.507     -0.333    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5662    .   1   1   26   LYS   HA     H   5.314     2.400     0.812     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5663    .   1   1   26   LYS   HB2    H   6.243     0.508     -0.454    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5664    .   1   1   26   LYS   HB3    H   5.310     1.009     -1.861    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5665    .   1   1   26   LYS   HD2    H   8.325     0.738     -2.029    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5666    .   1   1   26   LYS   HD3    H   7.245     1.302     -3.310    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5667    .   1   1   26   LYS   HE2    H   8.419     3.446     -3.348    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5668    .   1   1   26   LYS   HE3    H   9.511     2.876     -2.093    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5669    .   1   1   26   LYS   HG2    H   6.548     3.160     -1.853    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5670    .   1   1   26   LYS   HG3    H   7.565     2.513     -0.570    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5671    .   1   1   26   LYS   HZ1    H   9.234     1.802     -4.838    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5672    .   1   1   26   LYS   HZ2    H   10.199    1.103     -3.652    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5673    .   1   1   26   LYS   HZ3    H   10.553    2.645     -4.217    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5674    .   1   1   26   LYS   N      N   3.749     1.185     0.297     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5675    .   1   1   26   LYS   NZ     N   9.779     1.997     -3.975    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5676    .   1   1   26   LYS   O      O   3.558     3.073     -1.828    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5677    .   1   1   27   LYS   C      C   4.921     5.786     -2.244    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5678    .   1   1   27   LYS   CA     C   4.109     5.642     -0.970    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5679    .   1   1   27   LYS   CB     C   4.324     6.872     -0.068    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5680    .   1   1   27   LYS   CD     C   5.946     8.332     1.244     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5681    .   1   1   27   LYS   CE     C   5.457     9.647     0.636     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5682    .   1   1   27   LYS   CG     C   5.779     7.130     0.315     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5683    .   1   1   27   LYS   H      H   4.979     4.471     0.558     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5684    .   1   1   27   LYS   HA     H   3.063     5.561     -1.222    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5685    .   1   1   27   LYS   HB2    H   3.954     7.740     -0.590    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5686    .   1   1   27   LYS   HB3    H   3.744     6.744     0.831     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5687    .   1   1   27   LYS   HD2    H   5.390     8.151     2.152     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5688    .   1   1   27   LYS   HD3    H   6.993     8.428     1.485     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5689    .   1   1   27   LYS   HE2    H   4.404     9.563     0.412     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5690    .   1   1   27   LYS   HE3    H   5.595     10.429    1.369     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5691    .   1   1   27   LYS   HG2    H   6.163     6.252     0.814     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5692    .   1   1   27   LYS   HG3    H   6.342     7.298     -0.590    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5693    .   1   1   27   LYS   HZ1    H   5.982     9.360     -1.382    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5694    .   1   1   27   LYS   HZ2    H   7.211     10.015    -0.448    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5695    .   1   1   27   LYS   HZ3    H   5.916     10.975    -0.909    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5696    .   1   1   27   LYS   N      N   4.506     4.427     -0.302    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5697    .   1   1   27   LYS   NZ     N   6.183     10.018    -0.602    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5698    .   1   1   27   LYS   O      O   6.084     5.340     -2.294    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5699    .   1   1   28   LYS   C      C   5.093     5.279     -5.294    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5700    .   1   1   28   LYS   CA     C   4.915     6.615     -4.551    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5701    .   1   1   28   LYS   CB     C   6.226     7.428     -4.416    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5702    .   1   1   28   LYS   CD     C   8.017     8.833     -5.393    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5703    .   1   1   28   LYS   CE     C   8.687     9.367     -6.644    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5704    .   1   1   28   LYS   CG     C   6.874     7.879     -5.706    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5705    .   1   1   28   LYS   H      H   3.398     6.709     -3.079    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5706    .   1   1   28   LYS   HA     H   4.196     7.192     -5.111    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5707    .   1   1   28   LYS   HB2    H   6.021     8.311     -3.830    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5708    .   1   1   28   LYS   HB3    H   6.938     6.822     -3.874    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5709    .   1   1   28   LYS   HD2    H   7.626     9.670     -4.832    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5710    .   1   1   28   LYS   HD3    H   8.748     8.315     -4.792    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5711    .   1   1   28   LYS   HE2    H   7.927     9.758     -7.301    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5712    .   1   1   28   LYS   HE3    H   9.353     10.169    -6.362    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5713    .   1   1   28   LYS   HG2    H   7.251     7.019     -6.240    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5714    .   1   1   28   LYS   HG3    H   6.138     8.395     -6.305    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5715    .   1   1   28   LYS   HZ1    H   10.231    7.985     -6.780    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5716    .   1   1   28   LYS   HZ2    H   9.836     8.741     -8.244    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5717    .   1   1   28   LYS   HZ3    H   8.857     7.525     -7.644    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5718    .   1   1   28   LYS   N      N   4.312     6.392     -3.242    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5719    .   1   1   28   LYS   NZ     N   9.448     8.339     -7.366    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5720    .   1   1   28   LYS   O      O   6.056     4.530     -5.065    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5721    .   1   1   29   LEU   C      C   5.306     3.402     -7.671    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5722    .   1   1   29   LEU   CA     C   4.007     3.754     -6.936    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5723    .   1   1   29   LEU   CB     C   2.840     3.881     -7.934    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5724    .   1   1   29   LEU   CD1    C   2.100     1.469     -7.946    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5725    .   1   1   29   LEU   CD2    C   1.425     2.994     -9.796    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5726    .   1   1   29   LEU   CG     C   2.516     2.655     -8.802    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5727    .   1   1   29   LEU   H      H   3.414     5.668     -6.279    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5728    .   1   1   29   LEU   HA     H   3.772     2.958     -6.246    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5729    .   1   1   29   LEU   HB2    H   1.952     4.131     -7.374    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5730    .   1   1   29   LEU   HB3    H   3.062     4.709     -8.593    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5731    .   1   1   29   LEU   HD11   H   1.230     1.731     -7.362    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD11   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5732    .   1   1   29   LEU   HD12   H   2.909     1.195     -7.288    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD12   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5733    .   1   1   29   LEU   HD13   H   1.861     0.633     -8.588    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD13   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5734    .   1   1   29   LEU   HD21   H   0.536     3.301     -9.264    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5735    .   1   1   29   LEU   HD22   H   1.203     2.126     -10.398   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5736    .   1   1   29   LEU   HD23   H   1.757     3.800     -10.433   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD23   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5737    .   1   1   29   LEU   HG     H   3.400     2.377     -9.355    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5738    .   1   1   29   LEU   N      N   4.117     4.996     -6.159    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5739    .   1   1   29   LEU   O      O   5.721     2.229     -7.702    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5740    .   1   1   30   TRP   C      C   7.848     5.548     -9.075    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5741    .   1   1   30   TRP   CA     C   7.188     4.199     -8.929    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5742    .   1   1   30   TRP   CB     C   6.959     3.545     -10.300   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5743    .   1   1   30   TRP   CD1    C   8.990     3.702     -11.870   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5744    .   1   1   30   TRP   CD2    C   8.786     1.739     -10.831   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5745    .   1   1   30   TRP   CE2    C   9.914     1.686     -11.668   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5746    .   1   1   30   TRP   CE3    C   8.461     0.615     -10.074   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5747    .   1   1   30   TRP   CG     C   8.206     3.039     -10.977   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5748    .   1   1   30   TRP   CH2    C   10.368    -0.528    -11.016   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5749    .   1   1   30   TRP   CZ2    C   10.712    0.552     -11.767   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5750    .   1   1   30   TRP   CZ3    C   9.257     -0.505    -10.174   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5751    .   1   1   30   TRP   H      H   5.572     5.302     -8.201    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5752    .   1   1   30   TRP   HA     H   7.814     3.561     -8.322    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5753    .   1   1   30   TRP   HB2    H   6.290     2.706     -10.181   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5754    .   1   1   30   TRP   HB3    H   6.497     4.271     -10.952   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5755    .   1   1   30   TRP   HD1    H   8.817     4.717     -12.195   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5756    .   1   1   30   TRP   HE1    H   10.702    3.163     -12.946   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5757    .   1   1   30   TRP   HE3    H   7.605     0.619     -9.417    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5758    .   1   1   30   TRP   HH2    H   10.962    -1.429    -11.068   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5759    .   1   1   30   TRP   HZ2    H   11.579    0.508     -12.410   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5760    .   1   1   30   TRP   HZ3    H   9.024     -1.386    -9.596    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5761    .   1   1   30   TRP   N      N   5.939     4.391     -8.243    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5762    .   1   1   30   TRP   NE1    N   10.015    2.895     -12.293   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   NE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5763    .   1   1   30   TRP   O      O   7.605     6.245     -10.081   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   11   .   5764    .   1   1   30   TRP   OXT    O   8.579     5.955     -8.148    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   OXT    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5765    .   1   1   1    TYR   C      C   -10.050   1.195     2.306     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5766    .   1   1   1    TYR   CA     C   -11.224   1.925     2.899     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5767    .   1   1   1    TYR   CB     C   -10.891   2.284     4.360     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5768    .   1   1   1    TYR   CD1    C   -12.994   2.419     5.759     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5769    .   1   1   1    TYR   CD2    C   -11.910   4.452     5.165     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5770    .   1   1   1    TYR   CE1    C   -13.954   3.128     6.446     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5771    .   1   1   1    TYR   CE2    C   -12.869   5.168     5.849     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5772    .   1   1   1    TYR   CG     C   -11.955   3.065     5.105     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5773    .   1   1   1    TYR   CZ     C   -13.888   4.501     6.487     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5774    .   1   1   1    TYR   H1     H   -12.591   0.842     1.826     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   H1     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5775    .   1   1   1    TYR   H2     H   -13.244   1.520     3.220     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   H2     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5776    .   1   1   1    TYR   H3     H   -12.216   0.163     3.308     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   H3     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5777    .   1   1   1    TYR   HA     H   -11.412   2.826     2.337     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5778    .   1   1   1    TYR   HB2    H   -10.719   1.370     4.904     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5779    .   1   1   1    TYR   HB3    H   -9.980    2.864     4.372     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5780    .   1   1   1    TYR   HD1    H   -13.050   1.340     5.727     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5781    .   1   1   1    TYR   HD2    H   -11.110   4.978     4.664     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5782    .   1   1   1    TYR   HE1    H   -14.751   2.595     6.943     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5783    .   1   1   1    TYR   HE2    H   -12.813   6.246     5.878     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5784    .   1   1   1    TYR   HH     H   -14.999   4.786     8.024     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HH     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5785    .   1   1   1    TYR   N      N   -12.397   1.064     2.822     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5786    .   1   1   1    TYR   O      O   -9.979    -0.032    2.383     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5787    .   1   1   1    TYR   OH     O   -14.840   5.209     7.172     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   OH     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5788    .   1   1   2    CYS   C      C   -6.842    1.493     2.208     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5789    .   1   1   2    CYS   CA     C   -7.947    1.340     1.187     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5790    .   1   1   2    CYS   CB     C   -7.577    2.026     -0.124    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5791    .   1   1   2    CYS   H      H   -9.260    2.894     1.668     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5792    .   1   1   2    CYS   HA     H   -8.127    0.291     1.008     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5793    .   1   1   2    CYS   HB2    H   -6.614    1.659     -0.444    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5794    .   1   1   2    CYS   HB3    H   -8.316    1.779     -0.870    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5795    .   1   1   2    CYS   N      N   -9.148    1.919     1.726     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5796    .   1   1   2    CYS   O      O   -6.999    2.240     3.188     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5797    .   1   1   2    CYS   SG     S   -7.467    3.849     -0.013    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5798    .   1   1   3    GLN   C      C   -3.813    2.093     2.564     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5799    .   1   1   3    GLN   CA     C   -4.673    0.917     2.951     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5800    .   1   1   3    GLN   CB     C   -3.845    -0.353    3.005     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5801    .   1   1   3    GLN   CD     C   -5.270    -1.476    4.747     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5802    .   1   1   3    GLN   CG     C   -4.632    -1.591    3.383     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5803    .   1   1   3    GLN   H      H   -5.690    0.157     1.289     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5804    .   1   1   3    GLN   HA     H   -5.113    1.091     3.917     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5805    .   1   1   3    GLN   HB2    H   -3.377    -0.508    2.045     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5806    .   1   1   3    GLN   HB3    H   -3.065    -0.214    3.739     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5807    .   1   1   3    GLN   HE21   H   -3.652    -2.221    5.583     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HE21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5808    .   1   1   3    GLN   HE22   H   -4.963    -1.826    6.649     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HE22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5809    .   1   1   3    GLN   HG2    H   -5.412    -1.730    2.649     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5810    .   1   1   3    GLN   HG3    H   -3.971    -2.445    3.363     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5811    .   1   1   3    GLN   N      N   -5.763    0.793     2.034     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5812    .   1   1   3    GLN   NE2    N   -4.559    -1.873    5.757     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   NE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5813    .   1   1   3    GLN   O      O   -3.296    2.148     1.441     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5814    .   1   1   3    GLN   OE1    O   -6.407    -1.019    4.883     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   OE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5815    .   1   1   4    LYS   C      C   -1.413    3.911     3.286     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5816    .   1   1   4    LYS   CA     C   -2.894    4.233     3.226     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5817    .   1   1   4    LYS   CB     C   -3.199    5.361     4.226     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5818    .   1   1   4    LYS   CD     C   -4.658    7.241     4.972     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5819    .   1   1   4    LYS   CE     C   -5.979    7.978     4.805     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5820    .   1   1   4    LYS   CG     C   -4.565    6.003     4.087     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5821    .   1   1   4    LYS   H      H   -4.177    2.958     4.316     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5822    .   1   1   4    LYS   HA     H   -3.127    4.586     2.233     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5823    .   1   1   4    LYS   HB2    H   -3.130    4.960     5.226     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5824    .   1   1   4    LYS   HB3    H   -2.450    6.130     4.112     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5825    .   1   1   4    LYS   HD2    H   -4.564    6.941     6.003     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5826    .   1   1   4    LYS   HD3    H   -3.849    7.911     4.720     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5827    .   1   1   4    LYS   HE2    H   -5.947    8.893     5.373     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5828    .   1   1   4    LYS   HE3    H   -6.099    8.219     3.759     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5829    .   1   1   4    LYS   HG2    H   -4.718    6.287     3.058     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5830    .   1   1   4    LYS   HG3    H   -5.320    5.293     4.395     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5831    .   1   1   4    LYS   HZ1    H   -7.186    6.286     4.729     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5832    .   1   1   4    LYS   HZ2    H   -8.021    7.700     5.061     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5833    .   1   1   4    LYS   HZ3    H   -7.085    6.977     6.270     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5834    .   1   1   4    LYS   N      N   -3.702    3.054     3.467     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5835    .   1   1   4    LYS   NZ     N   -7.140    7.180     5.252     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5836    .   1   1   4    LYS   O      O   -1.017    2.813     3.657     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5837    .   1   1   5    TRP   C      C   1.395     4.529     4.368     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5838    .   1   1   5    TRP   CA     C   0.847     4.833     2.976     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5839    .   1   1   5    TRP   CB     C   1.422     6.177     2.475     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5840    .   1   1   5    TRP   CD1    C   1.882     7.820     4.415     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5841    .   1   1   5    TRP   CD2    C   -0.035    8.227     3.331     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5842    .   1   1   5    TRP   CE2    C   0.111     9.172     4.369     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5843    .   1   1   5    TRP   CE3    C   -1.170    8.296     2.516     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5844    .   1   1   5    TRP   CG     C   1.116     7.363     3.379     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5845    .   1   1   5    TRP   CH2    C   -1.928    10.201    3.799     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5846    .   1   1   5    TRP   CZ2    C   -0.833    10.163    4.610     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5847    .   1   1   5    TRP   CZ3    C   -2.103    9.282     2.761     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5848    .   1   1   5    TRP   H      H   -1.023    5.781     2.787     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5849    .   1   1   5    TRP   HA     H   1.141     4.054     2.288     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5850    .   1   1   5    TRP   HB2    H   2.494     6.091     2.392     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5851    .   1   1   5    TRP   HB3    H   1.012     6.388     1.499     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5852    .   1   1   5    TRP   HD1    H   2.819     7.374     4.714     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5853    .   1   1   5    TRP   HE1    H   1.644     9.400     5.780     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5854    .   1   1   5    TRP   HE3    H   -1.330    7.603     1.704     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5855    .   1   1   5    TRP   HH2    H   -2.684    10.958    3.954     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5856    .   1   1   5    TRP   HZ2    H   -0.722    10.887    5.404     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5857    .   1   1   5    TRP   HZ3    H   -2.986    9.353     2.144     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5858    .   1   1   5    TRP   N      N   -0.613    4.919     3.001     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5859    .   1   1   5    TRP   NE1    N   1.284     8.899     5.012     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   NE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5860    .   1   1   5    TRP   O      O   2.485     4.002     4.527     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5861    .   1   1   6    MET   C      C   0.557     3.319     7.223     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5862    .   1   1   6    MET   CA     C   0.958     4.712     6.745     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5863    .   1   1   6    MET   CB     C   0.260     5.804     7.555     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5864    .   1   1   6    MET   CE     C   0.741     8.556     9.154     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5865    .   1   1   6    MET   CG     C   0.542     5.771     9.038     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5866    .   1   1   6    MET   H      H   -0.239    5.305     5.123     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5867    .   1   1   6    MET   HA     H   2.027     4.832     6.846     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5868    .   1   1   6    MET   HB2    H   0.574     6.763     7.172     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5869    .   1   1   6    MET   HB3    H   -0.806    5.710     7.408     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5870    .   1   1   6    MET   HE1    H   0.509     8.599     8.101     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5871    .   1   1   6    MET   HE2    H   1.804     8.408     9.280     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5872    .   1   1   6    MET   HE3    H   0.451     9.484     9.626     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5873    .   1   1   6    MET   HG2    H   0.113     4.864     9.441     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5874    .   1   1   6    MET   HG3    H   1.613     5.742     9.156     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5875    .   1   1   6    MET   N      N   0.612     4.884     5.357     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5876    .   1   1   6    MET   O      O   1.012     2.835     8.254     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5877    .   1   1   6    MET   SD     S   -0.149    7.195     9.923     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   SD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5878    .   1   1   7    TRP   C      C   0.001     0.296     5.984     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5879    .   1   1   7    TRP   CA     C   -0.742    1.355     6.784     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5880    .   1   1   7    TRP   CB     C   -2.266    1.235     6.614     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5881    .   1   1   7    TRP   CD1    C   -2.625    2.513     8.821     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5882    .   1   1   7    TRP   CD2    C   -4.415    2.482     7.481     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5883    .   1   1   7    TRP   CE2    C   -4.735    3.203     8.644     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5884    .   1   1   7    TRP   CE3    C   -5.391    2.329     6.504     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5885    .   1   1   7    TRP   CG     C   -3.052    2.055     7.605     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5886    .   1   1   7    TRP   CH2    C   -6.922    3.597     7.868     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5887    .   1   1   7    TRP   CZ2    C   -5.984    3.764     8.847     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5888    .   1   1   7    TRP   CZ3    C   -6.635    2.885     6.705     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5889    .   1   1   7    TRP   H      H   -0.527    3.090     5.606     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5890    .   1   1   7    TRP   HA     H   -0.496    1.194     7.823     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5891    .   1   1   7    TRP   HB2    H   -2.535    1.568     5.623     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5892    .   1   1   7    TRP   HB3    H   -2.558    0.201     6.729     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5893    .   1   1   7    TRP   HD1    H   -1.632    2.357     9.218     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5894    .   1   1   7    TRP   HE1    H   -3.547    3.646     10.324    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5895    .   1   1   7    TRP   HE3    H   -5.185    1.775     5.604     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5896    .   1   1   7    TRP   HH2    H   -7.909    4.018     7.990     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5897    .   1   1   7    TRP   HZ2    H   -6.219    4.319     9.743     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5898    .   1   1   7    TRP   HZ3    H   -7.403    2.771     5.954     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5899    .   1   1   7    TRP   N      N   -0.268    2.677     6.454     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5900    .   1   1   7    TRP   NE1    N   -3.626    3.217     9.440     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   NE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5901    .   1   1   7    TRP   O      O   0.950     0.602     5.239     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5902    .   1   1   8    THR   C      C   -0.771    -2.902    4.783     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5903    .   1   1   8    THR   CA     C   0.271     -2.051    5.530     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5904    .   1   1   8    THR   CB     C   0.960     -2.897    6.639     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5905    .   1   1   8    THR   CG2    C   2.029     -2.081    7.377     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   CG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5906    .   1   1   8    THR   H      H   -1.178    -1.138    6.702     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5907    .   1   1   8    THR   HA     H   1.021     -1.655    4.859     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5908    .   1   1   8    THR   HB     H   1.427     -3.759    6.186     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5909    .   1   1   8    THR   HG1    H   0.445     -3.946    8.192     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HG1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5910    .   1   1   8    THR   HG21   H   2.502     -2.699    8.126     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HG21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5911    .   1   1   8    THR   HG22   H   1.560     -1.234    7.858     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HG22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5912    .   1   1   8    THR   HG23   H   2.772     -1.720    6.682     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HG23   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5913    .   1   1   8    THR   N      N   -0.395    -0.933    6.149     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5914    .   1   1   8    THR   O      O   -1.981    -2.742    5.045     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5915    .   1   1   8    THR   OG1    O   -0.019    -3.333    7.606     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   OG1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5916    .   1   1   9    CYS   C      C   -0.983    -6.059    3.215     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5917    .   1   1   9    CYS   CA     C   -1.363    -4.597    3.189     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5918    .   1   1   9    CYS   CB     C   -1.594    -4.129    1.761     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5919    .   1   1   9    CYS   H      H   0.577     -3.947    3.596     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5920    .   1   1   9    CYS   HA     H   -2.282    -4.482    3.745     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5921    .   1   1   9    CYS   HB2    H   -2.402    -4.700    1.327     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5922    .   1   1   9    CYS   HB3    H   -1.864    -3.083    1.772     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5923    .   1   1   9    CYS   N      N   -0.361    -3.790    3.861     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5924    .   1   1   9    CYS   O      O   0.112     -6.424    3.678     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5925    .   1   1   9    CYS   SG     S   -0.157    -4.314    0.691     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5926    .   1   1   10   ASP   C      C   -2.342    -8.884    1.494     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5927    .   1   1   10   ASP   CA     C   -1.691    -8.339    2.736     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5928    .   1   1   10   ASP   CB     C   -2.374    -8.967    3.969     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5929    .   1   1   10   ASP   CG     C   -1.871    -8.458    5.294     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5930    .   1   1   10   ASP   H      H   -2.674    -6.551    2.272     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5931    .   1   1   10   ASP   HA     H   -0.637    -8.567    2.740     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5932    .   1   1   10   ASP   HB2    H   -3.424    -8.736    3.909     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5933    .   1   1   10   ASP   HB3    H   -2.247    -10.039   3.938     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5934    .   1   1   10   ASP   N      N   -1.872    -6.897    2.720     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5935    .   1   1   10   ASP   O      O   -2.529    -8.144    0.525     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5936    .   1   1   10   ASP   OD1    O   -2.515    -7.577    5.881     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   OD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5937    .   1   1   10   ASP   OD2    O   -0.822    -8.932    5.781     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   OD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5938    .   1   1   11   SER   C      C   -4.736    -10.164   0.151     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5939    .   1   1   11   SER   CA     C   -3.341    -10.770   0.386     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5940    .   1   1   11   SER   CB     C   -3.424    -12.279   0.607     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5941    .   1   1   11   SER   H      H   -2.474    -10.714   2.276     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5942    .   1   1   11   SER   HA     H   -2.737    -10.580   -0.486    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5943    .   1   1   11   SER   HB2    H   -4.073    -12.490   1.443     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5944    .   1   1   11   SER   HB3    H   -3.821    -12.745   -0.281    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5945    .   1   1   11   SER   HG     H   -2.237    -13.792   0.833     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   HG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5946    .   1   1   11   SER   N      N   -2.687    -10.149   1.506     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5947    .   1   1   11   SER   O      O   -5.120    -9.885    -0.990    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5948    .   1   1   11   SER   OG     O   -2.136    -12.832   0.870     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   OG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5949    .   1   1   12   GLU   C      C   -6.795    -7.847    1.097     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5950    .   1   1   12   GLU   CA     C   -6.809    -9.373    1.074     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5951    .   1   1   12   GLU   CB     C   -7.784    -9.932    2.107     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5952    .   1   1   12   GLU   CD     C   -8.532    -11.907   0.712     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5953    .   1   1   12   GLU   CG     C   -7.969    -11.438   2.033     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5954    .   1   1   12   GLU   H      H   -5.131    -10.156   2.109     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5955    .   1   1   12   GLU   HA     H   -7.153    -9.665    0.092     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5956    .   1   1   12   GLU   HB2    H   -7.446    -9.681    3.100     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5957    .   1   1   12   GLU   HB3    H   -8.748    -9.471    1.950     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5958    .   1   1   12   GLU   HG2    H   -7.006    -11.907   2.169     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5959    .   1   1   12   GLU   HG3    H   -8.633    -11.745   2.826     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5960    .   1   1   12   GLU   N      N   -5.480    -9.933    1.219     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5961    .   1   1   12   GLU   O      O   -7.314    -7.216    0.174     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5962    .   1   1   12   GLU   OE1    O   -9.724    -11.688   0.454     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   OE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5963    .   1   1   12   GLU   OE2    O   -7.798    -12.534   -0.082    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   OE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5964    .   1   1   13   ARG   C      C   -5.371    -5.153    1.113     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5965    .   1   1   13   ARG   CA     C   -6.162    -5.784    2.259     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5966    .   1   1   13   ARG   CB     C   -5.584    -5.332    3.612     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5967    .   1   1   13   ARG   CD     C   -5.872    -5.121    6.109     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5968    .   1   1   13   ARG   CG     C   -6.435    -5.707    4.819     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5969    .   1   1   13   ARG   CZ     C   -3.700    -5.031    7.350     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   CZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5970    .   1   1   13   ARG   H      H   -5.814    -7.812    2.841     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5971    .   1   1   13   ARG   HA     H   -7.180    -5.432    2.183     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5972    .   1   1   13   ARG   HB2    H   -4.609    -5.781    3.737     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5973    .   1   1   13   ARG   HB3    H   -5.471    -4.259    3.596     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5974    .   1   1   13   ARG   HD2    H   -5.874    -4.046    6.022     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5975    .   1   1   13   ARG   HD3    H   -6.512    -5.413    6.929     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5976    .   1   1   13   ARG   HE     H   -4.133    -6.293    5.845     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5977    .   1   1   13   ARG   HG2    H   -7.432    -5.319    4.672     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5978    .   1   1   13   ARG   HG3    H   -6.484    -6.780    4.909     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5979    .   1   1   13   ARG   HH11   H   -5.090    -3.745    8.109     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HH11   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5980    .   1   1   13   ARG   HH12   H   -3.563    -3.688    8.870     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HH12   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5981    .   1   1   13   ARG   HH21   H   -2.153    -6.224    6.896     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HH21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5982    .   1   1   13   ARG   HH22   H   -1.846    -5.137    8.198     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HH22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5983    .   1   1   13   ARG   N      N   -6.214    -7.252    2.139     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5984    .   1   1   13   ARG   NE     N   -4.493    -5.559    6.397     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   NE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5985    .   1   1   13   ARG   NH1    N   -4.150    -4.091    8.163     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   NH1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5986    .   1   1   13   ARG   NH2    N   -2.477    -5.480    7.501     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   NH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5987    .   1   1   13   ARG   O      O   -4.208    -5.494    0.893     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5988    .   1   1   14   LYS   C      C   -5.039    -2.146    -0.400    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5989    .   1   1   14   LYS   CA     C   -5.409    -3.589    -0.754    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5990    .   1   1   14   LYS   CB     C   -6.373    -3.599    -1.962    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5991    .   1   1   14   LYS   CD     C   -8.624    -2.871    -2.927    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5992    .   1   1   14   LYS   CE     C   -8.011    -2.098    -4.087    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5993    .   1   1   14   LYS   CG     C   -7.709    -2.889    -1.703    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5994    .   1   1   14   LYS   H      H   -6.935    -4.019    0.625     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5995    .   1   1   14   LYS   HA     H   -4.512    -4.128    -1.022    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5996    .   1   1   14   LYS   HB2    H   -5.884    -3.109    -2.791    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5997    .   1   1   14   LYS   HB3    H   -6.580    -4.623    -2.234    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5998    .   1   1   14   LYS   HD2    H   -8.801    -3.889    -3.245    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   5999    .   1   1   14   LYS   HD3    H   -9.563    -2.414    -2.655    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6000    .   1   1   14   LYS   HE2    H   -7.749    -1.106    -3.749    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6001    .   1   1   14   LYS   HE3    H   -7.118    -2.613    -4.410    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6002    .   1   1   14   LYS   HG2    H   -8.222    -3.390    -0.897    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6003    .   1   1   14   LYS   HG3    H   -7.501    -1.871    -1.407    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6004    .   1   1   14   LYS   HZ1    H   -8.474    -1.510    -6.039    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6005    .   1   1   14   LYS   HZ2    H   -9.761    -1.401    -4.990    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6006    .   1   1   14   LYS   HZ3    H   -9.277    -2.908    -5.565    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6007    .   1   1   14   LYS   N      N   -6.016    -4.260    0.387     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6008    .   1   1   14   LYS   NZ     N   -8.938    -1.982    -5.237    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6009    .   1   1   14   LYS   O      O   -5.753    -1.480    0.368     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6010    .   1   1   15   CYS   C      C   -4.276    0.630     -1.621    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6011    .   1   1   15   CYS   CA     C   -3.492    -0.314    -0.739    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6012    .   1   1   15   CYS   CB     C   -1.997    -0.175    -1.045    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6013    .   1   1   15   CYS   H      H   -3.417    -2.242    -1.548    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6014    .   1   1   15   CYS   HA     H   -3.674    -0.032    0.284     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6015    .   1   1   15   CYS   HB2    H   -1.838    -0.334    -2.100    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6016    .   1   1   15   CYS   HB3    H   -1.686    0.829     -0.793    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6017    .   1   1   15   CYS   N      N   -3.950    -1.676    -0.952    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6018    .   1   1   15   CYS   O      O   -4.997    0.198     -2.535    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6019    .   1   1   15   CYS   SG     S   -0.919    -1.331    -0.152    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6020    .   1   1   16   CYS   C      C   -4.222    2.982     -3.538    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6021    .   1   1   16   CYS   CA     C   -4.849    2.901     -2.131    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6022    .   1   1   16   CYS   CB     C   -4.783    4.247     -1.425    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6023    .   1   1   16   CYS   H      H   -3.691    2.151     -0.519    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6024    .   1   1   16   CYS   HA     H   -5.884    2.614     -2.241    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6025    .   1   1   16   CYS   HB2    H   -3.752    4.560     -1.350    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6026    .   1   1   16   CYS   HB3    H   -5.336    4.972     -2.005    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6027    .   1   1   16   CYS   N      N   -4.195    1.888     -1.326    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6028    .   1   1   16   CYS   O      O   -3.050    2.600     -3.739    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6029    .   1   1   16   CYS   SG     S   -5.488    4.228     0.262     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6030    .   1   1   17   LYS   C      C   -3.349    4.476     -5.969    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6031    .   1   1   17   LYS   CA     C   -4.580    3.579     -5.891    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6032    .   1   1   17   LYS   CB     C   -5.725    4.160     -6.739    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6033    .   1   1   17   LYS   CD     C   -4.967    3.241     -8.993    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6034    .   1   1   17   LYS   CE     C   -4.640    3.621     -10.430   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6035    .   1   1   17   LYS   CG     C   -5.372    4.473     -8.198    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6036    .   1   1   17   LYS   H      H   -5.938    3.687     -4.278    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6037    .   1   1   17   LYS   HA     H   -4.329    2.599     -6.266    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6038    .   1   1   17   LYS   HB2    H   -6.543    3.454     -6.741    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6039    .   1   1   17   LYS   HB3    H   -6.064    5.073     -6.271    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6040    .   1   1   17   LYS   HD2    H   -4.097    2.795     -8.536    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6041    .   1   1   17   LYS   HD3    H   -5.784    2.536     -8.991    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6042    .   1   1   17   LYS   HE2    H   -5.508    4.084     -10.876   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6043    .   1   1   17   LYS   HE3    H   -3.825    4.330     -10.420   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6044    .   1   1   17   LYS   HG2    H   -6.227    4.924     -8.679    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6045    .   1   1   17   LYS   HG3    H   -4.552    5.176     -8.204    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6046    .   1   1   17   LYS   HZ1    H   -4.110    2.741     -12.233   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6047    .   1   1   17   LYS   HZ2    H   -5.001    1.734     -11.238   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6048    .   1   1   17   LYS   HZ3    H   -3.372    2.023     -10.907   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6049    .   1   1   17   LYS   N      N   -5.016    3.432     -4.506    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6050    .   1   1   17   LYS   NZ     N   -4.255    2.459     -11.243   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6051    .   1   1   17   LYS   O      O   -3.390    5.650     -5.572    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6052    .   1   1   18   GLY   C      C   -0.051    4.216     -5.529    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6053    .   1   1   18   GLY   CA     C   -1.050    4.677     -6.556    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6054    .   1   1   18   GLY   H      H   -2.298    3.000     -6.783    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6055    .   1   1   18   GLY   HA2    H   -0.630    4.546     -7.541    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   HA2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6056    .   1   1   18   GLY   HA3    H   -1.261    5.724     -6.393    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   HA3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6057    .   1   1   18   GLY   N      N   -2.273    3.930     -6.466    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6058    .   1   1   18   GLY   O      O   0.920     4.915     -5.225    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6059    .   1   1   19   MET   C      C   0.848     1.035     -4.396    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6060    .   1   1   19   MET   CA     C   0.591     2.464     -3.994    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6061    .   1   1   19   MET   CB     C   -0.012    2.504     -2.583    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6062    .   1   1   19   MET   CE     C   -1.330    5.717     -0.318    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6063    .   1   1   19   MET   CG     C   -0.217    3.902     -2.049    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6064    .   1   1   19   MET   H      H   -1.151    2.597     -5.133    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6065    .   1   1   19   MET   HA     H   1.520     3.013     -3.999    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6066    .   1   1   19   MET   HB2    H   -0.972    2.009     -2.603    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6067    .   1   1   19   MET   HB3    H   0.643     1.973     -1.907    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6068    .   1   1   19   MET   HE1    H   -0.369    6.208     -0.283    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6069    .   1   1   19   MET   HE2    H   -1.875    5.919     0.593     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6070    .   1   1   19   MET   HE3    H   -1.895    6.088     -1.161    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6071    .   1   1   19   MET   HG2    H   0.769     4.307     -1.876    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6072    .   1   1   19   MET   HG3    H   -0.743    4.495     -2.781    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6073    .   1   1   19   MET   N      N   -0.310    3.069     -4.949    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6074    .   1   1   19   MET   O      O   0.057     0.449     -5.140    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6075    .   1   1   19   MET   SD     S   -1.101    3.951     -0.486    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   SD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6076    .   1   1   20   VAL   C      C   1.999     -1.697    -2.938    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6077    .   1   1   20   VAL   CA     C   2.238     -0.901    -4.196    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6078    .   1   1   20   VAL   CB     C   3.700     -1.132    -4.707    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6079    .   1   1   20   VAL   CG1    C   3.952     -0.380    -5.996    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   CG1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6080    .   1   1   20   VAL   CG2    C   4.731     -0.745    -3.663    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   CG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6081    .   1   1   20   VAL   H      H   2.538     1.006     -3.353    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6082    .   1   1   20   VAL   HA     H   1.540     -1.237    -4.948    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6083    .   1   1   20   VAL   HB     H   3.808     -2.186    -4.919    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6084    .   1   1   20   VAL   HG11   H   3.246     -0.698    -6.747    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG11   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6085    .   1   1   20   VAL   HG12   H   4.957     -0.582    -6.336    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG12   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6086    .   1   1   20   VAL   HG13   H   3.840     0.678     -5.816    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG13   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6087    .   1   1   20   VAL   HG21   H   4.624     0.306     -3.433    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6088    .   1   1   20   VAL   HG22   H   5.724     -0.934    -4.046    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6089    .   1   1   20   VAL   HG23   H   4.571     -1.326    -2.767    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG23   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6090    .   1   1   20   VAL   N      N   1.931     0.478     -3.927    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6091    .   1   1   20   VAL   O      O   2.232     -1.203    -1.819    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6092    .   1   1   21   CYS   C      C   2.408     -4.557    -1.613    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6093    .   1   1   21   CYS   CA     C   1.187     -3.718    -1.992    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6094    .   1   1   21   CYS   CB     C   -0.034    -4.600    -2.323    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6095    .   1   1   21   CYS   H      H   1.373     -3.217    -4.015    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6096    .   1   1   21   CYS   HA     H   0.941     -3.074    -1.161    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6097    .   1   1   21   CYS   HB2    H   -0.794    -3.988    -2.786    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6098    .   1   1   21   CYS   HB3    H   0.271     -5.369    -3.018    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6099    .   1   1   21   CYS   N      N   1.512     -2.883    -3.104    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6100    .   1   1   21   CYS   O      O   3.155     -5.039    -2.497    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6101    .   1   1   21   CYS   SG     S   -0.801    -5.424    -0.878    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6102    .   1   1   22   ARG   C      C   3.400     -5.433    1.786     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6103    .   1   1   22   ARG   CA     C   3.704     -5.392    0.274     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6104    .   1   1   22   ARG   CB     C   5.020     -4.636    -0.014    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6105    .   1   1   22   ARG   CD     C   7.488     -4.690    -0.241    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6106    .   1   1   22   ARG   CG     C   6.289     -5.417    0.278     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6107    .   1   1   22   ARG   CZ     C   9.966     -4.978    -0.306    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   CZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6108    .   1   1   22   ARG   H      H   1.990     -4.264    0.307     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6109    .   1   1   22   ARG   HA     H   3.758     -6.389    -0.137    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6110    .   1   1   22   ARG   HB2    H   5.030     -4.351    -1.056    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6111    .   1   1   22   ARG   HB3    H   5.030     -3.737    0.585     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6112    .   1   1   22   ARG   HD2    H   7.374     -4.648    -1.314    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6113    .   1   1   22   ARG   HD3    H   7.475     -3.695    0.176     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6114    .   1   1   22   ARG   HE     H   8.641     -6.163    0.664     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6115    .   1   1   22   ARG   HG2    H   6.401     -5.531    1.347     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6116    .   1   1   22   ARG   HG3    H   6.229     -6.387    -0.193    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6117    .   1   1   22   ARG   HH11   H   9.322     -3.430    -1.488    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HH11   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6118    .   1   1   22   ARG   HH12   H   11.011    -3.616    -1.441    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HH12   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6119    .   1   1   22   ARG   HH21   H   10.981    -6.453    0.697     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HH21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6120    .   1   1   22   ARG   HH22   H   11.965    -5.380    -0.174    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HH22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6121    .   1   1   22   ARG   N      N   2.623     -4.678    -0.322    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6122    .   1   1   22   ARG   NE     N   8.746     -5.368    0.092     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   NE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6123    .   1   1   22   ARG   NH1    N   10.110    -3.939    -1.134    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   NH1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6124    .   1   1   22   ARG   NH2    N   11.038    -5.648    0.100     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   NH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6125    .   1   1   22   ARG   O      O   2.270     -5.039    2.211     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6126    .   1   1   23   LEU   C      C   3.808     -4.553    4.591     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6127    .   1   1   23   LEU   CA     C   4.259     -5.904    4.058     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6128    .   1   1   23   LEU   CB     C   5.591     -6.301    4.703     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6129    .   1   1   23   LEU   CD1    C   7.424     -7.953    5.102     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6130    .   1   1   23   LEU   CD2    C   5.060     -8.746    4.942     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6131    .   1   1   23   LEU   CG     C   6.077     -7.727    4.440     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6132    .   1   1   23   LEU   H      H   5.147     -6.323    2.189     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6133    .   1   1   23   LEU   HA     H   3.515     -6.637    4.329     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6134    .   1   1   23   LEU   HB2    H   6.349     -5.623    4.338     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6135    .   1   1   23   LEU   HB3    H   5.505     -6.167    5.770     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6136    .   1   1   23   LEU   HD11   H   8.148     -7.263    4.692     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD11   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6137    .   1   1   23   LEU   HD12   H   7.750     -8.968    4.922     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD12   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6138    .   1   1   23   LEU   HD13   H   7.334     -7.789    6.165     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD13   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6139    .   1   1   23   LEU   HD21   H   5.434     -9.742    4.764     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6140    .   1   1   23   LEU   HD22   H   4.126     -8.621    4.413     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6141    .   1   1   23   LEU   HD23   H   4.899     -8.606    6.001     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD23   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6142    .   1   1   23   LEU   HG     H   6.201     -7.865    3.376     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6143    .   1   1   23   LEU   N      N   4.362     -5.901    2.596     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6144    .   1   1   23   LEU   O      O   3.237     -4.478    5.659     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6145    .   1   1   24   TRP   C      C   3.161     -1.570    2.795     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6146    .   1   1   24   TRP   CA     C   3.590     -2.198    4.131     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6147    .   1   1   24   TRP   CB     C   4.661     -1.345    4.836     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6148    .   1   1   24   TRP   CD1    C   5.834     0.354     3.370     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6149    .   1   1   24   TRP   CD2    C   6.943     -1.576    3.537     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6150    .   1   1   24   TRP   CE2    C   7.678     -0.712    2.705     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6151    .   1   1   24   TRP   CE3    C   7.443     -2.854    3.793     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6152    .   1   1   24   TRP   CG     C   5.766     -0.864    3.949     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6153    .   1   1   24   TRP   CH2    C   9.352     -2.342    2.392     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6154    .   1   1   24   TRP   CZ2    C   8.886     -1.084    2.126     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6155    .   1   1   24   TRP   CZ3    C   8.643     -3.225    3.218     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6156    .   1   1   24   TRP   H      H   4.598     -3.605    3.016     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6157    .   1   1   24   TRP   HA     H   2.736     -2.335    4.774     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6158    .   1   1   24   TRP   HB2    H   4.190     -0.476    5.268     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6159    .   1   1   24   TRP   HB3    H   5.100     -1.933    5.629     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6160    .   1   1   24   TRP   HD1    H   5.055     1.089     3.520     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6161    .   1   1   24   TRP   HE1    H   7.250     1.259     2.108     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6162    .   1   1   24   TRP   HE3    H   6.907     -3.541    4.430     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6163    .   1   1   24   TRP   HH2    H   10.285    -2.672    1.962     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6164    .   1   1   24   TRP   HZ2    H   9.448     -0.419    1.487     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6165    .   1   1   24   TRP   HZ3    H   9.047     -4.210    3.401     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6166    .   1   1   24   TRP   N      N   4.077     -3.506    3.839     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6167    .   1   1   24   TRP   NE1    N   6.980     0.462     2.620     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   NE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6168    .   1   1   24   TRP   O      O   3.593     -2.048    1.736     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6169    .   1   1   25   CYS   C      C   2.889     1.197     1.243     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6170    .   1   1   25   CYS   CA     C   1.915     0.101     1.591     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6171    .   1   1   25   CYS   CB     C   0.491     0.652     1.672     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6172    .   1   1   25   CYS   H      H   1.971     -0.211    3.671     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6173    .   1   1   25   CYS   HA     H   1.960     -0.644    0.808     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6174    .   1   1   25   CYS   HB2    H   0.400     1.265     2.558     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6175    .   1   1   25   CYS   HB3    H   0.298     1.260     0.801     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6176    .   1   1   25   CYS   N      N   2.320     -0.559    2.822     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6177    .   1   1   25   CYS   O      O   3.153     2.095     2.050     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6178    .   1   1   25   CYS   SG     S   -0.802    -0.625    1.756     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6179    .   1   1   26   LYS   C      C   3.871     2.828     -1.585    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6180    .   1   1   26   LYS   CA     C   4.408     2.079     -0.392    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6181    .   1   1   26   LYS   CB     C   5.710     1.352     -0.749    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6182    .   1   1   26   LYS   CD     C   8.094     1.540     -1.592    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6183    .   1   1   26   LYS   CE     C   7.913     0.508     -2.687    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6184    .   1   1   26   LYS   CG     C   6.790     2.268     -1.303    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6185    .   1   1   26   LYS   H      H   3.102     0.443     -0.567    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6186    .   1   1   26   LYS   HA     H   4.600     2.774     0.410     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6187    .   1   1   26   LYS   HB2    H   6.094     0.872     0.139     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6188    .   1   1   26   LYS   HB3    H   5.490     0.596     -1.488    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6189    .   1   1   26   LYS   HD2    H   8.838     2.259     -1.904    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6190    .   1   1   26   LYS   HD3    H   8.427     1.045     -0.691    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6191    .   1   1   26   LYS   HE2    H   7.230     -0.251    -2.336    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6192    .   1   1   26   LYS   HE3    H   7.487     0.998     -3.550    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6193    .   1   1   26   LYS   HG2    H   6.420     2.688     -2.227    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6194    .   1   1   26   LYS   HG3    H   6.947     3.065     -0.597    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6195    .   1   1   26   LYS   HZ1    H   9.869     0.549     -3.407    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6196    .   1   1   26   LYS   HZ2    H   8.989     -0.807    -3.850    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6197    .   1   1   26   LYS   HZ3    H   9.591     -0.687    -2.292    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6198    .   1   1   26   LYS   N      N   3.419     1.134     0.055     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6199    .   1   1   26   LYS   NZ     N   9.173     -0.142    -3.072    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6200    .   1   1   26   LYS   O      O   3.213     2.243     -2.415    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6201    .   1   1   27   LYS   C      C   4.382     4.569     -4.053    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6202    .   1   1   27   LYS   CA     C   3.659     4.920     -2.766    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6203    .   1   1   27   LYS   CB     C   3.839     6.399     -2.463    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6204    .   1   1   27   LYS   CD     C   3.440     8.317     -0.900    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6205    .   1   1   27   LYS   CE     C   2.760     8.770     0.376     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6206    .   1   1   27   LYS   CG     C   3.149     6.859     -1.189    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6207    .   1   1   27   LYS   H      H   4.725     4.512     -0.988    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6208    .   1   1   27   LYS   HA     H   2.606     4.716     -2.892    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6209    .   1   1   27   LYS   HB2    H   4.898     6.600     -2.396    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6210    .   1   1   27   LYS   HB3    H   3.438     6.965     -3.290    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6211    .   1   1   27   LYS   HD2    H   4.507     8.452     -0.797    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6212    .   1   1   27   LYS   HD3    H   3.079     8.914     -1.725    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6213    .   1   1   27   LYS   HE2    H   1.692     8.665     0.255     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6214    .   1   1   27   LYS   HE3    H   3.087     8.135     1.187     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6215    .   1   1   27   LYS   HG2    H   2.083     6.729     -1.302    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6216    .   1   1   27   LYS   HG3    H   3.500     6.257     -0.364    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6217    .   1   1   27   LYS   HZ1    H   4.088     10.309    0.864     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6218    .   1   1   27   LYS   HZ2    H   2.570     10.450    1.576     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6219    .   1   1   27   LYS   HZ3    H   2.753     10.804    -0.057    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6220    .   1   1   27   LYS   N      N   4.147     4.107     -1.669    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6221    .   1   1   27   LYS   NZ     N   3.069     10.174    0.707     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6222    .   1   1   27   LYS   O      O   5.599     4.364     -4.068    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6223    .   1   1   28   LYS   C      C   4.324     5.488     -7.149    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6224    .   1   1   28   LYS   CA     C   4.178     4.186     -6.397    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6225    .   1   1   28   LYS   CB     C   3.246     3.222     -7.155    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6226    .   1   1   28   LYS   CD     C   2.815     1.771     -9.167    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6227    .   1   1   28   LYS   CE     C   3.404     1.176     -10.441   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6228    .   1   1   28   LYS   CG     C   3.815     2.682     -8.462    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6229    .   1   1   28   LYS   H      H   2.681     4.692     -5.027    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6230    .   1   1   28   LYS   HA     H   5.149     3.731     -6.266    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6231    .   1   1   28   LYS   HB2    H   3.007     2.386     -6.515    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6232    .   1   1   28   LYS   HB3    H   2.330     3.748     -7.379    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6233    .   1   1   28   LYS   HD2    H   2.540     0.971     -8.497    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6234    .   1   1   28   LYS   HD3    H   1.935     2.346     -9.419    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6235    .   1   1   28   LYS   HE2    H   3.687     1.979     -11.104   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6236    .   1   1   28   LYS   HE3    H   4.283     0.604     -10.178   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6237    .   1   1   28   LYS   HG2    H   4.062     3.510     -9.109    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6238    .   1   1   28   LYS   HG3    H   4.710     2.120     -8.243    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6239    .   1   1   28   LYS   HZ1    H   2.886     -0.100    -12.003   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6240    .   1   1   28   LYS   HZ2    H   1.594     0.813     -11.422   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6241    .   1   1   28   LYS   HZ3    H   2.162     -0.506    -10.539   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6242    .   1   1   28   LYS   N      N   3.641     4.496     -5.109    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6243    .   1   1   28   LYS   NZ     N   2.449     0.291     -11.145   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6244    .   1   1   28   LYS   O      O   3.390     5.951     -7.790    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6245    .   1   1   29   LEU   C      C   6.715     7.241     -8.741    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6246    .   1   1   29   LEU   CA     C   5.703     7.403     -7.622    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6247    .   1   1   29   LEU   CB     C   6.179     8.490     -6.610    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6248    .   1   1   29   LEU   CD1    C   7.950     9.587     -5.201    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6249    .   1   1   29   LEU   CD2    C   7.550     7.167     -4.899    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6250    .   1   1   29   LEU   CG     C   7.558     8.308     -5.913    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6251    .   1   1   29   LEU   H      H   6.124     5.730     -6.386    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6252    .   1   1   29   LEU   HA     H   4.771     7.724     -8.062    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6253    .   1   1   29   LEU   HB2    H   6.208     9.433     -7.137    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6254    .   1   1   29   LEU   HB3    H   5.424     8.568     -5.840    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6255    .   1   1   29   LEU   HD11   H   8.013     10.394    -5.916    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD11   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6256    .   1   1   29   LEU   HD12   H   8.911     9.455     -4.725    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD12   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6257    .   1   1   29   LEU   HD13   H   7.208     9.827     -4.454    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD13   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6258    .   1   1   29   LEU   HD21   H   7.386     6.226     -5.402    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6259    .   1   1   29   LEU   HD22   H   6.761     7.330     -4.180    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6260    .   1   1   29   LEU   HD23   H   8.500     7.139     -4.386    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD23   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6261    .   1   1   29   LEU   HG     H   8.305     8.100     -6.665    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6262    .   1   1   29   LEU   N      N   5.450     6.123     -6.979    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6263    .   1   1   29   LEU   O      O   7.119     8.213     -9.385    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6264    .   1   1   30   TRP   C      C   7.371     5.433     -11.290   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6265    .   1   1   30   TRP   CA     C   8.068     5.697     -9.985    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6266    .   1   1   30   TRP   CB     C   8.884     4.470     -9.561    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6267    .   1   1   30   TRP   CD1    C   9.092     4.301     -7.025    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6268    .   1   1   30   TRP   CD2    C   10.880    5.170     -8.033    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6269    .   1   1   30   TRP   CE2    C   11.114    5.144     -6.648    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6270    .   1   1   30   TRP   CE3    C   11.869    5.672     -8.872    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6271    .   1   1   30   TRP   CG     C   9.576     4.633     -8.252    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6272    .   1   1   30   TRP   CH2    C   13.248    6.085     -6.931    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6273    .   1   1   30   TRP   CZ2    C   12.297    5.601     -6.085    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6274    .   1   1   30   TRP   CZ3    C   13.042    6.124     -8.313    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6275    .   1   1   30   TRP   H      H   6.655     5.285     -8.503    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6276    .   1   1   30   TRP   HA     H   8.731     6.543     -10.094   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6277    .   1   1   30   TRP   HB2    H   8.225     3.618     -9.477    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6278    .   1   1   30   TRP   HB3    H   9.631     4.269     -10.314   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6279    .   1   1   30   TRP   HD1    H   8.118     3.864     -6.850    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6280    .   1   1   30   TRP   HE1    H   9.890     4.478     -5.093    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6281    .   1   1   30   TRP   HE3    H   11.730    5.710     -9.942    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6282    .   1   1   30   TRP   HH2    H   14.186    6.452     -6.541    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6283    .   1   1   30   TRP   HZ2    H   12.477    5.578     -5.020    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6284    .   1   1   30   TRP   HZ3    H   13.820    6.516     -8.951    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6285    .   1   1   30   TRP   N      N   7.085     6.016     -8.989    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6286    .   1   1   30   TRP   NE1    N   10.008    4.617     -6.060    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   NE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6287    .   1   1   30   TRP   O      O   6.911     4.299     -11.508   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   12   .   6288    .   1   1   30   TRP   OXT    O   7.254     6.367     -12.113   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   OXT    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6289    .   1   1   1    TYR   C      C   -10.174   0.381     3.026     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6290    .   1   1   1    TYR   CA     C   -11.349   0.735     3.894     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6291    .   1   1   1    TYR   CB     C   -12.401   1.498     3.078     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6292    .   1   1   1    TYR   CD1    C   -13.743   2.993     4.609     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6293    .   1   1   1    TYR   CD2    C   -14.761   1.015     3.784     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6294    .   1   1   1    TYR   CE1    C   -14.890   3.303     5.295     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6295    .   1   1   1    TYR   CE2    C   -15.911   1.319     4.466     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6296    .   1   1   1    TYR   CG     C   -13.658   1.840     3.840     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6297    .   1   1   1    TYR   CZ     C   -15.973   2.460     5.220     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6298    .   1   1   1    TYR   H1     H   -10.444   2.420     4.709     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   H1     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6299    .   1   1   1    TYR   H2     H   -10.156   0.965     5.514     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   H2     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6300    .   1   1   1    TYR   H3     H   -11.638   1.714     5.710     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   H3     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6301    .   1   1   1    TYR   HA     H   -11.779   -0.178    4.279     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6302    .   1   1   1    TYR   HB2    H   -11.974   2.423     2.726     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6303    .   1   1   1    TYR   HB3    H   -12.681   0.898     2.225     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6304    .   1   1   1    TYR   HD1    H   -12.894   3.657     4.666     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6305    .   1   1   1    TYR   HD2    H   -14.715   0.115     3.190     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6306    .   1   1   1    TYR   HE1    H   -14.930   4.206     5.886     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6307    .   1   1   1    TYR   HE2    H   -16.760   0.657     4.404     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6308    .   1   1   1    TYR   HH     H   -17.300   3.701     5.798     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HH     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6309    .   1   1   1    TYR   N      N   -10.876   1.530     5.026     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6310    .   1   1   1    TYR   O      O   -9.690    -0.748    3.053     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6311    .   1   1   1    TYR   OH     O   -17.121   2.758     5.902     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   OH     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6312    .   1   1   2    CYS   C      C   -7.328    1.371     2.387     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6313    .   1   1   2    CYS   CA     C   -8.524    1.177     1.475     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6314    .   1   1   2    CYS   CB     C   -8.518    2.213     0.357     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6315    .   1   1   2    CYS   H      H   -10.108   2.238     2.301     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6316    .   1   1   2    CYS   HA     H   -8.522    0.178     1.064     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6317    .   1   1   2    CYS   HB2    H   -9.456    2.178     -0.173    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6318    .   1   1   2    CYS   HB3    H   -8.393    3.184     0.810     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6319    .   1   1   2    CYS   N      N   -9.692    1.349     2.291     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6320    .   1   1   2    CYS   O      O   -7.472    1.955     3.470     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6321    .   1   1   2    CYS   SG     S   -7.188    2.006     -0.863    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6322    .   1   1   3    GLN   C      C   -4.150    2.147     2.541     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6323    .   1   1   3    GLN   CA     C   -5.061    1.000     2.896     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6324    .   1   1   3    GLN   CB     C   -4.324    -0.315    3.075     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6325    .   1   1   3    GLN   CD     C   -4.640    -2.491    4.283     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6326    .   1   1   3    GLN   CG     C   -5.259    -1.466    3.396     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6327    .   1   1   3    GLN   H      H   -6.072    0.515     1.107     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6328    .   1   1   3    GLN   HA     H   -5.508    1.265     3.844     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6329    .   1   1   3    GLN   HB2    H   -3.782    -0.538    2.170     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6330    .   1   1   3    GLN   HB3    H   -3.619    -0.213    3.886     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6331    .   1   1   3    GLN   HE21   H   -5.453    -1.640    5.857     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HE21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6332    .   1   1   3    GLN   HE22   H   -4.468    -3.013    6.166     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HE22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6333    .   1   1   3    GLN   HG2    H   -6.154    -1.088    3.866     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6334    .   1   1   3    GLN   HG3    H   -5.518    -1.952    2.466     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6335    .   1   1   3    GLN   N      N   -6.177    0.897     2.003     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6336    .   1   1   3    GLN   NE2    N   -4.877    -2.372    5.549     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   NE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6337    .   1   1   3    GLN   O      O   -3.659    2.262     1.405     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6338    .   1   1   3    GLN   OE1    O   -4.015    -3.421    3.831     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   OE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6339    .   1   1   4    LYS   C      C   -1.709    3.914     3.474     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6340    .   1   1   4    LYS   CA     C   -3.195    4.215     3.409     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6341    .   1   1   4    LYS   CB     C   -3.593    5.159     4.542     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6342    .   1   1   4    LYS   CD     C   -5.446    6.326     5.779     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6343    .   1   1   4    LYS   CE     C   -6.949    6.506     5.894     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6344    .   1   1   4    LYS   CG     C   -5.091    5.430     4.610     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6345    .   1   1   4    LYS   H      H   -4.356    2.777     4.392     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6346    .   1   1   4    LYS   HA     H   -3.426    4.688     2.467     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6347    .   1   1   4    LYS   HB2    H   -3.284    4.721     5.480     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6348    .   1   1   4    LYS   HB3    H   -3.081    6.102     4.410     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6349    .   1   1   4    LYS   HD2    H   -5.077    5.878     6.690     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6350    .   1   1   4    LYS   HD3    H   -4.988    7.292     5.639     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6351    .   1   1   4    LYS   HE2    H   -7.326    6.923     4.973     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6352    .   1   1   4    LYS   HE3    H   -7.403    5.538     6.059     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6353    .   1   1   4    LYS   HG2    H   -5.404    5.911     3.695     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6354    .   1   1   4    LYS   HG3    H   -5.609    4.488     4.716     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6355    .   1   1   4    LYS   HZ1    H   -8.342    7.461     7.112     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6356    .   1   1   4    LYS   HZ2    H   -6.954    8.359     6.816     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6357    .   1   1   4    LYS   HZ3    H   -6.903    7.072     7.907     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6358    .   1   1   4    LYS   N      N   -3.961    2.998     3.524     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6359    .   1   1   4    LYS   NZ     N   -7.308    7.400     7.008     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6360    .   1   1   4    LYS   O      O   -1.318    2.858     3.951     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6361    .   1   1   5    TRP   C      C   1.190     4.368     4.334     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6362    .   1   1   5    TRP   CA     C   0.578     4.725     2.972     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6363    .   1   1   5    TRP   CB     C   1.231     6.027     2.445     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6364    .   1   1   5    TRP   CD1    C   0.242     7.918     3.900     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6365    .   1   1   5    TRP   CD2    C   2.445     7.633     4.132     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6366    .   1   1   5    TRP   CE2    C   2.039     8.678     4.980     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6367    .   1   1   5    TRP   CE3    C   3.793     7.270     4.106     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6368    .   1   1   5    TRP   CG     C   1.281     7.154     3.452     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6369    .   1   1   5    TRP   CH2    C   4.242     8.986     5.742     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6370    .   1   1   5    TRP   CZ2    C   2.931     9.363     5.791     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6371    .   1   1   5    TRP   CZ3    C   4.677     7.951     4.911     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6372    .   1   1   5    TRP   H      H   -1.293    5.729     2.774     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6373    .   1   1   5    TRP   HA     H   0.789     3.928     2.274     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6374    .   1   1   5    TRP   HB2    H   2.247     5.814     2.143     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6375    .   1   1   5    TRP   HB3    H   0.676     6.372     1.586     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6376    .   1   1   5    TRP   HD1    H   -0.781    7.807     3.579     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6377    .   1   1   5    TRP   HE1    H   0.124     9.488     5.292     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6378    .   1   1   5    TRP   HE3    H   4.144     6.472     3.469     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6379    .   1   1   5    TRP   HH2    H   4.973     9.492     6.354     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6380    .   1   1   5    TRP   HZ2    H   2.619     10.166    6.443     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6381    .   1   1   5    TRP   HZ3    H   5.724     7.685     4.903     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6382    .   1   1   5    TRP   N      N   -0.894    4.878     3.055     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6383    .   1   1   5    TRP   NE1    N   0.690     8.831     4.823     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   NE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6384    .   1   1   5    TRP   O      O   2.218     3.719     4.416     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6385    .   1   1   6    MET   C      C   0.705     3.170     7.216     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6386    .   1   1   6    MET   CA     C   1.004     4.588     6.736     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6387    .   1   1   6    MET   CB     C   0.360     5.628     7.653     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6388    .   1   1   6    MET   CE     C   0.979     8.259     9.392     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6389    .   1   1   6    MET   CG     C   0.750     5.512     9.110     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6390    .   1   1   6    MET   H      H   -0.310    5.272     5.236     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6391    .   1   1   6    MET   HA     H   2.070     4.750     6.732     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6392    .   1   1   6    MET   HB2    H   0.640     6.609     7.302     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6393    .   1   1   6    MET   HB3    H   -0.713    5.527     7.579     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6394    .   1   1   6    MET   HE1    H   2.045     8.094     9.449     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6395    .   1   1   6    MET   HE2    H   0.730     9.153     9.943     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6396    .   1   1   6    MET   HE3    H   0.685     8.384     8.360     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6397    .   1   1   6    MET   HG2    H   0.363     4.576     9.489     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6398    .   1   1   6    MET   HG3    H   1.827     5.496     9.150     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6399    .   1   1   6    MET   N      N   0.530     4.791     5.387     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6400    .   1   1   6    MET   O      O   1.258     2.696     8.215     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6401    .   1   1   6    MET   SD     S   0.115     6.860     10.119    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   SD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6402    .   1   1   7    TRP   C      C   0.277     0.140     6.084     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6403    .   1   1   7    TRP   CA     C   -0.553    1.166     6.850     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6404    .   1   1   7    TRP   CB     C   -2.059    0.965     6.571     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6405    .   1   1   7    TRP   CD1    C   -2.652    2.834     8.269     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6406    .   1   1   7    TRP   CD2    C   -4.400    2.009     7.154     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6407    .   1   1   7    TRP   CE2    C   -4.856    3.016     8.023     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6408    .   1   1   7    TRP   CE3    C   -5.324    1.347     6.356     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6409    .   1   1   7    TRP   CG     C   -2.983    1.911     7.312     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6410    .   1   1   7    TRP   CH2    C   -7.077    2.703     7.314     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6411    .   1   1   7    TRP   CZ2    C   -6.195    3.372     8.111     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6412    .   1   1   7    TRP   CZ3    C   -6.652    1.698     6.445     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6413    .   1   1   7    TRP   H      H   -0.457    2.898     5.661     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6414    .   1   1   7    TRP   HA     H   -0.373    1.044     7.906     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6415    .   1   1   7    TRP   HB2    H   -2.236    1.103     5.514     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6416    .   1   1   7    TRP   HB3    H   -2.332    -0.046    6.838     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6417    .   1   1   7    TRP   HD1    H   -1.645    3.005     8.623     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6418    .   1   1   7    TRP   HE1    H   -3.796    4.227     9.358     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6419    .   1   1   7    TRP   HE3    H   -5.011    0.564     5.683     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6420    .   1   1   7    TRP   HH2    H   -8.128    2.944     7.352     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6421    .   1   1   7    TRP   HZ2    H   -6.542    4.148     8.779     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6422    .   1   1   7    TRP   HZ3    H   -7.381    1.191     5.828     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6423    .   1   1   7    TRP   N      N   -0.134    2.498     6.495     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6424    .   1   1   7    TRP   NE1    N   -3.772    3.508     8.685     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   NE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6425    .   1   1   7    TRP   O      O   1.256     0.492     5.405     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6426    .   1   1   8    THR   C      C   -0.513    -3.048    4.928     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6427    .   1   1   8    THR   CA     C   0.578     -2.203    5.570     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6428    .   1   1   8    THR   CB     C   1.319     -3.037    6.641     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6429    .   1   1   8    THR   CG2    C   2.473     -2.256    7.246     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   CG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6430    .   1   1   8    THR   H      H   -0.838    -1.335    6.799     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6431    .   1   1   8    THR   HA     H   1.274     -1.814    4.844     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6432    .   1   1   8    THR   HB     H   1.694     -3.945    6.189     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6433    .   1   1   8    THR   HG1    H   0.010     -4.232    7.504     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HG1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6434    .   1   1   8    THR   HG21   H   3.171     -1.952    6.481     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HG21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6435    .   1   1   8    THR   HG22   H   2.984     -2.876    7.964     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HG22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6436    .   1   1   8    THR   HG23   H   2.080     -1.379    7.736     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HG23   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6437    .   1   1   8    THR   N      N   -0.080    -1.097    6.223     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6438    .   1   1   8    THR   O      O   -1.648    -2.975    5.401     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6439    .   1   1   8    THR   OG1    O   0.397     -3.371    7.702     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   OG1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6440    .   1   1   9    CYS   C      C   -1.099    -6.082    3.377     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6441    .   1   1   9    CYS   CA     C   -1.339    -4.598    3.321     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6442    .   1   1   9    CYS   CB     C   -1.663    -4.158    1.898     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6443    .   1   1   9    CYS   H      H   0.664     -3.963    3.496     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6444    .   1   1   9    CYS   HA     H   -2.210    -4.393    3.933     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6445    .   1   1   9    CYS   HB2    H   -2.540    -4.692    1.566     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6446    .   1   1   9    CYS   HB3    H   -1.881    -3.099    1.908     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6447    .   1   1   9    CYS   N      N   -0.234    -3.841    3.889     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6448    .   1   1   9    CYS   O      O   0.012     -6.538    3.700     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6449    .   1   1   9    CYS   SG     S   -0.362    -4.460    0.690     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6450    .   1   1   10   ASP   C      C   -2.753    -8.718    1.748     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6451    .   1   1   10   ASP   CA     C   -2.106    -8.266    3.052     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6452    .   1   1   10   ASP   CB     C   -2.833    -8.860    4.292     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6453    .   1   1   10   ASP   CG     C   -4.324    -8.558    4.372     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6454    .   1   1   10   ASP   H      H   -2.969    -6.391    2.787     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6455    .   1   1   10   ASP   HA     H   -1.069    -8.575    3.048     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6456    .   1   1   10   ASP   HB2    H   -2.715    -9.933    4.285     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6457    .   1   1   10   ASP   HB3    H   -2.359    -8.472    5.182     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6458    .   1   1   10   ASP   N      N   -2.131    -6.825    3.068     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6459    .   1   1   10   ASP   O      O   -2.812    -7.936    0.795     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6460    .   1   1   10   ASP   OD1    O   -5.122    -9.321    3.818     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   OD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6461    .   1   1   10   ASP   OD2    O   -4.718    -7.581    5.036     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   OD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6462    .   1   1   11   SER   C      C   -5.208    -9.874    0.254     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6463    .   1   1   11   SER   CA     C   -3.801    -10.442   0.456     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6464    .   1   1   11   SER   CB     C   -3.833    -11.969   0.495     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6465    .   1   1   11   SER   H      H   -3.158    -10.544   2.444     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6466    .   1   1   11   SER   HA     H   -3.182    -10.134   -0.373    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6467    .   1   1   11   SER   HB2    H   -4.367    -12.338   -0.369    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6468    .   1   1   11   SER   HB3    H   -2.824    -12.352   0.486     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6469    .   1   1   11   SER   HG     H   -5.443    -12.472   1.483     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   HG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6470    .   1   1   11   SER   N      N   -3.205    -9.943    1.670     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6471    .   1   1   11   SER   O      O   -5.572    -9.449    -0.850    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6472    .   1   1   11   SER   OG     O   -4.490    -12.436   1.676     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   OG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6473    .   1   1   12   GLU   C      C   -7.433    -7.904    1.255     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6474    .   1   1   12   GLU   CA     C   -7.333    -9.422    1.293     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6475    .   1   1   12   GLU   CB     C   -8.060    -9.978    2.527     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6476    .   1   1   12   GLU   CD     C   -8.085    -12.364   1.628     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6477    .   1   1   12   GLU   CG     C   -7.793    -11.465   2.806     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6478    .   1   1   12   GLU   H      H   -5.539    -9.962    2.215     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6479    .   1   1   12   GLU   HA     H   -7.778    -9.838    0.403     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6480    .   1   1   12   GLU   HB2    H   -7.752    -9.411    3.392     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6481    .   1   1   12   GLU   HB3    H   -9.122    -9.847    2.386     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6482    .   1   1   12   GLU   HG2    H   -6.752    -11.584   3.066     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6483    .   1   1   12   GLU   HG3    H   -8.404    -11.774   3.641     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6484    .   1   1   12   GLU   N      N   -5.951    -9.801    1.333     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6485    .   1   1   12   GLU   O      O   -8.201    -7.325    0.476     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6486    .   1   1   12   GLU   OE1    O   -7.133    -12.793   0.930     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   OE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6487    .   1   1   12   GLU   OE2    O   -9.273    -12.658   1.366     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   OE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6488    .   1   1   13   ARG   C      C   -5.413    -5.335    1.346     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6489    .   1   1   13   ARG   CA     C   -6.594    -5.818    2.119     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6490    .   1   1   13   ARG   CB     C   -6.495    -5.302    3.531     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6491    .   1   1   13   ARG   CD     C   -8.902    -4.671    3.929     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6492    .   1   1   13   ARG   CG     C   -7.706    -5.497    4.391     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6493    .   1   1   13   ARG   CZ     C   -10.414   -4.473    1.959     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   CZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6494    .   1   1   13   ARG   H      H   -6.076    -7.786    2.690     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6495    .   1   1   13   ARG   HA     H   -7.497    -5.432    1.669     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6496    .   1   1   13   ARG   HB2    H   -5.678    -5.818    4.011     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6497    .   1   1   13   ARG   HB3    H   -6.263    -4.247    3.498     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6498    .   1   1   13   ARG   HD2    H   -9.651    -4.694    4.703     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6499    .   1   1   13   ARG   HD3    H   -8.577    -3.650    3.787     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6500    .   1   1   13   ARG   HE     H   -9.228    -6.052    2.391     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6501    .   1   1   13   ARG   HG2    H   -7.962    -6.543    4.332     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6502    .   1   1   13   ARG   HG3    H   -7.430    -5.223    5.399     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6503    .   1   1   13   ARG   HH11   H   -10.499   -2.851    3.209     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HH11   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6504    .   1   1   13   ARG   HH12   H   -11.505   -2.746    1.846     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HH12   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6505    .   1   1   13   ARG   HH21   H   -10.639   -5.918    0.537     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HH21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6506    .   1   1   13   ARG   HH22   H   -11.579   -4.520    0.279     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HH22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6507    .   1   1   13   ARG   N      N   -6.653    -7.264    2.087     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6508    .   1   1   13   ARG   NE     N   -9.510    -5.154    2.681     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   NE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6509    .   1   1   13   ARG   NH1    N   -10.834   -3.280    2.365     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   NH1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6510    .   1   1   13   ARG   NH2    N   -10.915   -5.006    0.852     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   NH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6511    .   1   1   13   ARG   O      O   -4.286    -5.629    1.697     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6512    .   1   1   14   LYS   C      C   -4.480    -2.589    -0.352    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6513    .   1   1   14   LYS   CA     C   -4.635    -4.094    -0.561    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6514    .   1   1   14   LYS   CB     C   -4.959    -4.389    -2.015    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6515    .   1   1   14   LYS   CD     C   -5.496    -6.080    -3.766    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6516    .   1   1   14   LYS   CE     C   -5.541    -7.553    -4.123    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6517    .   1   1   14   LYS   CG     C   -5.019    -5.866    -2.346    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6518    .   1   1   14   LYS   H      H   -6.617    -4.424    0.105     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6519    .   1   1   14   LYS   HA     H   -3.706    -4.582    -0.304    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6520    .   1   1   14   LYS   HB2    H   -5.920    -3.955    -2.246    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6521    .   1   1   14   LYS   HB3    H   -4.205    -3.931    -2.637    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6522    .   1   1   14   LYS   HD2    H   -6.486    -5.666    -3.871    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6523    .   1   1   14   LYS   HD3    H   -4.821    -5.574    -4.442    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6524    .   1   1   14   LYS   HE2    H   -5.949    -7.654    -5.117    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6525    .   1   1   14   LYS   HE3    H   -4.533    -7.936    -4.111    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6526    .   1   1   14   LYS   HG2    H   -4.033    -6.293    -2.235    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6527    .   1   1   14   LYS   HG3    H   -5.703    -6.352    -1.666    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6528    .   1   1   14   LYS   HZ1    H   -5.971    -8.409    -2.234    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6529    .   1   1   14   LYS   HZ2    H   -6.503    -9.311    -3.530    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6530    .   1   1   14   LYS   HZ3    H   -7.332    -7.941    -3.096    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6531    .   1   1   14   LYS   N      N   -5.675    -4.629    0.295     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6532    .   1   1   14   LYS   NZ     N   -6.377    -8.338    -3.191    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6533    .   1   1   14   LYS   O      O   -5.422    -1.918    0.099     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6534    .   1   1   15   CYS   C      C   -3.734    0.113     -1.720    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6535    .   1   1   15   CYS   CA     C   -3.064    -0.632    -0.576    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6536    .   1   1   15   CYS   CB     C   -1.560    -0.339    -0.568    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6537    .   1   1   15   CYS   H      H   -2.604    -2.647    -1.010    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6538    .   1   1   15   CYS   HA     H   -3.498    -0.277    0.344     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6539    .   1   1   15   CYS   HB2    H   -1.138    -0.627    -1.519    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6540    .   1   1   15   CYS   HB3    H   -1.408    0.719     -0.421    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6541    .   1   1   15   CYS   N      N   -3.320    -2.064    -0.686    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6542    .   1   1   15   CYS   O      O   -4.075    -0.490    -2.758    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6543    .   1   1   15   CYS   SG     S   -0.633    -1.220    0.726     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6544    .   1   1   16   CYS   C      C   -3.770    2.394     -3.830    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6545    .   1   1   16   CYS   CA     C   -4.580    2.246     -2.529    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6546    .   1   1   16   CYS   CB     C   -4.859    3.617     -1.921    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6547    .   1   1   16   CYS   H      H   -3.669    1.787     -0.674    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6548    .   1   1   16   CYS   HA     H   -5.530    1.793     -2.772    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6549    .   1   1   16   CYS   HB2    H   -3.924    4.066     -1.620    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6550    .   1   1   16   CYS   HB3    H   -5.335    4.247     -2.659    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6551    .   1   1   16   CYS   N      N   -3.934    1.389     -1.534    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6552    .   1   1   16   CYS   O      O   -2.582    2.033     -3.904    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6553    .   1   1   16   CYS   SG     S   -5.940    3.553     -0.462    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6554    .   1   1   17   LYS   C      C   -2.786    4.266     -5.987    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6555    .   1   1   17   LYS   CA     C   -3.841    3.181     -6.138    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6556    .   1   1   17   LYS   CB     C   -4.929    3.611     -7.125    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6557    .   1   1   17   LYS   CD     C   -5.561    4.414     -9.421    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6558    .   1   1   17   LYS   CE     C   -6.476    3.251     -9.757    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6559    .   1   1   17   LYS   CG     C   -4.421    3.994     -8.511    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6560    .   1   1   17   LYS   H      H   -5.386    3.113     -4.728    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6561    .   1   1   17   LYS   HA     H   -3.370    2.278     -6.496    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6562    .   1   1   17   LYS   HB2    H   -5.623    2.792     -7.234    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6563    .   1   1   17   LYS   HB3    H   -5.456    4.457     -6.711    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6564    .   1   1   17   LYS   HD2    H   -6.139    5.180     -8.926    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6565    .   1   1   17   LYS   HD3    H   -5.146    4.813     -10.335   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6566    .   1   1   17   LYS   HE2    H   -5.913    2.508     -10.303   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6567    .   1   1   17   LYS   HE3    H   -6.848    2.812     -8.843    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6568    .   1   1   17   LYS   HG2    H   -3.727    4.815     -8.415    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6569    .   1   1   17   LYS   HG3    H   -3.917    3.144     -8.946    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6570    .   1   1   17   LYS   HZ1    H   -8.148    2.839     -10.893   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6571    .   1   1   17   LYS   HZ2    H   -7.292    4.185     -11.425   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6572    .   1   1   17   LYS   HZ3    H   -8.258    4.284     -10.029   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6573    .   1   1   17   LYS   N      N   -4.436    2.907     -4.848    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6574    .   1   1   17   LYS   NZ     N   -7.617    3.677     -10.579   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6575    .   1   1   17   LYS   O      O   -2.957    5.206     -5.201    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6576    .   1   1   18   GLY   C      C   0.371     4.497     -5.549    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6577    .   1   1   18   GLY   CA     C   -0.596    5.027     -6.569    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6578    .   1   1   18   GLY   H      H   -1.612    3.374     -7.341    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6579    .   1   1   18   GLY   HA2    H   -0.101    5.132     -7.524    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   HA2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6580    .   1   1   18   GLY   HA3    H   -0.960    5.989     -6.241    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   HA3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6581    .   1   1   18   GLY   N      N   -1.696    4.115     -6.701    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6582    .   1   1   18   GLY   O      O   1.423     5.088     -5.285    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6583    .   1   1   19   MET   C      C   0.866     1.263     -4.370    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6584    .   1   1   19   MET   CA     C   0.774     2.706     -3.973    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6585    .   1   1   19   MET   CB     C   0.120     2.825     -2.587    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6586    .   1   1   19   MET   CE     C   -0.994    6.215     -0.501    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6587    .   1   1   19   MET   CG     C   0.030     4.242     -2.088    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6588    .   1   1   19   MET   H      H   -0.876    2.993     -5.180    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6589    .   1   1   19   MET   HA     H   1.761     3.143     -3.939    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6590    .   1   1   19   MET   HB2    H   -0.881    2.421     -2.640    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6591    .   1   1   19   MET   HB3    H   0.695     2.247     -1.879    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6592    .   1   1   19   MET   HE1    H   -1.464    6.628     -1.380    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6593    .   1   1   19   MET   HE2    H   0.020     6.583     -0.435    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6594    .   1   1   19   MET   HE3    H   -1.545    6.509     0.377     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6595    .   1   1   19   MET   HG2    H   1.038     4.522     -1.819    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6596    .   1   1   19   MET   HG3    H   -0.345    4.885     -2.871    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6597    .   1   1   19   MET   N      N   -0.006    3.391     -4.953    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6598    .   1   1   19   MET   O      O   -0.005    0.749     -5.090    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6599    .   1   1   19   MET   SD     S   -0.975    4.431     -0.614    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   SD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6600    .   1   1   20   VAL   C      C   1.790     -1.537    -2.941    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6601    .   1   1   20   VAL   CA     C   2.076     -0.756    -4.206    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6602    .   1   1   20   VAL   CB     C   3.512     -1.053    -4.773    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6603    .   1   1   20   VAL   CG1    C   4.609     -0.593    -3.832    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   CG1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6604    .   1   1   20   VAL   CG2    C   3.683     -2.525    -5.113    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   CG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6605    .   1   1   20   VAL   H      H   2.535     1.093     -3.359    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6606    .   1   1   20   VAL   HA     H   1.340     -1.034    -4.946    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6607    .   1   1   20   VAL   HB     H   3.621     -0.486    -5.684    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6608    .   1   1   20   VAL   HG11   H   4.518     0.470     -3.661    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG11   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6609    .   1   1   20   VAL   HG12   H   5.573     -0.805    -4.272    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG12   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6610    .   1   1   20   VAL   HG13   H   4.518     -1.120    -2.893    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG13   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6611    .   1   1   20   VAL   HG21   H   2.962     -2.809    -5.865    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6612    .   1   1   20   VAL   HG22   H   3.519     -3.119    -4.225    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6613    .   1   1   20   VAL   HG23   H   4.682     -2.699    -5.485    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG23   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6614    .   1   1   20   VAL   N      N   1.884     0.621     -3.930    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6615    .   1   1   20   VAL   O      O   2.214     -1.139    -1.829    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6616    .   1   1   21   CYS   C      C   1.816     -4.297    -1.677    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6617    .   1   1   21   CYS   CA     C   0.642     -3.410    -1.995    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6618    .   1   1   21   CYS   CB     C   -0.599    -4.244    -2.347    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6619    .   1   1   21   CYS   H      H   0.655     -2.778    -3.980    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6620    .   1   1   21   CYS   HA     H   0.424     -2.785    -1.141    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6621    .   1   1   21   CYS   HB2    H   -1.370    -3.588    -2.723    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6622    .   1   1   21   CYS   HB3    H   -0.335    -4.954    -3.116    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6623    .   1   1   21   CYS   N      N   1.005     -2.568    -3.088    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6624    .   1   1   21   CYS   O      O   2.205     -5.146    -2.484    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6625    .   1   1   21   CYS   SG     S   -1.321    -5.179    -0.949    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6626    .   1   1   22   ARG   C      C   3.462     -5.030    1.382     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6627    .   1   1   22   ARG   CA     C   3.556     -4.777    -0.098    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6628    .   1   1   22   ARG   CB     C   4.826     -3.976    -0.379    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6629    .   1   1   22   ARG   CD     C   5.556     -5.291    -2.373    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6630    .   1   1   22   ARG   CG     C   5.248     -3.914    -1.808    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6631    .   1   1   22   ARG   CZ     C   7.238     -7.084    -1.949    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   CZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6632    .   1   1   22   ARG   H      H   2.065     -3.351    0.044     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6633    .   1   1   22   ARG   HA     H   3.620     -5.715    -0.625    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6634    .   1   1   22   ARG   HB2    H   4.658     -2.959    -0.056    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6635    .   1   1   22   ARG   HB3    H   5.654     -4.364    0.190     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6636    .   1   1   22   ARG   HD2    H   4.681     -5.919    -2.307    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6637    .   1   1   22   ARG   HD3    H   5.838     -5.185    -3.410    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6638    .   1   1   22   ARG   HE     H   7.021     -5.397    -0.893    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6639    .   1   1   22   ARG   HG2    H   4.491     -3.414    -2.388    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6640    .   1   1   22   ARG   HG3    H   6.164     -3.348    -1.760    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6641    .   1   1   22   ARG   HH11   H   5.967     -7.586    -3.485    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HH11   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6642    .   1   1   22   ARG   HH12   H   7.197     -8.715    -3.195    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HH12   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6643    .   1   1   22   ARG   HH21   H   8.631     -6.959    -0.466    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HH21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6644    .   1   1   22   ARG   HH22   H   8.746     -8.355    -1.428    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HH22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6645    .   1   1   22   ARG   N      N   2.414     -4.054    -0.547    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6646    .   1   1   22   ARG   NE     N   6.666     -5.920    -1.649    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   NE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6647    .   1   1   22   ARG   NH1    N   6.767     -7.844    -2.939    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   NH1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6648    .   1   1   22   ARG   NH2    N   8.265     -7.494    -1.235    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   NH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6649    .   1   1   22   ARG   O      O   2.346     -4.911    2.011     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6650    .   1   1   23   LEU   C      C   4.203     -4.413    4.115     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6651    .   1   1   23   LEU   CA     C   4.794     -5.594    3.378     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6652    .   1   1   23   LEU   CB     C   6.276     -5.768    3.741     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6653    .   1   1   23   LEU   CD1    C   5.997     -7.450    5.601     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6654    .   1   1   23   LEU   CD2    C   8.081     -6.070    5.464     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6655    .   1   1   23   LEU   CG     C   6.584     -6.101    5.208     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6656    .   1   1   23   LEU   H      H   5.416     -5.397    1.348     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6657    .   1   1   23   LEU   HA     H   4.244     -6.491    3.625     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6658    .   1   1   23   LEU   HB2    H   6.682     -6.557    3.126     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6659    .   1   1   23   LEU   HB3    H   6.788     -4.849    3.493     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6660    .   1   1   23   LEU   HD11   H   4.924     -7.427    5.484     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD11   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6661    .   1   1   23   LEU   HD12   H   6.241     -7.663    6.631     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD12   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6662    .   1   1   23   LEU   HD13   H   6.412     -8.222    4.967     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD13   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6663    .   1   1   23   LEU   HD21   H   8.273     -6.305    6.502     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6664    .   1   1   23   LEU   HD22   H   8.467     -5.087    5.241     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6665    .   1   1   23   LEU   HD23   H   8.570     -6.800    4.836     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD23   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6666    .   1   1   23   LEU   HG     H   6.119     -5.351    5.832     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6667    .   1   1   23   LEU   N      N   4.638     -5.351    1.950     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6668    .   1   1   23   LEU   O      O   3.509     -4.570    5.115     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6669    .   1   1   24   TRP   C      C   3.273     -1.337    2.781     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6670    .   1   1   24   TRP   CA     C   3.828     -2.047    4.010     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6671    .   1   1   24   TRP   CB     C   4.796     -1.142    4.802     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6672    .   1   1   24   TRP   CD1    C   5.868     0.643     3.333     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6673    .   1   1   24   TRP   CD2    C   7.238     -1.038    3.843     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6674    .   1   1   24   TRP   CE2    C   7.940     -0.120    3.035     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6675    .   1   1   24   TRP   CE3    C   7.895     -2.179    4.294     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6676    .   1   1   24   TRP   CG     C   5.914     -0.530    4.010     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6677    .   1   1   24   TRP   CH2    C   9.886     -1.443    3.134     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6678    .   1   1   24   TRP   CZ2    C   9.268     -0.313    2.672     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6679    .   1   1   24   TRP   CZ3    C   9.211     -2.368    3.935     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6680    .   1   1   24   TRP   H      H   5.052     -3.181    2.800     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6681    .   1   1   24   TRP   HA     H   3.016     -2.366    4.641     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6682    .   1   1   24   TRP   HB2    H   4.230     -0.328    5.223     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6683    .   1   1   24   TRP   HB3    H   5.231     -1.718    5.607     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6684    .   1   1   24   TRP   HD1    H   4.967     1.241     3.298     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6685    .   1   1   24   TRP   HE1    H   7.299     1.685     2.182     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6686    .   1   1   24   TRP   HE3    H   7.391     -2.904    4.914     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6687    .   1   1   24   TRP   HH2    H   10.918    -1.639    2.886     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6688    .   1   1   24   TRP   HZ2    H   9.805     0.393     2.055     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6689    .   1   1   24   TRP   HZ3    H   9.738     -3.248    4.276     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6690    .   1   1   24   TRP   N      N   4.446     -3.242    3.566     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6691    .   1   1   24   TRP   NE1    N   7.082     0.899     2.732     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   NE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6692    .   1   1   24   TRP   O      O   3.616     -1.715    1.652     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6693    .   1   1   25   CYS   C      C   2.952     1.376     1.404     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6694    .   1   1   25   CYS   CA     C   1.910     0.399     1.857     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6695    .   1   1   25   CYS   CB     C   0.598     1.094     2.185     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6696    .   1   1   25   CYS   H      H   2.104     -0.126    3.874     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6697    .   1   1   25   CYS   HA     H   1.747     -0.302    1.051     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6698    .   1   1   25   CYS   HB2    H   0.706     1.639     3.111     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6699    .   1   1   25   CYS   HB3    H   0.350     1.781     1.390     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6700    .   1   1   25   CYS   N      N   2.414     -0.366    2.972     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6701    .   1   1   25   CYS   O      O   3.358     2.282     2.145     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6702    .   1   1   25   CYS   SG     S   -0.794    -0.058    2.377     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6703    .   1   1   26   LYS   C      C   3.963     2.780     -1.456    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6704    .   1   1   26   LYS   CA     C   4.462     1.970     -0.301    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6705    .   1   1   26   LYS   CB     C   5.593     1.067     -0.767    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6706    .   1   1   26   LYS   CD     C   7.734     0.890     -2.031    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6707    .   1   1   26   LYS   CE     C   8.823     1.677     -2.718    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6708    .   1   1   26   LYS   CG     C   6.712     1.817     -1.437    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6709    .   1   1   26   LYS   H      H   2.999     0.496     -0.360    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6710    .   1   1   26   LYS   HA     H   4.836     2.609     0.482     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6711    .   1   1   26   LYS   HB2    H   5.997     0.544     0.088     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6712    .   1   1   26   LYS   HB3    H   5.199     0.345     -1.466    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6713    .   1   1   26   LYS   HD2    H   8.168     0.293     -1.243    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6714    .   1   1   26   LYS   HD3    H   7.252     0.248     -2.754    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6715    .   1   1   26   LYS   HE2    H   9.341     2.263     -1.975    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6716    .   1   1   26   LYS   HE3    H   9.520     0.983     -3.166    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6717    .   1   1   26   LYS   HG2    H   6.291     2.421     -2.227    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6718    .   1   1   26   LYS   HG3    H   7.181     2.459     -0.711    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6719    .   1   1   26   LYS   HZ1    H   7.777     2.075     -4.515    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6720    .   1   1   26   LYS   HZ2    H   9.081     3.085     -4.231    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6721    .   1   1   26   LYS   HZ3    H   7.659     3.315     -3.370    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6722    .   1   1   26   LYS   N      N   3.407     1.182     0.216     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6723    .   1   1   26   LYS   NZ     N   8.291     2.589     -3.772    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6724    .   1   1   26   LYS   O      O   3.330     2.232     -2.347    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6725    .   1   1   27   LYS   C      C   4.685     4.455     -3.773    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6726    .   1   1   27   LYS   CA     C   3.862     4.893     -2.572    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6727    .   1   1   27   LYS   CB     C   4.042     6.376     -2.279    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6728    .   1   1   27   LYS   CD     C   3.366     8.361     -0.763    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6729    .   1   1   27   LYS   CE     C   2.733     9.333     -1.786    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6730    .   1   1   27   LYS   CG     C   3.192     6.865     -1.103    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6731    .   1   1   27   LYS   H      H   4.644     4.467     -0.652    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6732    .   1   1   27   LYS   HA     H   2.827     4.689     -2.799    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6733    .   1   1   27   LYS   HB2    H   5.087     6.535     -2.085    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6734    .   1   1   27   LYS   HB3    H   3.767     6.931     -3.162    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6735    .   1   1   27   LYS   HD2    H   2.913     8.546     0.200     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6736    .   1   1   27   LYS   HD3    H   4.424     8.568     -0.692    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6737    .   1   1   27   LYS   HE2    H   1.736     8.984     -2.014    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6738    .   1   1   27   LYS   HE3    H   2.659     10.307    -1.324    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6739    .   1   1   27   LYS   HG2    H   2.153     6.696     -1.343    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6740    .   1   1   27   LYS   HG3    H   3.446     6.276     -0.234    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6741    .   1   1   27   LYS   HZ1    H   3.465     8.577     -3.619    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6742    .   1   1   27   LYS   HZ2    H   4.475     9.682     -2.862    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6743    .   1   1   27   LYS   HZ3    H   3.090     10.221    -3.645    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6744    .   1   1   27   LYS   N      N   4.216     4.072     -1.443    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6745    .   1   1   27   LYS   NZ     N   3.481     9.454     -3.062    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6746    .   1   1   27   LYS   O      O   5.913     4.263     -3.690    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6747    .   1   1   28   LYS   C      C   4.763     4.808     -7.054    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6748    .   1   1   28   LYS   CA     C   4.577     3.724     -6.031    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6749    .   1   1   28   LYS   CB     C   3.688     2.592     -6.577    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6750    .   1   1   28   LYS   CD     C   3.191     0.884     -8.343    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6751    .   1   1   28   LYS   CE     C   3.542     0.334     -9.716    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6752    .   1   1   28   LYS   CG     C   4.138     1.990     -7.903    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6753    .   1   1   28   LYS   H      H   3.062     4.527     -4.839    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6754    .   1   1   28   LYS   HA     H   5.541     3.306     -5.780    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6755    .   1   1   28   LYS   HB2    H   3.655     1.799     -5.845    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6756    .   1   1   28   LYS   HB3    H   2.688     2.981     -6.704    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6757    .   1   1   28   LYS   HD2    H   3.241     0.075     -7.629    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6758    .   1   1   28   LYS   HD3    H   2.186     1.278     -8.368    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6759    .   1   1   28   LYS   HE2    H   2.837     -0.443    -9.970    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6760    .   1   1   28   LYS   HE3    H   3.459     1.136     -10.434   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6761    .   1   1   28   LYS   HG2    H   4.149     2.764     -8.656    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6762    .   1   1   28   LYS   HG3    H   5.131     1.579     -7.792    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6763    .   1   1   28   LYS   HZ1    H   5.029     -0.731    -10.685   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6764    .   1   1   28   LYS   HZ2    H   5.093     -0.896    -9.009    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6765    .   1   1   28   LYS   HZ3    H   5.621     0.532     -9.762    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6766    .   1   1   28   LYS   N      N   4.008     4.258     -4.839    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6767    .   1   1   28   LYS   NZ     N   4.903     -0.231    -9.783    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6768    .   1   1   28   LYS   O      O   3.807     5.225     -7.726    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6769    .   1   1   29   LEU   C      C   6.675     5.460     -9.347    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6770    .   1   1   29   LEU   CA     C   6.290     6.266     -8.138    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6771    .   1   1   29   LEU   CB     C   7.452     7.170     -7.702    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6772    .   1   1   29   LEU   CD1    C   8.464     8.831     -6.126    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6773    .   1   1   29   LEU   CD2    C   6.019     8.938     -6.626    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6774    .   1   1   29   LEU   CG     C   7.222     8.019     -6.448    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6775    .   1   1   29   LEU   H      H   6.630     5.061     -6.451    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6776    .   1   1   29   LEU   HA     H   5.417     6.859     -8.363    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6777    .   1   1   29   LEU   HB2    H   8.315     6.544     -7.531    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6778    .   1   1   29   LEU   HB3    H   7.679     7.837     -8.520    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6779    .   1   1   29   LEU   HD11   H   8.695     9.482     -6.957    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD11   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6780    .   1   1   29   LEU   HD12   H   9.294     8.164     -5.951    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD12   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6781    .   1   1   29   LEU   HD13   H   8.286     9.425     -5.242    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD13   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6782    .   1   1   29   LEU   HD21   H   5.888     9.533     -5.735    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6783    .   1   1   29   LEU   HD22   H   5.131     8.346     -6.791    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6784    .   1   1   29   LEU   HD23   H   6.183     9.589     -7.472    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD23   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6785    .   1   1   29   LEU   HG     H   7.030     7.363     -5.612    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6786    .   1   1   29   LEU   N      N   5.957     5.323     -7.114    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6787    .   1   1   29   LEU   O      O   6.186     5.677     -10.456   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6788    .   1   1   30   TRP   C      C   7.672     2.208     -9.711    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6789    .   1   1   30   TRP   CA     C   7.960     3.608     -10.140   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6790    .   1   1   30   TRP   CB     C   9.442     3.800     -10.447   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6791    .   1   1   30   TRP   CD1    C   9.487     5.676     -12.167   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6792    .   1   1   30   TRP   CD2    C   10.399    6.217     -10.205   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6793    .   1   1   30   TRP   CE2    C   10.485    7.331     -11.057   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6794    .   1   1   30   TRP   CE3    C   10.906    6.317     -8.914    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6795    .   1   1   30   TRP   CG     C   9.759     5.171     -10.937   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6796    .   1   1   30   TRP   CH2    C   11.548    8.595     -9.378    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6797    .   1   1   30   TRP   CZ2    C   11.060    8.530     -10.654   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6798    .   1   1   30   TRP   CZ3    C   11.475    7.505     -8.514    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6799    .   1   1   30   TRP   H      H   7.849     4.348     -8.204    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6800    .   1   1   30   TRP   HA     H   7.382     3.820     -11.027   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6801    .   1   1   30   TRP   HB2    H   10.019    3.622     -9.552    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6802    .   1   1   30   TRP   HB3    H   9.739     3.096     -11.209   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6803    .   1   1   30   TRP   HD1    H   9.002     5.120     -12.956   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6804    .   1   1   30   TRP   HE1    H   9.834     7.550     -13.045   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6805    .   1   1   30   TRP   HE3    H   10.853    5.479     -8.234    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6806    .   1   1   30   TRP   HH2    H   12.004    9.503     -9.013    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6807    .   1   1   30   TRP   HZ2    H   11.125    9.389     -11.306   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6808    .   1   1   30   TRP   HZ3    H   11.873    7.603     -7.514    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6809    .   1   1   30   TRP   N      N   7.518     4.495     -9.115    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6810    .   1   1   30   TRP   NE1    N   9.924     6.973     -12.251   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   NE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6811    .   1   1   30   TRP   O      O   6.669     1.649     -10.159   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   13   .   6812    .   1   1   30   TRP   OXT    O   8.404     1.678     -8.849    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   OXT    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6813    .   1   1   1    TYR   C      C   -10.143   1.202     0.225     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6814    .   1   1   1    TYR   CA     C   -11.579   1.233     0.681     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6815    .   1   1   1    TYR   CB     C   -11.944   -0.043    1.467     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6816    .   1   1   1    TYR   CD1    C   -13.169   -1.714    0.049     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6817    .   1   1   1    TYR   CD2    C   -10.845   -2.048    0.416     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6818    .   1   1   1    TYR   CE1    C   -13.211   -2.840    -0.725    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6819    .   1   1   1    TYR   CE2    C   -10.878   -3.175    -0.354    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6820    .   1   1   1    TYR   CG     C   -11.988   -1.296    0.634     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6821    .   1   1   1    TYR   CZ     C   -12.062   -3.572    -0.926    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6822    .   1   1   1    TYR   H1     H   -13.454   1.459     -0.195    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   H1     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6823    .   1   1   1    TYR   H2     H   -12.287   0.680     -1.163    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   H2     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6824    .   1   1   1    TYR   H3     H   -12.207   2.324     -0.929    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   H3     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6825    .   1   1   1    TYR   HA     H   -11.715   2.089     1.318     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6826    .   1   1   1    TYR   HB2    H   -11.209   -0.196    2.242     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6827    .   1   1   1    TYR   HB3    H   -12.910   0.096     1.927     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6828    .   1   1   1    TYR   HD1    H   -14.074   -1.144    0.207     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6829    .   1   1   1    TYR   HD2    H   -9.915    -1.735    0.866     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6830    .   1   1   1    TYR   HE1    H   -14.154   -3.126    -1.162    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6831    .   1   1   1    TYR   HE2    H   -9.965    -3.730    -0.499    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6832    .   1   1   1    TYR   HH     H   -11.532   -5.373    -1.312    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HH     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6833    .   1   1   1    TYR   N      N   -12.450   1.429     -0.460    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6834    .   1   1   1    TYR   O      O   -9.851    0.754     -0.883    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6835    .   1   1   1    TYR   OH     O   -12.099   -4.698    -1.712    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   OH     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6836    .   1   1   2    CYS   C      C   -7.016    1.646     1.978     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6837    .   1   1   2    CYS   CA     C   -7.853    1.739     0.736     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6838    .   1   1   2    CYS   CB     C   -7.515    3.071     0.055     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6839    .   1   1   2    CYS   H      H   -9.546    2.000     1.937     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6840    .   1   1   2    CYS   HA     H   -7.603    0.940     0.054     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6841    .   1   1   2    CYS   HB2    H   -8.037    3.850     0.589     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6842    .   1   1   2    CYS   HB3    H   -6.457    3.244     0.156     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6843    .   1   1   2    CYS   N      N   -9.261    1.671     1.056     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6844    .   1   1   2    CYS   O      O   -7.401    2.168     3.032     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6845    .   1   1   2    CYS   SG     S   -7.977    3.234     -1.703    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6846    .   1   1   3    GLN   C      C   -4.098    2.251     2.747     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6847    .   1   1   3    GLN   CA     C   -4.923    1.001     2.936     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6848    .   1   1   3    GLN   CB     C   -3.993    -0.210    2.914     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6849    .   1   1   3    GLN   CD     C   -5.344    -1.701    4.390     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6850    .   1   1   3    GLN   CG     C   -4.656    -1.559    3.073     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6851    .   1   1   3    GLN   H      H   -5.701    0.451     1.066     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6852    .   1   1   3    GLN   HA     H   -5.458    1.052     3.871     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6853    .   1   1   3    GLN   HB2    H   -3.432    -0.212    1.994     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6854    .   1   1   3    GLN   HB3    H   -3.288    -0.093    3.724     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6855    .   1   1   3    GLN   HE21   H   -3.677    -2.379    5.199     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HE21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6856    .   1   1   3    GLN   HE22   H   -5.039    -2.228    6.256     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HE22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6857    .   1   1   3    GLN   HG2    H   -5.387    -1.682    2.288     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6858    .   1   1   3    GLN   HG3    H   -3.905    -2.330    2.986     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6859    .   1   1   3    GLN   N      N   -5.889    0.978     1.871     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6860    .   1   1   3    GLN   NE2    N   -4.620    -2.152    5.373     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   NE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6861    .   1   1   3    GLN   O      O   -3.852    2.662     1.608     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6862    .   1   1   3    GLN   OE1    O   -6.523    -1.397    4.523     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   OE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6863    .   1   1   4    LYS   C      C   -1.461    3.803     3.745     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6864    .   1   1   4    LYS   CA     C   -2.947    4.086     3.748     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6865    .   1   1   4    LYS   CB     C   -3.291    5.006     4.915     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6866    .   1   1   4    LYS   CD     C   -5.006    6.340     6.133     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6867    .   1   1   4    LYS   CE     C   -6.460    6.752     6.185     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6868    .   1   1   4    LYS   CG     C   -4.743    5.422     4.962     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6869    .   1   1   4    LYS   H      H   -3.924    2.477     4.697     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6870    .   1   1   4    LYS   HA     H   -3.213    4.587     2.830     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6871    .   1   1   4    LYS   HB2    H   -3.057    4.495     5.837     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6872    .   1   1   4    LYS   HB3    H   -2.683    5.896     4.846     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6873    .   1   1   4    LYS   HD2    H   -4.749    5.830     7.048     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6874    .   1   1   4    LYS   HD3    H   -4.392    7.221     6.022     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6875    .   1   1   4    LYS   HE2    H   -6.722    7.254     5.266     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6876    .   1   1   4    LYS   HE3    H   -7.058    5.860     6.292     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6877    .   1   1   4    LYS   HG2    H   -4.992    5.937     4.047     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6878    .   1   1   4    LYS   HG3    H   -5.358    4.539     5.060     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6879    .   1   1   4    LYS   HZ1    H   -7.736    7.943     7.325     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6880    .   1   1   4    LYS   HZ2    H   -6.161    8.515     7.261     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6881    .   1   1   4    LYS   HZ3    H   -6.529    7.193     8.225     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6882    .   1   1   4    LYS   N      N   -3.706    2.865     3.824     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6883    .   1   1   4    LYS   NZ     N   -6.738    7.651     7.319     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6884    .   1   1   4    LYS   O      O   -1.037    2.686     3.994     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6885    .   1   1   5    TRP   C      C   1.334     4.411     4.864     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6886    .   1   1   5    TRP   CA     C   0.779     4.816     3.490     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6887    .   1   1   5    TRP   CB     C   1.303     6.223     3.094     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6888    .   1   1   5    TRP   CD1    C   1.387     7.825     5.106     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6889    .   1   1   5    TRP   CD2    C   -0.446    8.047     3.842     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6890    .   1   1   5    TRP   CE2    C   -0.530    8.948     4.916     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6891    .   1   1   5    TRP   CE3    C   -1.487    8.009     2.911     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6892    .   1   1   5    TRP   CG     C   0.789     7.325     3.987     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6893    .   1   1   5    TRP   CH2    C   -2.612    9.742     4.157     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6894    .   1   1   5    TRP   CZ2    C   -1.611    9.803     5.084     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6895    .   1   1   5    TRP   CZ3    C   -2.557    8.859     3.079     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6896    .   1   1   5    TRP   H      H   -1.131    5.709     3.354     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6897    .   1   1   5    TRP   HA     H   1.097     4.102     2.746     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6898    .   1   1   5    TRP   HB2    H   2.380     6.233     3.164     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6899    .   1   1   5    TRP   HB3    H   1.005     6.444     2.081     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6900    .   1   1   5    TRP   HD1    H   2.342     7.488     5.487     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6901    .   1   1   5    TRP   HE1    H   0.813     9.280     6.502     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6902    .   1   1   5    TRP   HE3    H   -1.468    7.338     2.064     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6903    .   1   1   5    TRP   HH2    H   -3.473    10.387    4.248     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6904    .   1   1   5    TRP   HZ2    H   -1.676    10.496    5.910     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6905    .   1   1   5    TRP   HZ3    H   -3.373    8.845     2.371     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6906    .   1   1   5    TRP   N      N   -0.693    4.848     3.516     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6907    .   1   1   5    TRP   NE1    N   0.596     8.792     5.673     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   NE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6908    .   1   1   5    TRP   O      O   2.429     3.870     4.987     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6909    .   1   1   6    MET   C      C   0.651     2.917     7.531     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6910    .   1   1   6    MET   CA     C   0.882     4.392     7.256     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6911    .   1   1   6    MET   CB     C   -0.021    5.222     8.164     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6912    .   1   1   6    MET   CE     C   -0.420    5.436     12.297    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6913    .   1   1   6    MET   CG     C   0.172     4.975     9.643     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6914    .   1   1   6    MET   H      H   -0.290    5.152     5.684     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6915    .   1   1   6    MET   HA     H   1.909     4.659     7.448     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6916    .   1   1   6    MET   HB2    H   0.170     6.268     7.972     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6917    .   1   1   6    MET   HB3    H   -1.051    5.008     7.915     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6918    .   1   1   6    MET   HE1    H   0.621     5.691     12.433    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6919    .   1   1   6    MET   HE2    H   -0.547    4.369     12.399    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6920    .   1   1   6    MET   HE3    H   -1.015    5.940     13.044    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6921    .   1   1   6    MET   HG2    H   0.004     3.926     9.838     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6922    .   1   1   6    MET   HG3    H   1.191     5.224     9.890     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6923    .   1   1   6    MET   N      N   0.553     4.694     5.880     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6924    .   1   1   6    MET   O      O   1.277     2.313     8.402     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6925    .   1   1   6    MET   SD     S   -0.954    5.946     10.663    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   SD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6926    .   1   1   7    TRP   C      C   0.190     0.055     6.102     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6927    .   1   1   7    TRP   CA     C   -0.643    0.996     6.965     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6928    .   1   1   7    TRP   CB     C   -2.148    0.835     6.636     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6929    .   1   1   7    TRP   CD1    C   -2.767    2.676     8.361     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6930    .   1   1   7    TRP   CD2    C   -4.498    1.889     7.195     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6931    .   1   1   7    TRP   CE2    C   -4.961    2.885     8.074     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6932    .   1   1   7    TRP   CE3    C   -5.411    1.253     6.367     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6933    .   1   1   7    TRP   CG     C   -3.085    1.772     7.383     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6934    .   1   1   7    TRP   CH2    C   -7.168    2.610     7.308     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6935    .   1   1   7    TRP   CZ2    C   -6.299    3.252     8.138     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6936    .   1   1   7    TRP   CZ3    C   -6.737    1.616     6.431     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6937    .   1   1   7    TRP   H      H   -0.547    2.841     5.983     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6938    .   1   1   7    TRP   HA     H   -0.487    0.756     8.006     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6939    .   1   1   7    TRP   HB2    H   -2.292    1.015     5.581     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6940    .   1   1   7    TRP   HB3    H   -2.445    -0.180    6.857     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6941    .   1   1   7    TRP   HD1    H   -1.766    2.828     8.736     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6942    .   1   1   7    TRP   HE1    H   -3.915    4.051     9.456     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6943    .   1   1   7    TRP   HE3    H   -5.094    0.473     5.690     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6944    .   1   1   7    TRP   HH2    H   -8.218    2.863     7.326     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6945    .   1   1   7    TRP   HZ2    H   -6.656    4.018     8.812     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6946    .   1   1   7    TRP   HZ3    H   -7.460    1.131     5.790     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6947    .   1   1   7    TRP   N      N   -0.216    2.347     6.761     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6948    .   1   1   7    TRP   NE1    N   -3.886    3.351     8.767     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   NE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6949    .   1   1   7    TRP   O      O   1.139     0.472     5.416     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6950    .   1   1   8    THR   C      C   -0.536    -2.977    4.628     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6951    .   1   1   8    THR   CA     C   0.539     -2.206    5.406     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6952    .   1   1   8    THR   CB     C   1.281     -3.142    6.400     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6953    .   1   1   8    THR   CG2    C   2.350     -2.373    7.186     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   CG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6954    .   1   1   8    THR   H      H   -0.900    -1.485    6.699     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6955    .   1   1   8    THR   HA     H   1.241     -1.720    4.746     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6956    .   1   1   8    THR   HB     H   1.746     -3.955    5.860     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6957    .   1   1   8    THR   HG1    H   0.278     -3.006    8.060     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HG1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6958    .   1   1   8    THR   HG21   H   3.076     -1.915    6.530     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HG21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6959    .   1   1   8    THR   HG22   H   2.860     -3.049    7.854     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HG22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6960    .   1   1   8    THR   HG23   H   1.867     -1.602    7.766     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HG23   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6961    .   1   1   8    THR   N      N   -0.142    -1.191    6.150     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6962    .   1   1   8    THR   O      O   -1.745    -2.714    4.857     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6963    .   1   1   8    THR   OG1    O   0.334     -3.654    7.348     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   OG1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6964    .   1   1   9    CYS   C      C   -1.196    -6.089    3.335     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6965    .   1   1   9    CYS   CA     C   -1.275    -4.601    3.082     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6966    .   1   1   9    CYS   CB     C   -1.394    -4.294    1.587     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6967    .   1   1   9    CYS   H      H   0.742     -4.102    3.463     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6968    .   1   1   9    CYS   HA     H   -2.174    -4.254    3.572     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6969    .   1   1   9    CYS   HB2    H   -2.332    -4.686    1.223     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6970    .   1   1   9    CYS   HB3    H   -1.391    -3.223    1.451     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6971    .   1   1   9    CYS   N      N   -0.186    -3.892    3.721     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6972    .   1   1   9    CYS   O      O   -0.286    -6.566    4.009     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6973    .   1   1   9    CYS   SG     S   -0.088    -4.988    0.544     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6974    .   1   1   10   ASP   C      C   -2.832    -8.723    1.624     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6975    .   1   1   10   ASP   CA     C   -2.330    -8.207    2.971     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6976    .   1   1   10   ASP   CB     C   -3.389    -8.419    4.091     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6977    .   1   1   10   ASP   CG     C   -3.741    -9.854    4.397     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6978    .   1   1   10   ASP   H      H   -2.806    -6.346    2.218     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6979    .   1   1   10   ASP   HA     H   -1.394    -8.671    3.244     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6980    .   1   1   10   ASP   HB2    H   -3.057    -7.958    5.005     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6981    .   1   1   10   ASP   HB3    H   -4.291    -7.931    3.752     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6982    .   1   1   10   ASP   N      N   -2.152    -6.791    2.804     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6983    .   1   1   10   ASP   O      O   -2.751    -7.998    0.622     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6984    .   1   1   10   ASP   OD1    O   -2.937    -10.566   5.014     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   OD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6985    .   1   1   10   ASP   OD2    O   -4.844    -10.290   4.002     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   OD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6986    .   1   1   11   SER   C      C   -5.293    -9.846    0.211     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6987    .   1   1   11   SER   CA     C   -3.894    -10.433   0.374     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6988    .   1   1   11   SER   CB     C   -3.905    -11.962   0.430     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6989    .   1   1   11   SER   H      H   -3.371    -10.469   2.380     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6990    .   1   1   11   SER   HA     H   -3.279    -10.105   -0.451    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6991    .   1   1   11   SER   HB2    H   -4.505    -12.345   -0.380    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6992    .   1   1   11   SER   HB3    H   -2.894    -12.333   0.337     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6993    .   1   1   11   SER   HG     H   -5.137    -13.067   1.444     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   HG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6994    .   1   1   11   SER   N      N   -3.332    -9.914    1.572     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6995    .   1   1   11   SER   O      O   -5.699    -9.464    -0.890    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6996    .   1   1   11   SER   OG     O   -4.451    -12.424   1.667     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   OG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6997    .   1   1   12   GLU   C      C   -7.255    -7.617    1.435     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6998    .   1   1   12   GLU   CA     C   -7.312    -9.136    1.330     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   6999    .   1   1   12   GLU   CB     C   -8.150    -9.719    2.451     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7000    .   1   1   12   GLU   CD     C   -9.088    -11.541   1.027     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7001    .   1   1   12   GLU   CG     C   -8.403    -11.202   2.317     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7002    .   1   1   12   GLU   H      H   -5.589    -10.020   2.172     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7003    .   1   1   12   GLU   HA     H   -7.772    -9.392    0.386     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7004    .   1   1   12   GLU   HB2    H   -7.651    -9.543    3.391     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7005    .   1   1   12   GLU   HB3    H   -9.103    -9.217    2.454     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7006    .   1   1   12   GLU   HG2    H   -7.459    -11.727   2.356     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7007    .   1   1   12   GLU   HG3    H   -9.032    -11.524   3.134     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7008    .   1   1   12   GLU   N      N   -5.991    -9.706    1.327     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7009    .   1   1   12   GLU   O      O   -7.898    -6.908    0.662     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7010    .   1   1   12   GLU   OE1    O   -10.328   -11.371   0.923     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   OE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7011    .   1   1   12   GLU   OE2    O   -8.423    -12.001   0.101     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   OE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7012    .   1   1   13   ARG   C      C   -5.356    -5.212    1.476     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7013    .   1   1   13   ARG   CA     C   -6.332    -5.668    2.524     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7014    .   1   1   13   ARG   CB     C   -5.768    -5.302    3.891     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7015    .   1   1   13   ARG   CD     C   -7.865    -4.729    5.185     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7016    .   1   1   13   ARG   CG     C   -6.642    -5.614    5.084     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7017    .   1   1   13   ARG   CZ     C   -10.087   -4.468    4.120     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   CZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7018    .   1   1   13   ARG   H      H   -6.042    -7.720    3.010     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7019    .   1   1   13   ARG   HA     H   -7.287    -5.186    2.381     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7020    .   1   1   13   ARG   HB2    H   -4.853    -5.855    4.023     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7021    .   1   1   13   ARG   HB3    H   -5.540    -4.246    3.898     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7022    .   1   1   13   ARG   HD2    H   -8.236    -4.754    6.198     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7023    .   1   1   13   ARG   HD3    H   -7.573    -3.720    4.940     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7024    .   1   1   13   ARG   HE     H   -8.777    -5.995    3.825     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7025    .   1   1   13   ARG   HG2    H   -7.002    -6.612    4.906     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7026    .   1   1   13   ARG   HG3    H   -6.064    -5.563    5.993     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7027    .   1   1   13   ARG   HH11   H   -9.584    -2.879    5.333     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HH11   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7028    .   1   1   13   ARG   HH12   H   -11.138   -2.787    4.643     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HH12   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7029    .   1   1   13   ARG   HH21   H   -10.964   -5.866    2.900     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HH21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7030    .   1   1   13   ARG   HH22   H   -11.929   -4.509    3.240     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HH22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7031    .   1   1   13   ARG   N      N   -6.502    -7.112    2.395     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7032    .   1   1   13   ARG   NE     N   -8.938    -5.138    4.280     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   NE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7033    .   1   1   13   ARG   NH1    N   -10.279   -3.295    4.737     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   NH1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7034    .   1   1   13   ARG   NH2    N   -11.051   -4.979    3.363     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   NH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7035    .   1   1   13   ARG   O      O   -4.194    -5.545    1.531     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7036    .   1   1   14   LYS   C      C   -4.668    -2.538    -0.412    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7037    .   1   1   14   LYS   CA     C   -4.955    -4.022    -0.532    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7038    .   1   1   14   LYS   CB     C   -5.495    -4.379    -1.914    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7039    .   1   1   14   LYS   CD     C   -7.254    -4.201    -3.637    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7040    .   1   1   14   LYS   CE     C   -8.591    -3.627    -4.026    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7041    .   1   1   14   LYS   CG     C   -6.861    -3.817    -2.235    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7042    .   1   1   14   LYS   H      H   -6.775    -4.273    0.560     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7043    .   1   1   14   LYS   HA     H   -4.013    -4.535    -0.396    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7044    .   1   1   14   LYS   HB2    H   -4.804    -4.013    -2.658    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7045    .   1   1   14   LYS   HB3    H   -5.547    -5.455    -1.992    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7046    .   1   1   14   LYS   HD2    H   -6.505    -3.824    -4.316    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7047    .   1   1   14   LYS   HD3    H   -7.295    -5.279    -3.708    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7048    .   1   1   14   LYS   HE2    H   -9.350    -4.019    -3.366    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7049    .   1   1   14   LYS   HE3    H   -8.543    -2.553    -3.929    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7050    .   1   1   14   LYS   HG2    H   -7.583    -4.215    -1.538    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7051    .   1   1   14   LYS   HG3    H   -6.832    -2.739    -2.158    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7052    .   1   1   14   LYS   HZ1    H   -8.185    -3.630    -6.052    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7053    .   1   1   14   LYS   HZ2    H   -9.824    -3.516    -5.697    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7054    .   1   1   14   LYS   HZ3    H   -9.034    -4.995    -5.539    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7055    .   1   1   14   LYS   N      N   -5.822    -4.497    0.526     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7056    .   1   1   14   LYS   NZ     N   -8.932    -3.968    -5.413    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7057    .   1   1   14   LYS   O      O   -5.507    -1.769    0.087     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7058    .   1   1   15   CYS   C      C   -3.906    0.034     -1.885    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7059    .   1   1   15   CYS   CA     C   -3.101    -0.736    -0.849    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7060    .   1   1   15   CYS   CB     C   -1.607    -0.588    -1.114    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7061    .   1   1   15   CYS   H      H   -2.866    -2.796    -1.218    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7062    .   1   1   15   CYS   HA     H   -3.335    -0.330    0.121     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7063    .   1   1   15   CYS   HB2    H   -1.388    -0.941    -2.111    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7064    .   1   1   15   CYS   HB3    H   -1.341    0.456     -1.041    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7065    .   1   1   15   CYS   N      N   -3.493    -2.137    -0.862    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7066    .   1   1   15   CYS   O      O   -4.460    -0.565    -2.821    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7067    .   1   1   15   CYS   SG     S   -0.542    -1.513    0.042     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7068    .   1   1   16   CYS   C      C   -4.131    2.324     -3.978    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7069    .   1   1   16   CYS   CA     C   -4.776    2.172     -2.593    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7070    .   1   1   16   CYS   CB     C   -4.963    3.548     -1.958    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7071    .   1   1   16   CYS   H      H   -3.443    1.777     -1.023    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7072    .   1   1   16   CYS   HA     H   -5.744    1.707     -2.701    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7073    .   1   1   16   CYS   HB2    H   -4.931    3.467     -0.884    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7074    .   1   1   16   CYS   HB3    H   -4.132    4.165     -2.265    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7075    .   1   1   16   CYS   N      N   -3.963    1.338     -1.730    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7076    .   1   1   16   CYS   O      O   -3.009    1.846     -4.220    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7077    .   1   1   16   CYS   SG     S   -6.498    4.403     -2.475    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7078    .   1   1   17   LYS   C      C   -3.203    4.199     -6.169    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7079    .   1   1   17   LYS   CA     C   -4.372    3.221     -6.212    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7080    .   1   1   17   LYS   CB     C   -5.514    3.775     -7.064    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7081    .   1   1   17   LYS   CD     C   -6.372    4.444     -9.310    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7082    .   1   1   17   LYS   CE     C   -6.044    4.593     -10.779   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7083    .   1   1   17   LYS   CG     C   -5.165    3.977     -8.523    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7084    .   1   1   17   LYS   H      H   -5.728    3.312     -4.618    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7085    .   1   1   17   LYS   HA     H   -4.040    2.283     -6.632    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7086    .   1   1   17   LYS   HB2    H   -6.352    3.096     -7.007    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7087    .   1   1   17   LYS   HB3    H   -5.815    4.727     -6.653    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7088    .   1   1   17   LYS   HD2    H   -7.166    3.721     -9.202    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7089    .   1   1   17   LYS   HD3    H   -6.697    5.399     -8.922    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7090    .   1   1   17   LYS   HE2    H   -5.647    3.656     -11.137   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7091    .   1   1   17   LYS   HE3    H   -6.952    4.822     -11.315   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7092    .   1   1   17   LYS   HG2    H   -4.385    4.720     -8.598    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7093    .   1   1   17   LYS   HG3    H   -4.815    3.042     -8.933    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7094    .   1   1   17   LYS   HZ1    H   -5.443    6.585     -10.773   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7095    .   1   1   17   LYS   HZ2    H   -4.801    5.673     -12.043   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7096    .   1   1   17   LYS   HZ3    H   -4.177    5.503     -10.487   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7097    .   1   1   17   LYS   N      N   -4.843    2.976     -4.873    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7098    .   1   1   17   LYS   NZ     N   -5.048    5.658     -11.034   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7099    .   1   1   17   LYS   O      O   -3.305    5.277     -5.577    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7100    .   1   1   18   GLY   C      C   0.013     4.185     -5.644    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7101    .   1   1   18   GLY   CA     C   -0.910    4.624     -6.751    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7102    .   1   1   18   GLY   H      H   -2.089    2.942     -7.226    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7103    .   1   1   18   GLY   HA2    H   -0.405    4.522     -7.702    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   HA2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7104    .   1   1   18   GLY   HA3    H   -1.177    5.658     -6.600    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   HA3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7105    .   1   1   18   GLY   N      N   -2.105    3.809     -6.766    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7106    .   1   1   18   GLY   O      O   0.978     4.870     -5.292    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7107    .   1   1   19   MET   C      C   0.880     1.081     -4.446    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7108    .   1   1   19   MET   CA     C   0.477     2.461     -4.030    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7109    .   1   1   19   MET   CB     C   -0.292    2.371     -2.707    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7110    .   1   1   19   MET   CE     C   -1.812    5.207     -0.084    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7111    .   1   1   19   MET   CG     C   -0.624    3.693     -2.065    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7112    .   1   1   19   MET   H      H   -1.141    2.606     -5.345    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7113    .   1   1   19   MET   HA     H   1.362     3.059     -3.880    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7114    .   1   1   19   MET   HB2    H   -1.220    1.851     -2.887    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7115    .   1   1   19   MET   HB3    H   0.298     1.793     -2.011    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7116    .   1   1   19   MET   HE1    H   -2.315    5.750     -0.871    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7117    .   1   1   19   MET   HE2    H   -0.842    5.648     0.094     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7118    .   1   1   19   MET   HE3    H   -2.401    5.257     0.819     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7119    .   1   1   19   MET   HG2    H   0.312     4.155     -1.787    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7120    .   1   1   19   MET   HG3    H   -1.156    4.317     -2.769    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7121    .   1   1   19   MET   N      N   -0.316    3.059     -5.063    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7122    .   1   1   19   MET   O      O   0.230     0.462     -5.305    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7123    .   1   1   19   MET   SD     S   -1.612    3.495     -0.574    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   SD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7124    .   1   1   20   VAL   C      C   2.021     -1.572    -2.871    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7125    .   1   1   20   VAL   CA     C   2.406     -0.728    -4.067    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7126    .   1   1   20   VAL   CB     C   3.959     -0.722    -4.205    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7127    .   1   1   20   VAL   CG1    C   4.506     -2.126    -4.438    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   CG1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7128    .   1   1   20   VAL   CG2    C   4.404     0.214     -5.323    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   CG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7129    .   1   1   20   VAL   H      H   2.387     1.170     -3.191    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7130    .   1   1   20   VAL   HA     H   1.965     -1.124    -4.970    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7131    .   1   1   20   VAL   HB     H   4.372     -0.357    -3.276    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7132    .   1   1   20   VAL   HG11   H   4.104     -2.523    -5.357    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG11   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7133    .   1   1   20   VAL   HG12   H   4.217     -2.764    -3.617    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG12   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7134    .   1   1   20   VAL   HG13   H   5.584     -2.088    -4.502    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG13   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7135    .   1   1   20   VAL   HG21   H   5.483     0.202     -5.398    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7136    .   1   1   20   VAL   HG22   H   4.068     1.217     -5.109    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7137    .   1   1   20   VAL   HG23   H   3.976     -0.117    -6.258    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG23   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7138    .   1   1   20   VAL   N      N   1.909     0.595     -3.834    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7139    .   1   1   20   VAL   O      O   2.315     -1.191    -1.718    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7140    .   1   1   21   CYS   C      C   2.116     -4.385    -1.693    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7141    .   1   1   21   CYS   CA     C   0.912     -3.573    -2.073    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7142    .   1   1   21   CYS   CB     C   -0.256    -4.474    -2.517    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7143    .   1   1   21   CYS   H      H   1.069     -2.879    -4.052    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7144    .   1   1   21   CYS   HA     H   0.615     -2.977    -1.223    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7145    .   1   1   21   CYS   HB2    H   -1.034    -3.856    -2.941    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7146    .   1   1   21   CYS   HB3    H   0.107     -5.149    -3.277    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7147    .   1   1   21   CYS   N      N   1.313     -2.665    -3.125    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7148    .   1   1   21   CYS   O      O   2.580     -5.257    -2.449    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7149    .   1   1   21   CYS   SG     S   -1.036    -5.496    -1.189    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7150    .   1   1   22   ARG   C      C   3.722     -4.884    1.420     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7151    .   1   1   22   ARG   CA     C   3.840     -4.645    -0.100    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7152    .   1   1   22   ARG   CB     C   4.931     -3.620    -0.454    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7153    .   1   1   22   ARG   CD     C   7.242     -3.097    -1.097    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7154    .   1   1   22   ARG   CG     C   6.349     -4.120    -0.449    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7155    .   1   1   22   ARG   CZ     C   9.592     -2.947    -1.892    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   CZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7156    .   1   1   22   ARG   H      H   2.174     -3.454    0.049     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7157    .   1   1   22   ARG   HA     H   4.042     -5.557    -0.637    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7158    .   1   1   22   ARG   HB2    H   4.724     -3.238    -1.442    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7159    .   1   1   22   ARG   HB3    H   4.855     -2.800    0.245     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7160    .   1   1   22   ARG   HD2    H   6.876     -2.936    -2.101    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7161    .   1   1   22   ARG   HD3    H   7.159     -2.182    -0.531    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7162    .   1   1   22   ARG   HE     H   8.876     -4.286    -0.579    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7163    .   1   1   22   ARG   HG2    H   6.672     -4.276    0.570     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7164    .   1   1   22   ARG   HG3    H   6.400     -5.044    -1.003    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7165    .   1   1   22   ARG   HH11   H   8.365     -1.632    -2.892    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HH11   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7166    .   1   1   22   ARG   HH12   H   10.011    -1.527    -3.297    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HH12   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7167    .   1   1   22   ARG   HH21   H   11.079    -4.146    -1.189    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HH21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7168    .   1   1   22   ARG   HH22   H   11.591    -2.985    -2.326    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HH22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7169    .   1   1   22   ARG   N      N   2.637     -4.084    -0.547    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7170    .   1   1   22   ARG   NE     N   8.637     -3.522    -1.153    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   NE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7171    .   1   1   22   ARG   NH1    N   9.296     -1.971    -2.751    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   NH1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7172    .   1   1   22   ARG   NH2    N   10.835    -3.386    -1.800    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   NH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7173    .   1   1   22   ARG   O      O   2.594     -4.738    2.015     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7174    .   1   1   23   LEU   C      C   4.466     -4.220    4.272     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7175    .   1   1   23   LEU   CA     C   4.962     -5.446    3.507     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7176    .   1   1   23   LEU   CB     C   6.415     -5.795    3.942     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7177    .   1   1   23   LEU   CD1    C   6.134     -8.312    3.720     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7178    .   1   1   23   LEU   CD2    C   7.426     -7.067    1.963     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7179    .   1   1   23   LEU   CG     C   7.037     -7.126    3.436     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7180    .   1   1   23   LEU   H      H   5.661     -5.371    1.514     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7181    .   1   1   23   LEU   HA     H   4.316     -6.277    3.745     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7182    .   1   1   23   LEU   HB2    H   7.057     -4.997    3.601     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7183    .   1   1   23   LEU   HB3    H   6.439     -5.802    5.022     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7184    .   1   1   23   LEU   HD11   H   5.948     -8.386    4.781     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD11   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7185    .   1   1   23   LEU   HD12   H   6.616     -9.217    3.378     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD12   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7186    .   1   1   23   LEU   HD13   H   5.197     -8.188    3.198     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD13   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7187    .   1   1   23   LEU   HD21   H   8.123     -6.258    1.810     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7188    .   1   1   23   LEU   HD22   H   6.546     -6.914    1.358     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7189    .   1   1   23   LEU   HD23   H   7.893     -7.999    1.682     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD23   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7190    .   1   1   23   LEU   HG     H   7.935     -7.295    4.015     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7191    .   1   1   23   LEU   N      N   4.859     -5.229    2.055     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7192    .   1   1   23   LEU   O      O   4.200     -4.284    5.469     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7193    .   1   1   24   TRP   C      C   3.218     -1.244    2.778     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7194    .   1   1   24   TRP   CA     C   3.805     -1.909    4.021     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7195    .   1   1   24   TRP   CB     C   4.816     -0.993    4.738     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7196    .   1   1   24   TRP   CD1    C   5.739     0.966     3.432     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7197    .   1   1   24   TRP   CD2    C   6.978     -0.880    3.241     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7198    .   1   1   24   TRP   CE2    C   7.584     0.136     2.481     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7199    .   1   1   24   TRP   CE3    C   7.574     -2.140    3.276     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7200    .   1   1   24   TRP   CG     C   5.804     -0.316    3.841     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7201    .   1   1   24   TRP   CH2    C   9.311     -1.321    1.814     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7202    .   1   1   24   TRP   CZ2    C   8.755     -0.074    1.760     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7203    .   1   1   24   TRP   CZ3    C   8.734     -2.348    2.561     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7204    .   1   1   24   TRP   H      H   4.754     -3.093    2.653     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7205    .   1   1   24   TRP   HA     H   3.015     -2.208    4.689     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7206    .   1   1   24   TRP   HB2    H   4.271     -0.219    5.254     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7207    .   1   1   24   TRP   HB3    H   5.365     -1.579    5.462     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7208    .   1   1   24   TRP   HD1    H   4.927     1.607     3.751     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7209    .   1   1   24   TRP   HE1    H   6.996     2.135     2.198     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7210    .   1   1   24   TRP   HE3    H   7.136     -2.938    3.854     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7211    .   1   1   24   TRP   HH2    H   10.220    -1.531    1.268     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7212    .   1   1   24   TRP   HZ2    H   9.221     0.705     1.176     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7213    .   1   1   24   TRP   HZ3    H   9.207     -3.318    2.575     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7214    .   1   1   24   TRP   N      N   4.404     -3.110    3.568     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7215    .   1   1   24   TRP   NE1    N   6.814     1.263     2.618     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   NE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7216    .   1   1   24   TRP   O      O   3.648     -1.577    1.664     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7217    .   1   1   25   CYS   C      C   2.545     1.454     1.371     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7218    .   1   1   25   CYS   CA     C   1.701     0.287     1.761     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7219    .   1   1   25   CYS   CB     C   0.248     0.690     1.945     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7220    .   1   1   25   CYS   H      H   1.905     -0.130    3.809     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7221    .   1   1   25   CYS   HA     H   1.761     -0.430    0.954     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7222    .   1   1   25   CYS   HB2    H   0.131     1.165     2.907     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7223    .   1   1   25   CYS   HB3    H   -0.030    1.387     1.168     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7224    .   1   1   25   CYS   N      N   2.251     -0.376    2.922     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7225    .   1   1   25   CYS   O      O   2.669     2.441     2.114     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7226    .   1   1   25   CYS   SG     S   -0.903    -0.710    1.874     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7227    .   1   1   26   LYS   C      C   3.421     3.119     -1.366    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7228    .   1   1   26   LYS   CA     C   4.015     2.373     -0.214    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7229    .   1   1   26   LYS   CB     C   5.390     1.811     -0.573    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7230    .   1   1   26   LYS   CD     C   7.768     2.356     -1.173    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7231    .   1   1   26   LYS   CE     C   8.717     3.483     -1.527    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7232    .   1   1   26   LYS   CG     C   6.366     2.886     -1.001    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7233    .   1   1   26   LYS   H      H   2.970     0.576     -0.351    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7234    .   1   1   26   LYS   HA     H   4.139     3.054     0.613     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7235    .   1   1   26   LYS   HB2    H   5.797     1.300     0.286     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7236    .   1   1   26   LYS   HB3    H   5.281     1.109     -1.387    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7237    .   1   1   26   LYS   HD2    H   8.088     1.900     -0.247    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7238    .   1   1   26   LYS   HD3    H   7.778     1.623     -1.965    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7239    .   1   1   26   LYS   HE2    H   8.435     3.888     -2.488    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7240    .   1   1   26   LYS   HE3    H   8.627     4.252     -0.777    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7241    .   1   1   26   LYS   HG2    H   6.033     3.298     -1.943    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7242    .   1   1   26   LYS   HG3    H   6.360     3.664     -0.254    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7243    .   1   1   26   LYS   HZ1    H   10.426    2.646     -0.681    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7244    .   1   1   26   LYS   HZ2    H   10.749    3.805     -1.854    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7245    .   1   1   26   LYS   HZ3    H   10.212    2.273     -2.298    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7246    .   1   1   26   LYS   N      N   3.143     1.353     0.224     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7247    .   1   1   26   LYS   NZ     N   10.109    3.032     -1.593    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7248    .   1   1   26   LYS   O      O   3.129     2.529     -2.397    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7249    .   1   1   27   LYS   C      C   3.908     5.632     -3.106    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7250    .   1   1   27   LYS   CA     C   2.727     5.231     -2.253    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7251    .   1   1   27   LYS   CB     C   1.945     6.457     -1.738    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7252    .   1   1   27   LYS   CD     C   1.856     8.505     -0.294    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7253    .   1   1   27   LYS   CE     C   2.543     9.302     0.814     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7254    .   1   1   27   LYS   CG     C   2.680     7.302     -0.720    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7255    .   1   1   27   LYS   H      H   3.381     4.779     -0.295    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7256    .   1   1   27   LYS   HA     H   2.080     4.622     -2.866    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7257    .   1   1   27   LYS   HB2    H   1.707     7.089     -2.580    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7258    .   1   1   27   LYS   HB3    H   1.020     6.119     -1.293    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7259    .   1   1   27   LYS   HD2    H   1.711     9.147     -1.149    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7260    .   1   1   27   LYS   HD3    H   0.898     8.160     0.063     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7261    .   1   1   27   LYS   HE2    H   1.919     10.144    1.077     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7262    .   1   1   27   LYS   HE3    H   2.654     8.661     1.677     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7263    .   1   1   27   LYS   HG2    H   2.884     6.695     0.150     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7264    .   1   1   27   LYS   HG3    H   3.609     7.643     -1.153    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7265    .   1   1   27   LYS   HZ1    H   3.835     10.464    -0.392    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7266    .   1   1   27   LYS   HZ2    H   4.501     9.027     0.132     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7267    .   1   1   27   LYS   HZ3    H   4.342     10.296    1.205     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7268    .   1   1   27   LYS   N      N   3.197     4.394     -1.177    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7269    .   1   1   27   LYS   NZ     N   3.877     9.809     0.415     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7270    .   1   1   27   LYS   O      O   5.048     5.657     -2.615    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7271    .   1   1   28   LYS   C      C   5.560     7.425     -4.881    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7272    .   1   1   28   LYS   CA     C   4.693     6.236     -5.325    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7273    .   1   1   28   LYS   CB     C   4.121     6.493     -6.735    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7274    .   1   1   28   LYS   CD     C   1.971     7.802     -6.209    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7275    .   1   1   28   LYS   CE     C   1.161     9.037     -6.587    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7276    .   1   1   28   LYS   CG     C   3.307     7.786     -6.929    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7277    .   1   1   28   LYS   H      H   2.718     5.851     -4.670    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7278    .   1   1   28   LYS   HA     H   5.335     5.371     -5.379    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7279    .   1   1   28   LYS   HB2    H   4.945     6.524     -7.433    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7280    .   1   1   28   LYS   HB3    H   3.488     5.657     -6.996    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7281    .   1   1   28   LYS   HD2    H   1.415     6.916     -6.479    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7282    .   1   1   28   LYS   HD3    H   2.149     7.809     -5.144    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7283    .   1   1   28   LYS   HE2    H   1.028     9.037     -7.659    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7284    .   1   1   28   LYS   HE3    H   0.197     8.974     -6.107    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7285    .   1   1   28   LYS   HG2    H   3.894     8.608     -6.547    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7286    .   1   1   28   LYS   HG3    H   3.145     7.948     -7.984    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7287    .   1   1   28   LYS   HZ1    H   1.220     11.101    -6.496    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7288    .   1   1   28   LYS   HZ2    H   2.759     10.434    -6.641    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7289    .   1   1   28   LYS   HZ3    H   1.921     10.359    -5.160    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7290    .   1   1   28   LYS   N      N   3.650     5.903     -4.364    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7291    .   1   1   28   LYS   NZ     N   1.821     10.308    -6.195    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7292    .   1   1   28   LYS   O      O   5.103     8.328     -4.162    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7293    .   1   1   29   LEU   C      C   7.571     9.648     -5.955    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7294    .   1   1   29   LEU   CA     C   7.754     8.468     -5.008    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7295    .   1   1   29   LEU   CB     C   9.183     7.922     -5.124    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7296    .   1   1   29   LEU   CD1    C   10.930    6.232     -4.503    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7297    .   1   1   29   LEU   CD2    C   9.522     7.257     -2.729    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7298    .   1   1   29   LEU   CG     C   9.553     6.778     -4.170    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7299    .   1   1   29   LEU   H      H   7.103     6.662     -5.864    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7300    .   1   1   29   LEU   HA     H   7.586     8.798     -3.994    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7301    .   1   1   29   LEU   HB2    H   9.326     7.574     -6.136    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7302    .   1   1   29   LEU   HB3    H   9.867     8.740     -4.948    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7303    .   1   1   29   LEU   HD11   H   11.169    5.428     -3.824    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD11   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7304    .   1   1   29   LEU   HD12   H   11.663    7.018     -4.405    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD12   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7305    .   1   1   29   LEU   HD13   H   10.933    5.858     -5.516    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD13   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7306    .   1   1   29   LEU   HD21   H   8.533     7.619     -2.489    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7307    .   1   1   29   LEU   HD22   H   10.237    8.054     -2.596    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7308    .   1   1   29   LEU   HD23   H   9.774     6.436     -2.073    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD23   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7309    .   1   1   29   LEU   HG     H   8.836     5.978     -4.278    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7310    .   1   1   29   LEU   N      N   6.796     7.416     -5.315    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7311    .   1   1   29   LEU   O      O   8.219     10.695    -5.808    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7312    .   1   1   30   TRP   C      C   4.931     10.508    -8.151    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7313    .   1   1   30   TRP   CA     C   6.434     10.507    -7.875    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7314    .   1   1   30   TRP   CB     C   7.220     10.209    -9.151    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7315    .   1   1   30   TRP   CD1    C   6.476     11.955    -10.861   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7316    .   1   1   30   TRP   CD2    C   8.622     12.097    -10.268   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7317    .   1   1   30   TRP   CE2    C   8.357     13.100    -11.210   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7318    .   1   1   30   TRP   CE3    C   9.912     11.986    -9.747    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7319    .   1   1   30   TRP   CG     C   7.404     11.378    -10.057   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7320    .   1   1   30   TRP   CH2    C   10.584    13.858    -11.118   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7321    .   1   1   30   TRP   CZ2    C   9.329     13.987    -11.644   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7322    .   1   1   30   TRP   CZ3    C   10.882    12.868    -10.178   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7323    .   1   1   30   TRP   H      H   6.206     8.641     -6.986    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7324    .   1   1   30   TRP   HA     H   6.739     11.460    -7.470    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7325    .   1   1   30   TRP   HB2    H   8.202     9.853     -8.878    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7326    .   1   1   30   TRP   HB3    H   6.708     9.434     -9.702    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7327    .   1   1   30   TRP   HD1    H   5.449     11.631    -10.929   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7328    .   1   1   30   TRP   HE1    H   6.562     13.558    -12.203   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7329    .   1   1   30   TRP   HE3    H   10.155    11.224    -9.021    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7330    .   1   1   30   TRP   HH2    H   11.371    14.529    -11.431   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7331    .   1   1   30   TRP   HZ2    H   9.118     14.755    -12.370   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7332    .   1   1   30   TRP   HZ3    H   11.886    12.799    -9.787    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7333    .   1   1   30   TRP   N      N   6.700     9.482     -6.916    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7334    .   1   1   30   TRP   NE1    N   7.043     12.993    -11.559   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   NE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7335    .   1   1   30   TRP   O      O   4.480     9.857     -9.105    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   14   .   7336    .   1   1   30   TRP   OXT    O   4.175     11.091    -7.347    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   OXT    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7337    .   1   1   1    TYR   C      C   -9.981    1.126     3.556     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7338    .   1   1   1    TYR   CA     C   -11.022   1.810     4.402     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7339    .   1   1   1    TYR   CB     C   -10.340   2.877     5.271     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7340    .   1   1   1    TYR   CD1    C   -11.432   3.467     7.468     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7341    .   1   1   1    TYR   CD2    C   -12.033   4.715     5.532     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7342    .   1   1   1    TYR   CE1    C   -12.298   4.219     8.224     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7343    .   1   1   1    TYR   CE2    C   -12.898   5.470     6.283     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7344    .   1   1   1    TYR   CG     C   -11.283   3.701     6.106     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7345    .   1   1   1    TYR   CZ     C   -13.028   5.218     7.627     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7346    .   1   1   1    TYR   H1     H   -12.472   1.292     5.777     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   H1     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7347    .   1   1   1    TYR   H2     H   -11.048   0.361     5.864     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   H2     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7348    .   1   1   1    TYR   H3     H   -12.139   0.100     4.626     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   H3     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7349    .   1   1   1    TYR   HA     H   -11.741   2.292     3.757     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7350    .   1   1   1    TYR   HB2    H   -9.647    2.392     5.942     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7351    .   1   1   1    TYR   HB3    H   -9.788    3.549     4.630     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7352    .   1   1   1    TYR   HD1    H   -10.857   2.683     7.941     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7353    .   1   1   1    TYR   HD2    H   -11.932   4.912     4.476     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7354    .   1   1   1    TYR   HE1    H   -12.399   4.020     9.281     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7355    .   1   1   1    TYR   HE2    H   -13.473   6.255     5.816     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7356    .   1   1   1    TYR   HH     H   -13.451   6.248     9.177     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HH     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7357    .   1   1   1    TYR   N      N   -11.720   0.836     5.229     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7358    .   1   1   1    TYR   O      O   -9.736    -0.077    3.708     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7359    .   1   1   1    TYR   OH     O   -13.899   5.966     8.369     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   OH     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7360    .   1   1   2    CYS   C      C   -7.034    1.623     2.621     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7361    .   1   1   2    CYS   CA     C   -8.315    1.441     1.819     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7362    .   1   1   2    CYS   CB     C   -8.297    2.306     0.545     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7363    .   1   1   2    CYS   H      H   -9.708    2.812     2.553     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7364    .   1   1   2    CYS   HA     H   -8.459    0.402     1.565     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7365    .   1   1   2    CYS   HB2    H   -9.251    2.226     0.049     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7366    .   1   1   2    CYS   HB3    H   -8.143    3.329     0.852     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7367    .   1   1   2    CYS   N      N   -9.400    1.886     2.660     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7368    .   1   1   2    CYS   O      O   -7.024    2.393     3.605     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7369    .   1   1   2    CYS   SG     S   -7.014    1.912     -0.698    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7370    .   1   1   3    GLN   C      C   -3.988    2.298     2.633     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7371    .   1   1   3    GLN   CA     C   -4.751    1.051     3.004     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7372    .   1   1   3    GLN   CB     C   -3.856    -0.172    2.813     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7373    .   1   1   3    GLN   CD     C   -5.211    -1.621    4.391     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7374    .   1   1   3    GLN   CG     C   -4.516    -1.522    3.055     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7375    .   1   1   3    GLN   H      H   -5.998    0.481     1.383     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7376    .   1   1   3    GLN   HA     H   -5.036    1.124     4.042     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7377    .   1   1   3    GLN   HB2    H   -3.448    -0.161    1.815     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7378    .   1   1   3    GLN   HB3    H   -3.030    -0.080    3.503     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7379    .   1   1   3    GLN   HE21   H   -3.526    -2.165    5.250     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HE21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7380    .   1   1   3    GLN   HE22   H   -4.905    -2.042    6.281     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HE22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7381    .   1   1   3    GLN   HG2    H   -5.247    -1.692    2.279     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7382    .   1   1   3    GLN   HG3    H   -3.759    -2.290    3.000     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7383    .   1   1   3    GLN   N      N   -5.970    0.976     2.228     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7384    .   1   1   3    GLN   NE2    N   -4.482    -1.977    5.400     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   NE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7385    .   1   1   3    GLN   O      O   -3.838    2.617     1.458     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7386    .   1   1   3    GLN   OE1    O   -6.404    -1.352    4.509     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   OE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7387    .   1   1   4    LYS   C      C   -1.327    3.990     3.481     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7388    .   1   1   4    LYS   CA     C   -2.828    4.242     3.448     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7389    .   1   1   4    LYS   CB     C   -3.189    5.242     4.549     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7390    .   1   1   4    LYS   CD     C   -4.944    6.557     5.740     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7391    .   1   1   4    LYS   CE     C   -6.422    6.864     5.831     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7392    .   1   1   4    LYS   CG     C   -4.661    5.578     4.624     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7393    .   1   1   4    LYS   H      H   -3.744    2.692     4.542     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7394    .   1   1   4    LYS   HA     H   -3.110    4.666     2.497     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7395    .   1   1   4    LYS   HB2    H   -2.891    4.826     5.501     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7396    .   1   1   4    LYS   HB3    H   -2.637    6.155     4.381     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7397    .   1   1   4    LYS   HD2    H   -4.618    6.124     6.674     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7398    .   1   1   4    LYS   HD3    H   -4.402    7.474     5.556     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7399    .   1   1   4    LYS   HE2    H   -6.754    7.268     4.886     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7400    .   1   1   4    LYS   HE3    H   -6.957    5.948     6.035     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7401    .   1   1   4    LYS   HG2    H   -4.963    6.027     3.689     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7402    .   1   1   4    LYS   HG3    H   -5.224    4.673     4.793     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7403    .   1   1   4    LYS   HZ1    H   -6.225    8.735     6.704     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7404    .   1   1   4    LYS   HZ2    H   -6.435    7.479     7.827     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7405    .   1   1   4    LYS   HZ3    H   -7.738    8.028     6.905     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7406    .   1   1   4    LYS   N      N   -3.558    3.014     3.637     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7407    .   1   1   4    LYS   NZ     N   -6.716    7.839     6.893     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7408    .   1   1   4    LYS   O      O   -0.879    2.893     3.785     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7409    .   1   1   5    TRP   C      C   1.440     4.694     4.667     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7410    .   1   1   5    TRP   CA     C   0.910     5.041     3.262     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7411    .   1   1   5    TRP   CB     C   1.427     6.435     2.829     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7412    .   1   1   5    TRP   CD1    C   1.532     8.140     4.765     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7413    .   1   1   5    TRP   CD2    C   -0.346    8.257     3.549     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7414    .   1   1   5    TRP   CE2    C   -0.416    9.216     4.578     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7415    .   1   1   5    TRP   CE3    C   -1.417    8.151     2.656     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7416    .   1   1   5    TRP   CG     C   0.910     7.572     3.688     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7417    .   1   1   5    TRP   CH2    C   -2.539    9.922     3.847     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7418    .   1   1   5    TRP   CZ2    C   -1.510    10.054    4.736     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7419    .   1   1   5    TRP   CZ3    C   -2.499    8.985     2.817     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7420    .   1   1   5    TRP   H      H   -1.023    5.888     3.034     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7421    .   1   1   5    TRP   HA     H   1.258     4.303     2.556     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7422    .   1   1   5    TRP   HB2    H   2.505     6.446     2.892     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7423    .   1   1   5    TRP   HB3    H   1.124     6.622     1.809     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7424    .   1   1   5    TRP   HD1    H   2.504     7.840     5.129     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7425    .   1   1   5    TRP   HE1    H   0.969     9.678     6.087     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7426    .   1   1   5    TRP   HE3    H   -1.410    7.439     1.845     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7427    .   1   1   5    TRP   HH2    H   -3.412    10.552    3.931     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7428    .   1   1   5    TRP   HZ2    H   -1.563    10.789    5.527     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7429    .   1   1   5    TRP   HZ3    H   -3.337    8.919     2.139     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7430    .   1   1   5    TRP   N      N   -0.568    5.047     3.246     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7431    .   1   1   5    TRP   NE1    N   0.738     9.126     5.303     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   NE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7432    .   1   1   5    TRP   O      O   2.559     4.232     4.840     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7433    .   1   1   6    MET   C      C   0.623     3.191     7.356     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7434    .   1   1   6    MET   CA     C   0.893     4.667     7.043     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7435    .   1   1   6    MET   CB     C   -0.033    5.548     7.896     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7436    .   1   1   6    MET   CE     C   -0.681    7.820     10.060    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7437    .   1   1   6    MET   CG     C   -0.049    5.212     9.377     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7438    .   1   1   6    MET   H      H   -0.241    5.367     5.408     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7439    .   1   1   6    MET   HA     H   1.917     4.925     7.262     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7440    .   1   1   6    MET   HB2    H   0.294     6.571     7.793     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7441    .   1   1   6    MET   HB3    H   -1.041    5.472     7.513     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7442    .   1   1   6    MET   HE1    H   -1.329    8.504     10.585    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7443    .   1   1   6    MET   HE2    H   -0.690    8.058     9.007     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7444    .   1   1   6    MET   HE3    H   0.324     7.906     10.444    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7445    .   1   1   6    MET   HG2    H   -0.263    4.158     9.486     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7446    .   1   1   6    MET   HG3    H   0.933     5.416     9.766     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7447    .   1   1   6    MET   N      N   0.610     4.948     5.646     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7448    .   1   1   6    MET   O      O   1.169     2.616     8.298     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7449    .   1   1   6    MET   SD     S   -1.278    6.155     10.304    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   SD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7450    .   1   1   7    TRP   C      C   0.131     0.236     6.011     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7451    .   1   1   7    TRP   CA     C   -0.701    1.265     6.757     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7452    .   1   1   7    TRP   CB     C   -2.182    1.189     6.297     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7453    .   1   1   7    TRP   CD1    C   -2.825    3.241     7.741     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7454    .   1   1   7    TRP   CD2    C   -4.562    2.012     7.086     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7455    .   1   1   7    TRP   CE2    C   -5.033    3.092     7.857     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7456    .   1   1   7    TRP   CE3    C   -5.483    1.114     6.568     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7457    .   1   1   7    TRP   CG     C   -3.136    2.118     7.029     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7458    .   1   1   7    TRP   CH2    C   -7.257    2.393     7.592     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7459    .   1   1   7    TRP   CZ2    C   -6.380    3.291     8.118     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7460    .   1   1   7    TRP   CZ3    C   -6.818    1.312     6.822     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7461    .   1   1   7    TRP   H      H   -0.401    3.050     5.693     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7462    .   1   1   7    TRP   HA     H   -0.661    1.060     7.816     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7463    .   1   1   7    TRP   HB2    H   -2.228    1.446     5.249     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7464    .   1   1   7    TRP   HB3    H   -2.537    0.177     6.421     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7465    .   1   1   7    TRP   HD1    H   -1.814    3.593     7.886     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7466    .   1   1   7    TRP   HE1    H   -3.992    4.633     8.796     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7467    .   1   1   7    TRP   HE3    H   -5.171    0.267     5.972     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7468    .   1   1   7    TRP   HH2    H   -8.316    2.508     7.768     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7469    .   1   1   7    TRP   HZ2    H   -6.739    4.120     8.708     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7470    .   1   1   7    TRP   HZ3    H   -7.540    0.618     6.417     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7471    .   1   1   7    TRP   N      N   -0.181    2.597     6.533     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7472    .   1   1   7    TRP   NE1    N   -3.952    3.818     8.246     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   NE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7473    .   1   1   7    TRP   O      O   1.168     0.566     5.401     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7474    .   1   1   8    THR   C      C   -0.681    -2.842    4.607     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7475    .   1   1   8    THR   CA     C   0.373     -2.085    5.416     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7476    .   1   1   8    THR   CB     C   1.007     -3.039    6.461     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7477    .   1   1   8    THR   CG2    C   2.007     -2.300    7.352     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   CG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7478    .   1   1   8    THR   H      H   -1.079    -1.215    6.620     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7479    .   1   1   8    THR   HA     H   1.135     -1.686    4.768     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7480    .   1   1   8    THR   HB     H   1.521     -3.828    5.933     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7481    .   1   1   8    THR   HG1    H   -0.306    -4.433    6.893     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HG1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7482    .   1   1   8    THR   HG21   H   1.493     -1.518    7.891     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HG21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7483    .   1   1   8    THR   HG22   H   2.784     -1.857    6.746     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HG22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7484    .   1   1   8    THR   HG23   H   2.446     -2.995    8.052     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HG23   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7485    .   1   1   8    THR   N      N   -0.287    -0.995    6.083     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7486    .   1   1   8    THR   O      O   -1.878    -2.593    4.799     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7487    .   1   1   8    THR   OG1    O   -0.021    -3.601    7.295     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   OG1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7488    .   1   1   9    CYS   C      C   -1.029    -5.956    2.969     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7489    .   1   1   9    CYS   CA     C   -1.329    -4.478    3.017     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7490    .   1   1   9    CYS   CB     C   -1.605    -3.903    1.632     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7491    .   1   1   9    CYS   H      H   0.639     -3.950    3.467     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7492    .   1   1   9    CYS   HA     H   -2.221    -4.360    3.615     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7493    .   1   1   9    CYS   HB2    H   -2.371    -4.490    1.148     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7494    .   1   1   9    CYS   HB3    H   -1.953    -2.887    1.741     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7495    .   1   1   9    CYS   N      N   -0.297    -3.743    3.708     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7496    .   1   1   9    CYS   O      O   -0.008    -6.422    3.527     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7497    .   1   1   9    CYS   SG     S   -0.173    -3.880    0.545     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7498    .   1   1   10   ASP   C      C   -2.662    -8.500    1.016     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7499    .   1   1   10   ASP   CA     C   -1.843    -8.126    2.249     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7500    .   1   1   10   ASP   CB     C   -2.462    -8.710    3.541     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7501    .   1   1   10   ASP   CG     C   -2.297    -10.199   3.687     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7502    .   1   1   10   ASP   H      H   -2.647    -6.273    1.833     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7503    .   1   1   10   ASP   HA     H   -0.816    -8.441    2.140     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7504    .   1   1   10   ASP   HB2    H   -1.996    -8.241    4.394     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7505    .   1   1   10   ASP   HB3    H   -3.518    -8.477    3.550     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7506    .   1   1   10   ASP   N      N   -1.906    -6.689    2.330     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7507    .   1   1   10   ASP   O      O   -2.968    -7.620    0.224     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7508    .   1   1   10   ASP   OD1    O   -3.165    -10.942   3.215     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   OD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7509    .   1   1   10   ASP   OD2    O   -1.294    -10.648   4.284     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   OD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7510    .   1   1   11   SER   C      C   -5.299    -9.823    0.059     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7511    .   1   1   11   SER   CA     C   -3.842    -10.148   -0.266    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7512    .   1   1   11   SER   CB     C   -3.676    -11.639   -0.505    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7513    .   1   1   11   SER   H      H   -2.770    -10.424   1.514     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7514    .   1   1   11   SER   HA     H   -3.532    -9.600    -1.143    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7515    .   1   1   11   SER   HB2    H   -4.073    -12.178   0.342     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7516    .   1   1   11   SER   HB3    H   -4.204    -11.925   -1.402    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7517    .   1   1   11   SER   HG     H   -1.801    -11.154   -0.770    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   HG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7518    .   1   1   11   SER   N      N   -3.027    -9.743    0.847     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7519    .   1   1   11   SER   O      O   -6.124    -9.611    -0.830    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7520    .   1   1   11   SER   OG     O   -2.305    -11.972   -0.649    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   OG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7521    .   1   1   12   GLU   C      C   -7.042    -7.921    1.885     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7522    .   1   1   12   GLU   CA     C   -6.912    -9.441    1.823     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7523    .   1   1   12   GLU   CB     C   -7.174    -10.060   3.190     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7524    .   1   1   12   GLU   CD     C   -7.362    -12.157   4.549     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7525    .   1   1   12   GLU   CG     C   -7.073    -11.569   3.201     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7526    .   1   1   12   GLU   H      H   -4.891    -10.039   1.991     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7527    .   1   1   12   GLU   HA     H   -7.629    -9.824    1.112     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7528    .   1   1   12   GLU   HB2    H   -6.461    -9.667    3.898     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7529    .   1   1   12   GLU   HB3    H   -8.171    -9.790    3.505     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7530    .   1   1   12   GLU   HG2    H   -7.786    -11.972   2.498     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7531    .   1   1   12   GLU   HG3    H   -6.074    -11.855   2.902     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7532    .   1   1   12   GLU   N      N   -5.595    -9.793    1.352     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7533    .   1   1   12   GLU   O      O   -7.915    -7.336    1.240     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7534    .   1   1   12   GLU   OE1    O   -6.454    -12.213   5.390     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   OE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7535    .   1   1   12   GLU   OE2    O   -8.497    -12.610   4.788     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   OE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7536    .   1   1   13   ARG   C      C   -5.630    -5.233    1.457     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7537    .   1   1   13   ARG   CA     C   -6.142    -5.829    2.745     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7538    .   1   1   13   ARG   CB     C   -5.252    -5.372    3.902     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7539    .   1   1   13   ARG   CD     C   -6.955    -4.735    5.674     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7540    .   1   1   13   ARG   CG     C   -5.781    -5.640    5.301     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7541    .   1   1   13   ARG   CZ     C   -9.276    -4.286    4.901     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   CZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7542    .   1   1   13   ARG   H      H   -5.493    -7.813    3.129     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7543    .   1   1   13   ARG   HA     H   -7.152    -5.488    2.919     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7544    .   1   1   13   ARG   HB2    H   -4.315    -5.899    3.816     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7545    .   1   1   13   ARG   HB3    H   -5.068    -4.311    3.801     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7546    .   1   1   13   ARG   HD2    H   -7.143    -4.822    6.734     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7547    .   1   1   13   ARG   HD3    H   -6.682    -3.715    5.450     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7548    .   1   1   13   ARG   HE     H   -8.184    -5.943    4.513     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7549    .   1   1   13   ARG   HG2    H   -6.134    -6.660    5.313     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7550    .   1   1   13   ARG   HG3    H   -4.981    -5.512    6.013     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7551    .   1   1   13   ARG   HH11   H   -8.498    -2.722    5.981     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HH11   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7552    .   1   1   13   ARG   HH12   H   -10.101   -2.502    5.459     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HH12   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7553    .   1   1   13   ARG   HH21   H   -10.398   -5.619    3.832     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HH21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7554    .   1   1   13   ARG   HH22   H   -11.184   -4.149    4.198     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HH22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7555    .   1   1   13   ARG   N      N   -6.160    -7.285    2.642     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7556    .   1   1   13   ARG   NE     N   -8.184    -5.063    4.954     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   NE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7557    .   1   1   13   ARG   NH1    N   -9.288    -3.089    5.485     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   NH1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7558    .   1   1   13   ARG   NH2    N   -10.358   -4.717    4.274     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   NH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7559    .   1   1   13   ARG   O      O   -4.452    -5.379    1.127     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7560    .   1   1   14   LYS   C      C   -5.578    -2.596    -0.362    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7561    .   1   1   14   LYS   CA     C   -6.133    -3.992    -0.527    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7562    .   1   1   14   LYS   CB     C   -7.273    -4.019    -1.585    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7563    .   1   1   14   LYS   CD     C   -9.474    -4.051    -0.290    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7564    .   1   1   14   LYS   CE     C   -10.785   -3.318    -0.073    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7565    .   1   1   14   LYS   CG     C   -8.580    -3.285    -1.251    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7566    .   1   1   14   LYS   H      H   -7.381    -4.428    1.141     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7567    .   1   1   14   LYS   HA     H   -5.317    -4.600    -0.889    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7568    .   1   1   14   LYS   HB2    H   -6.890    -3.571    -2.488    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7569    .   1   1   14   LYS   HB3    H   -7.510    -5.051    -1.797    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7570    .   1   1   14   LYS   HD2    H   -9.685    -5.026    -0.705    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7571    .   1   1   14   LYS   HD3    H   -8.978    -4.164    0.661     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7572    .   1   1   14   LYS   HE2    H   -10.572   -2.352    0.360     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7573    .   1   1   14   LYS   HE3    H   -11.268   -3.180    -1.030    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7574    .   1   1   14   LYS   HG2    H   -8.336    -2.333    -0.803    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7575    .   1   1   14   LYS   HG3    H   -9.120    -3.115    -2.171    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7576    .   1   1   14   LYS   HZ1    H   -11.892   -5.008    0.466     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7577    .   1   1   14   LYS   HZ2    H   -12.598   -3.547    0.922     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7578    .   1   1   14   LYS   HZ3    H   -11.285   -4.143    1.778     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7579    .   1   1   14   LYS   N      N   -6.493    -4.565    0.750     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7580    .   1   1   14   LYS   NZ     N   -11.695   -4.053    0.826     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7581    .   1   1   14   LYS   O      O   -6.150    -1.762    0.356     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7582    .   1   1   15   CYS   C      C   -4.313    -0.188    -2.022    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7583    .   1   1   15   CYS   CA     C   -3.817    -1.085    -0.894    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7584    .   1   1   15   CYS   CB     C   -2.299    -1.290    -0.951    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7585    .   1   1   15   CYS   H      H   -4.102    -3.036    -1.592    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7586    .   1   1   15   CYS   HA     H   -4.090    -0.640    0.050     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7587    .   1   1   15   CYS   HB2    H   -2.037    -2.155    -0.360    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7588    .   1   1   15   CYS   HB3    H   -2.009    -1.468    -1.975    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7589    .   1   1   15   CYS   N      N   -4.478    -2.350    -1.000    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7590    .   1   1   15   CYS   O      O   -4.831    -0.688    -3.042    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7591    .   1   1   15   CYS   SG     S   -1.316    0.105     -0.334    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7592    .   1   1   16   CYS   C      C   -3.869    2.058     -4.109    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7593    .   1   1   16   CYS   CA     C   -4.709    2.038     -2.836    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7594    .   1   1   16   CYS   CB     C   -4.794    3.444     -2.243    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7595    .   1   1   16   CYS   H      H   -3.739    1.457     -1.062    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7596    .   1   1   16   CYS   HA     H   -5.708    1.720     -3.091    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7597    .   1   1   16   CYS   HB2    H   -3.814    3.729     -1.891    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7598    .   1   1   16   CYS   HB3    H   -5.097    4.132     -3.021    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7599    .   1   1   16   CYS   N      N   -4.194    1.102     -1.857    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7600    .   1   1   16   CYS   O      O   -2.658    1.789     -4.087    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7601    .   1   1   16   CYS   SG     S   -5.953    3.647     -0.833    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7602    .   1   1   17   LYS   C      C   -3.043    3.786     -6.404    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7603    .   1   1   17   LYS   CA     C   -3.821    2.492     -6.469    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7604    .   1   1   17   LYS   CB     C   -4.784    2.470     -7.657    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7605    .   1   1   17   LYS   CD     C   -6.437    1.150     -9.019    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7606    .   1   1   17   LYS   CE     C   -7.133    -0.189    -9.182    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7607    .   1   1   17   LYS   CG     C   -5.510    1.142     -7.819    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7608    .   1   1   17   LYS   H      H   -5.489    2.468     -5.197    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7609    .   1   1   17   LYS   HA     H   -3.122    1.672     -6.544    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7610    .   1   1   17   LYS   HB2    H   -5.520    3.246     -7.519    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7611    .   1   1   17   LYS   HB3    H   -4.228    2.666     -8.562    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7612    .   1   1   17   LYS   HD2    H   -7.183    1.920     -8.885    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7613    .   1   1   17   LYS   HD3    H   -5.854    1.357     -9.903    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7614    .   1   1   17   LYS   HE2    H   -6.384    -0.957    -9.308    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7615    .   1   1   17   LYS   HE3    H   -7.702    -0.391    -8.288    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7616    .   1   1   17   LYS   HG2    H   -4.781    0.355     -7.947    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7617    .   1   1   17   LYS   HG3    H   -6.089    0.954     -6.926    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7618    .   1   1   17   LYS   HZ1    H   -8.792    0.500     -10.286   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7619    .   1   1   17   LYS   HZ2    H   -8.487    -1.154    -10.410   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7620    .   1   1   17   LYS   HZ3    H   -7.511    -0.074    -11.232   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7621    .   1   1   17   LYS   N      N   -4.516    2.340     -5.224    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7622    .   1   1   17   LYS   NZ     N   -8.041    -0.216    -10.349   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7623    .   1   1   17   LYS   O      O   -3.579    4.833     -6.002    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7624    .   1   1   18   GLY   C      C   0.012     4.520     -5.446    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7625    .   1   1   18   GLY   CA     C   -0.929    4.833     -6.576    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7626    .   1   1   18   GLY   H      H   -1.464    2.898     -7.171    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7627    .   1   1   18   GLY   HA2    H   -0.374    5.016     -7.485    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   HA2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7628    .   1   1   18   GLY   HA3    H   -1.507    5.708     -6.318    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   HA3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7629    .   1   1   18   GLY   N      N   -1.808    3.720     -6.761    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7630    .   1   1   18   GLY   O      O   0.804     5.349     -5.023    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7631    .   1   1   19   MET   C      C   1.143     1.419     -4.319    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7632    .   1   1   19   MET   CA     C   0.724     2.792     -3.891    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7633    .   1   1   19   MET   CB     C   -0.010    2.682     -2.548    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7634    .   1   1   19   MET   CE     C   -1.913    5.476     -0.163    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7635    .   1   1   19   MET   CG     C   -0.493    3.991     -1.976    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7636    .   1   1   19   MET   H      H   -0.860    2.738     -5.223    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7637    .   1   1   19   MET   HA     H   1.592     3.422     -3.786    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7638    .   1   1   19   MET   HB2    H   -0.871    2.043     -2.679    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7639    .   1   1   19   MET   HB3    H   0.653     2.222     -1.830    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7640    .   1   1   19   MET   HE1    H   -2.513    5.534     0.733     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7641    .   1   1   19   MET   HE2    H   -2.483    5.850     -1.000    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7642    .   1   1   19   MET   HE3    H   -1.021    6.073     -0.038    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7643    .   1   1   19   MET   HG2    H   0.383     4.564     -1.711    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7644    .   1   1   19   MET   HG3    H   -1.084    4.518     -2.709    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7645    .   1   1   19   MET   N      N   -0.131    3.322     -4.920    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7646    .   1   1   19   MET   O      O   0.480     0.803     -5.157    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7647    .   1   1   19   MET   SD     S   -1.451    3.785     -0.475    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   SD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7648    .   1   1   20   VAL   C      C   2.343     -1.241    -2.873    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7649    .   1   1   20   VAL   CA     C   2.653     -0.384    -4.071    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7650    .   1   1   20   VAL   CB     C   4.177     -0.425    -4.386    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7651    .   1   1   20   VAL   CG1    C   4.637     -1.845    -4.695    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   CG1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7652    .   1   1   20   VAL   CG2    C   4.503     0.493     -5.558    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   CG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7653    .   1   1   20   VAL   H      H   2.713     1.484     -3.126    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7654    .   1   1   20   VAL   HA     H   2.096     -0.746    -4.923    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7655    .   1   1   20   VAL   HB     H   4.716     -0.071    -3.519    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7656    .   1   1   20   VAL   HG11   H   4.444     -2.480    -3.841    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG11   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7657    .   1   1   20   VAL   HG12   H   5.693     -1.842    -4.914    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG12   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7658    .   1   1   20   VAL   HG13   H   4.094     -2.220    -5.550    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG13   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7659    .   1   1   20   VAL   HG21   H   5.565     0.470     -5.749    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7660    .   1   1   20   VAL   HG22   H   4.197     1.502     -5.324    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7661    .   1   1   20   VAL   HG23   H   3.973     0.154     -6.436    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG23   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7662    .   1   1   20   VAL   N      N   2.204     0.938     -3.773    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7663    .   1   1   20   VAL   O      O   2.704     -0.888    -1.738    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7664    .   1   1   21   CYS   C      C   2.409     -4.099    -1.718    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7665    .   1   1   21   CYS   CA     C   1.240     -3.196    -2.056    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7666    .   1   1   21   CYS   CB     C   0.009     -4.018    -2.461    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7667    .   1   1   21   CYS   H      H   1.395     -2.534    -4.033    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7668    .   1   1   21   CYS   HA     H   1.002     -2.596    -1.190    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7669    .   1   1   21   CYS   HB2    H   -0.745    -3.354    -2.855    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7670    .   1   1   21   CYS   HB3    H   0.294     -4.728    -3.223    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7671    .   1   1   21   CYS   N      N   1.635     -2.313    -3.108    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7672    .   1   1   21   CYS   O      O   3.098     -4.597    -2.621    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7673    .   1   1   21   CYS   SG     S   -0.740    -4.952    -1.081    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7674    .   1   1   22   ARG   C      C   3.472     -5.261    1.552     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7675    .   1   1   22   ARG   CA     C   3.746     -5.018    0.061     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7676    .   1   1   22   ARG   CB     C   4.986     -4.139    -0.152    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7677    .   1   1   22   ARG   CD     C   7.369     -3.924    -0.660    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7678    .   1   1   22   ARG   CG     C   6.316     -4.847    -0.126    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7679    .   1   1   22   ARG   CZ     C   9.775     -3.975    -1.226    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   CZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7680    .   1   1   22   ARG   H      H   2.018     -3.919    0.231     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7681    .   1   1   22   ARG   HA     H   3.865     -5.946    -0.477    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7682    .   1   1   22   ARG   HB2    H   4.893     -3.649    -1.108    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7683    .   1   1   22   ARG   HB3    H   4.992     -3.380    0.616     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7684    .   1   1   22   ARG   HD2    H   7.076     -3.630    -1.657    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7685    .   1   1   22   ARG   HD3    H   7.403     -3.055    -0.021    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7686    .   1   1   22   ARG   HE     H   8.736     -5.454    -0.338    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7687    .   1   1   22   ARG   HG2    H   6.563     -5.115    0.891     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7688    .   1   1   22   ARG   HG3    H   6.272     -5.733    -0.743    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7689    .   1   1   22   ARG   HH11   H   8.862     -2.227    -1.786    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HH11   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7690    .   1   1   22   ARG   HH12   H   10.516    -2.331    -2.170    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HH12   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7691    .   1   1   22   ARG   HH21   H   11.022    -5.552    -0.850    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HH21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7692    .   1   1   22   ARG   HH22   H   11.760    -4.221    -1.596    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HH22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7693    .   1   1   22   ARG   N      N   2.640     -4.285    -0.438    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7694    .   1   1   22   ARG   NE     N   8.685     -4.546    -0.712    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   NE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7695    .   1   1   22   ARG   NH1    N   9.712     -2.761    -1.754    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   NH1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7696    .   1   1   22   ARG   NH2    N   10.918    -4.625    -1.223    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   NH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7697    .   1   1   22   ARG   O      O   2.315     -5.010    2.035     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7698    .   1   1   23   LEU   C      C   3.933     -4.621    4.426     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7699    .   1   1   23   LEU   CA     C   4.399     -5.903    3.760     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7700    .   1   1   23   LEU   CB     C   5.729     -6.367    4.410     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7701    .   1   1   23   LEU   CD1    C   6.774     -7.869    2.660     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7702    .   1   1   23   LEU   CD2    C   7.308     -8.223    5.069     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7703    .   1   1   23   LEU   CG     C   6.249     -7.780    4.073     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7704    .   1   1   23   LEU   H      H   5.343     -5.937    1.859     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7705    .   1   1   23   LEU   HA     H   3.642     -6.655    3.924     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7706    .   1   1   23   LEU   HB2    H   6.496     -5.666    4.120     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7707    .   1   1   23   LEU   HB3    H   5.608     -6.302    5.482     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7708    .   1   1   23   LEU   HD11   H   7.576     -7.158    2.532     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD11   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7709    .   1   1   23   LEU   HD12   H   5.977     -7.648    1.965     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD12   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7710    .   1   1   23   LEU   HD13   H   7.146     -8.866    2.476     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD13   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7711    .   1   1   23   LEU   HD21   H   8.142     -7.539    5.044     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7712    .   1   1   23   LEU   HD22   H   7.649     -9.214    4.809     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7713    .   1   1   23   LEU   HD23   H   6.885     -8.240    6.062     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD23   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7714    .   1   1   23   LEU   HG     H   5.421     -8.466    4.148     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7715    .   1   1   23   LEU   N      N   4.501     -5.710    2.302     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7716    .   1   1   23   LEU   O      O   3.370     -4.651    5.514     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7717    .   1   1   24   TRP   C      C   3.193     -1.525    2.895     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7718    .   1   1   24   TRP   CA     C   3.691     -2.231    4.164     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7719    .   1   1   24   TRP   CB     C   4.810     -1.420    4.848     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7720    .   1   1   24   TRP   CD1    C   5.846     0.499     3.541     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7721    .   1   1   24   TRP   CD2    C   6.947     -1.419    3.275     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7722    .   1   1   24   TRP   CE2    C   7.591     -0.419    2.520     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7723    .   1   1   24   TRP   CE3    C   7.469     -2.707    3.258     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7724    .   1   1   24   TRP   CG     C   5.824     -0.796    3.923     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7725    .   1   1   24   TRP   CH2    C   9.213     -1.941    1.765     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7726    .   1   1   24   TRP   CZ2    C   8.724     -0.671    1.761     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7727    .   1   1   24   TRP   CZ3    C   8.598     -2.956    2.503     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7728    .   1   1   24   TRP   H      H   4.653     -3.543    2.907     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7729    .   1   1   24   TRP   HA     H   2.876     -2.402    4.848     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7730    .   1   1   24   TRP   HB2    H   4.356     -0.617    5.407     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7731    .   1   1   24   TRP   HB3    H   5.335     -2.067    5.535     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7732    .   1   1   24   TRP   HD1    H   5.108     1.214     3.878     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7733    .   1   1   24   TRP   HE1    H   7.127     1.602     2.296     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7734    .   1   1   24   TRP   HE3    H   7.005     -3.500    3.825     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7735    .   1   1   24   TRP   HH2    H   10.094    -2.181    1.187     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7736    .   1   1   24   TRP   HZ2    H   9.212     0.101     1.183     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7737    .   1   1   24   TRP   HZ3    H   9.021     -3.948    2.476     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7738    .   1   1   24   TRP   N      N   4.164     -3.509    3.755     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7739    .   1   1   24   TRP   NE1    N   6.900     0.736     2.700     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   NE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7740    .   1   1   24   TRP   O      O   3.531     -1.964    1.798     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7741    .   1   1   25   CYS   C      C   2.887     1.396     1.594     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7742    .   1   1   25   CYS   CA     C   1.966     0.248     1.848     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7743    .   1   1   25   CYS   CB     C   0.531     0.744     1.955     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7744    .   1   1   25   CYS   H      H   2.091     -0.182    3.901     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7745    .   1   1   25   CYS   HA     H   2.040     -0.427    1.009     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7746    .   1   1   25   CYS   HB2    H   0.341     1.058     2.972     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7747    .   1   1   25   CYS   HB3    H   0.401     1.590     1.296     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7748    .   1   1   25   CYS   N      N   2.395     -0.497    3.021     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7749    .   1   1   25   CYS   O      O   3.232     2.148     2.512     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7750    .   1   1   25   CYS   SG     S   -0.723    -0.490    1.526     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7751    .   1   1   26   LYS   C      C   3.684     3.315     -1.178    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7752    .   1   1   26   LYS   CA     C   4.199     2.586     0.026     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7753    .   1   1   26   LYS   CB     C   5.597     2.050     -0.226    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7754    .   1   1   26   LYS   CD     C   7.988     2.629     -0.618    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7755    .   1   1   26   LYS   CE     C   8.943     3.764     -0.883    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7756    .   1   1   26   LYS   CG     C   6.577     3.139     -0.556    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7757    .   1   1   26   LYS   H      H   3.001     0.916     -0.326    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7758    .   1   1   26   LYS   HA     H   4.236     3.266     0.863     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7759    .   1   1   26   LYS   HB2    H   5.940     1.532     0.657     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7760    .   1   1   26   LYS   HB3    H   5.565     1.358     -1.055    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7761    .   1   1   26   LYS   HD2    H   8.238     2.162     0.323     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7762    .   1   1   26   LYS   HD3    H   8.069     1.906     -1.415    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7763    .   1   1   26   LYS   HE2    H   8.726     4.189     -1.851    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7764    .   1   1   26   LYS   HE3    H   8.796     4.516     -0.123    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7765    .   1   1   26   LYS   HG2    H   6.311     3.563     -1.512    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7766    .   1   1   26   LYS   HG3    H   6.488     3.903     0.199     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7767    .   1   1   26   LYS   HZ1    H   10.569    2.941     0.089     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7768    .   1   1   26   LYS   HZ2    H   10.982    4.103     -1.062    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7769    .   1   1   26   LYS   HZ3    H   10.504    2.559     -1.547    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7770    .   1   1   26   LYS   N      N   3.310     1.534     0.373     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7771    .   1   1   26   LYS   NZ     N   10.338    3.317     -0.853    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7772    .   1   1   26   LYS   O      O   3.496     2.712     -2.234    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7773    .   1   1   27   LYS   C      C   3.916     5.599     -3.224    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7774    .   1   1   27   LYS   CA     C   2.914     5.391     -2.102    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7775    .   1   1   27   LYS   CB     C   2.340     6.705     -1.563    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7776    .   1   1   27   LYS   CD     C   2.690     8.738     -0.089    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7777    .   1   1   27   LYS   CE     C   1.655     9.573     -0.847    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7778    .   1   1   27   LYS   CG     C   3.359     7.662     -0.952    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7779    .   1   1   27   LYS   H      H   3.731     5.028     -0.191    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7780    .   1   1   27   LYS   HA     H   2.107     4.811     -2.521    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7781    .   1   1   27   LYS   HB2    H   1.845     7.212     -2.377    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7782    .   1   1   27   LYS   HB3    H   1.599     6.461     -0.818    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7783    .   1   1   27   LYS   HD2    H   2.195     8.256     0.741     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7784    .   1   1   27   LYS   HD3    H   3.459     9.392     0.293     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7785    .   1   1   27   LYS   HE2    H   0.895     8.911     -1.233    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7786    .   1   1   27   LYS   HE3    H   1.200     10.264    -0.153    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7787    .   1   1   27   LYS   HG2    H   4.051     7.101     -0.344    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7788    .   1   1   27   LYS   HG3    H   3.900     8.144     -1.754    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7789    .   1   1   27   LYS   HZ1    H   2.573     9.699     -2.730    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7790    .   1   1   27   LYS   HZ2    H   3.019     10.941    -1.674    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7791    .   1   1   27   LYS   HZ3    H   1.498     10.936    -2.381    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7792    .   1   1   27   LYS   N      N   3.474     4.598     -1.036    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7793    .   1   1   27   LYS   NZ     N   2.237     10.329    -1.976    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7794    .   1   1   27   LYS   O      O   5.129     5.702     -2.995    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7795    .   1   1   28   LYS   C      C   4.344     7.224     -5.837    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7796    .   1   1   28   LYS   CA     C   4.232     5.740     -5.599    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7797    .   1   1   28   LYS   CB     C   3.544     5.070     -6.808    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7798    .   1   1   28   LYS   CD     C   5.413     3.707     -7.811    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7799    .   1   1   28   LYS   CE     C   6.286     3.426     -9.035    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7800    .   1   1   28   LYS   CG     C   4.432     4.853     -8.038    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7801    .   1   1   28   LYS   H      H   2.443     5.502     -4.533    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7802    .   1   1   28   LYS   HA     H   5.205     5.306     -5.434    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7803    .   1   1   28   LYS   HB2    H   3.168     4.107     -6.496    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7804    .   1   1   28   LYS   HB3    H   2.705     5.683     -7.102    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7805    .   1   1   28   LYS   HD2    H   6.054     3.958     -6.980    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7806    .   1   1   28   LYS   HD3    H   4.852     2.817     -7.569    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7807    .   1   1   28   LYS   HE2    H   6.837     2.514     -8.868    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7808    .   1   1   28   LYS   HE3    H   5.640     3.294     -9.892    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7809    .   1   1   28   LYS   HG2    H   3.809     4.617     -8.887    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7810    .   1   1   28   LYS   HG3    H   4.987     5.758     -8.235    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7811    .   1   1   28   LYS   HZ1    H   6.817     5.428     -9.563    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7812    .   1   1   28   LYS   HZ2    H   7.837     4.244     -10.144   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7813    .   1   1   28   LYS   HZ3    H   7.896     4.645     -8.518    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7814    .   1   1   28   LYS   N      N   3.419     5.583     -4.422    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7815    .   1   1   28   LYS   NZ     N   7.254     4.511     -9.325    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7816    .   1   1   28   LYS   O      O   3.332     7.897     -6.023    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7817    .   1   1   29   LEU   C      C   5.468     9.542     -7.384    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7818    .   1   1   29   LEU   CA     C   5.754     9.161     -5.944    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7819    .   1   1   29   LEU   CB     C   7.192     9.518     -5.558    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7820    .   1   1   29   LEU   CD1    C   9.063     9.483     -3.878    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7821    .   1   1   29   LEU   CD2    C   6.702     9.652     -3.087    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7822    .   1   1   29   LEU   CG     C   7.627     9.081     -4.150    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7823    .   1   1   29   LEU   H      H   6.303     7.142     -5.623    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7824    .   1   1   29   LEU   HA     H   5.068     9.687     -5.298    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7825    .   1   1   29   LEU   HB2    H   7.855     9.062     -6.277    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7826    .   1   1   29   LEU   HB3    H   7.301     10.590    -5.624    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7827    .   1   1   29   LEU   HD11   H   9.712     9.015     -4.604    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD11   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7828    .   1   1   29   LEU   HD12   H   9.344     9.162     -2.885    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD12   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7829    .   1   1   29   LEU   HD13   H   9.158     10.556    -3.949    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD13   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7830    .   1   1   29   LEU   HD21   H   7.049     9.356     -2.109    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7831    .   1   1   29   LEU   HD22   H   5.703     9.270     -3.239    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7832    .   1   1   29   LEU   HD23   H   6.690     10.729    -3.158    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD23   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7833    .   1   1   29   LEU   HG     H   7.580     8.003     -4.095    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7834    .   1   1   29   LEU   N      N   5.537     7.738     -5.778    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7835    .   1   1   29   LEU   O      O   4.713     10.482    -7.671    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7836    .   1   1   30   TRP   C      C   5.986     7.589     -10.277   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7837    .   1   1   30   TRP   CA     C   5.847     8.948     -9.672    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7838    .   1   1   30   TRP   CB     C   6.879     9.925     -10.248   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7839    .   1   1   30   TRP   CD1    C   5.886     11.290    -12.163   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7840    .   1   1   30   TRP   CD2    C   7.253     9.657     -12.841   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7841    .   1   1   30   TRP   CE2    C   6.776     10.337    -13.975   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7842    .   1   1   30   TRP   CE3    C   8.134     8.589     -13.022   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7843    .   1   1   30   TRP   CG     C   6.666     10.284    -11.688   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7844    .   1   1   30   TRP   CH2    C   8.009     8.938     -15.412   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7845    .   1   1   30   TRP   CZ2    C   7.147     9.986     -15.267   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7846    .   1   1   30   TRP   CZ3    C   8.502     8.240     -14.305   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7847    .   1   1   30   TRP   H      H   6.595     8.033     -7.973    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7848    .   1   1   30   TRP   HA     H   4.847     9.315     -9.847    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7849    .   1   1   30   TRP   HB2    H   6.854     10.840    -9.677    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7850    .   1   1   30   TRP   HB3    H   7.859     9.486     -10.160   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7851    .   1   1   30   TRP   HD1    H   5.307     11.953    -11.537   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7852    .   1   1   30   TRP   HE1    H   5.474     11.968    -14.112   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7853    .   1   1   30   TRP   HE3    H   8.520     8.043     -12.175   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7854    .   1   1   30   TRP   HH2    H   8.322     8.631     -16.400   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7855    .   1   1   30   TRP   HZ2    H   6.777     10.513    -16.135   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7856    .   1   1   30   TRP   HZ3    H   9.183     7.416     -14.463   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7857    .   1   1   30   TRP   N      N   6.030     8.777     -8.270    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7858    .   1   1   30   TRP   NE1    N   5.944     11.324    -13.535   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   NE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7859    .   1   1   30   TRP   O      O   7.114     7.057     -10.276   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   15   .   7860    .   1   1   30   TRP   OXT    O   4.977     7.006     -10.688   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   OXT    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7861    .   1   1   1    TYR   C      C   -10.555   3.015     1.487     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7862    .   1   1   1    TYR   CA     C   -11.764   3.569     2.214     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7863    .   1   1   1    TYR   CB     C   -11.487   5.017     2.664     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7864    .   1   1   1    TYR   CD1    C   -12.562   5.530     4.885     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7865    .   1   1   1    TYR   CD2    C   -13.637   6.323     2.917     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7866    .   1   1   1    TYR   CE1    C   -13.544   6.085     5.655     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7867    .   1   1   1    TYR   CE2    C   -14.630   6.886     3.690     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7868    .   1   1   1    TYR   CG     C   -12.586   5.634     3.501     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7869    .   1   1   1    TYR   CZ     C   -14.574   6.762     5.062     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7870    .   1   1   1    TYR   H1     H   -12.892   3.067     3.873     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   H1     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7871    .   1   1   1    TYR   H2     H   -11.256   2.594     3.976     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   H2     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7872    .   1   1   1    TYR   H3     H   -12.317   1.773     2.974     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   H3     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7873    .   1   1   1    TYR   HA     H   -12.608   3.556     1.539     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7874    .   1   1   1    TYR   HB2    H   -10.577   5.043     3.242     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7875    .   1   1   1    TYR   HB3    H   -11.355   5.631     1.785     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7876    .   1   1   1    TYR   HD1    H   -11.755   5.003     5.370     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7877    .   1   1   1    TYR   HD2    H   -13.678   6.418     1.841     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7878    .   1   1   1    TYR   HE1    H   -13.501   5.988     6.731     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7879    .   1   1   1    TYR   HE2    H   -15.442   7.420     3.218     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7880    .   1   1   1    TYR   HH     H   -16.413   7.034     5.506     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HH     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7881    .   1   1   1    TYR   N      N   -12.073   2.713     3.345     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7882    .   1   1   1    TYR   O      O   -10.685   2.399     0.438     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7883    .   1   1   1    TYR   OH     O   -15.554   7.316     5.845     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   OH     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7884    .   1   1   2    CYS   C      C   -7.116    2.412     2.495     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7885    .   1   1   2    CYS   CA     C   -8.149    2.741     1.463     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7886    .   1   1   2    CYS   CB     C   -7.580    3.817     0.524     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7887    .   1   1   2    CYS   H      H   -9.303    3.576     2.972     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7888    .   1   1   2    CYS   HA     H   -8.370    1.866     0.873     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7889    .   1   1   2    CYS   HB2    H   -7.652    4.772     1.022     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7890    .   1   1   2    CYS   HB3    H   -6.540    3.599     0.327     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7891    .   1   1   2    CYS   N      N   -9.384    3.176     2.078     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7892    .   1   1   2    CYS   O      O   -7.094    3.014     3.566     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7893    .   1   1   2    CYS   SG     S   -8.435    3.975     -1.071    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7894    .   1   1   3    GLN   C      C   -4.053    2.110     2.616     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7895    .   1   1   3    GLN   CA     C   -5.146    1.145     3.010     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7896    .   1   1   3    GLN   CB     C   -4.676    -0.304    2.813     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7897    .   1   1   3    GLN   CD     C   -6.182    -1.363    4.577     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7898    .   1   1   3    GLN   CG     C   -5.722    -1.367    3.132     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7899    .   1   1   3    GLN   H      H   -6.435    0.926     1.370     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7900    .   1   1   3    GLN   HA     H   -5.431    1.310     4.038     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7901    .   1   1   3    GLN   HB2    H   -4.382    -0.431    1.783     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7902    .   1   1   3    GLN   HB3    H   -3.814    -0.478    3.441     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7903    .   1   1   3    GLN   HE21   H   -4.382    -0.857    5.196     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HE21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7904    .   1   1   3    GLN   HE22   H   -5.581    -1.003    6.420     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HE22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7905    .   1   1   3    GLN   HG2    H   -6.587    -1.201    2.505     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7906    .   1   1   3    GLN   HG3    H   -5.297    -2.332    2.901     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7907    .   1   1   3    GLN   N      N   -6.276    1.451     2.184     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7908    .   1   1   3    GLN   NE2    N   -5.297    -1.053    5.481     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   NE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7909    .   1   1   3    GLN   O      O   -3.547    2.064     1.489     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7910    .   1   1   3    GLN   OE1    O   -7.330    -1.703    4.877     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   OE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7911    .   1   1   4    LYS   C      C   -1.397    3.613     3.456     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7912    .   1   1   4    LYS   CA     C   -2.820    4.093     3.262     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7913    .   1   1   4    LYS   CB     C   -3.076    5.230     4.249     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7914    .   1   1   4    LYS   CD     C   -4.643    6.821     5.334     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7915    .   1   1   4    LYS   CE     C   -6.064    7.341     5.433     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7916    .   1   1   4    LYS   CG     C   -4.493    5.768     4.259     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7917    .   1   1   4    LYS   H      H   -4.214    2.982     4.376     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7918    .   1   1   4    LYS   HA     H   -2.957    4.474     2.263     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7919    .   1   1   4    LYS   HB2    H   -2.847    4.877     5.243     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7920    .   1   1   4    LYS   HB3    H   -2.406    6.045     4.011     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7921    .   1   1   4    LYS   HD2    H   -4.365    6.392     6.284     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7922    .   1   1   4    LYS   HD3    H   -3.980    7.642     5.103     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7923    .   1   1   4    LYS   HE2    H   -6.346    7.772     4.484     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7924    .   1   1   4    LYS   HE3    H   -6.722    6.516     5.663     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7925    .   1   1   4    LYS   HG2    H   -4.716    6.205     3.296     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7926    .   1   1   4    LYS   HG3    H   -5.178    4.957     4.460     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7927    .   1   1   4    LYS   HZ1    H   -7.177    8.678     6.579     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7928    .   1   1   4    LYS   HZ2    H   -5.619    9.210     6.265     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7929    .   1   1   4    LYS   HZ3    H   -5.881    7.995     7.405     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7930    .   1   1   4    LYS   N      N   -3.766    3.026     3.505     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7931    .   1   1   4    LYS   NZ     N   -6.190    8.368     6.486     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7932    .   1   1   4    LYS   O      O   -1.168    2.581     4.078     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7933    .   1   1   5    TRP   C      C   1.410     4.070     4.561     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7934    .   1   1   5    TRP   CA     C   1.001     4.214     3.094     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7935    .   1   1   5    TRP   CB     C   1.731     5.427     2.462     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7936    .   1   1   5    TRP   CD1    C   1.759     7.410     4.108     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7937    .   1   1   5    TRP   CD2    C   0.165     7.536     2.546     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7938    .   1   1   5    TRP   CE2    C   0.051     8.648     3.390     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7939    .   1   1   5    TRP   CE3    C   -0.731    7.404     1.482     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7940    .   1   1   5    TRP   CG     C   1.259     6.745     3.025     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7941    .   1   1   5    TRP   CH2    C   -1.780    9.463     2.162     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7942    .   1   1   5    TRP   CZ2    C   -0.919    9.616     3.212     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7943    .   1   1   5    TRP   CZ3    C   -1.692    8.371     1.300     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7944    .   1   1   5    TRP   H      H   -0.754    5.206     2.470     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7945    .   1   1   5    TRP   HA     H   1.275     3.322     2.551     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7946    .   1   1   5    TRP   HB2    H   2.791     5.345     2.649     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7947    .   1   1   5    TRP   HB3    H   1.554     5.435     1.396     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7948    .   1   1   5    TRP   HD1    H   2.596     7.067     4.698     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7949    .   1   1   5    TRP   HE1    H   1.171     9.194     5.066     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7950    .   1   1   5    TRP   HE3    H   -0.677    6.565     0.801     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7951    .   1   1   5    TRP   HH2    H   -2.547    10.199    1.980     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7952    .   1   1   5    TRP   HZ2    H   -1.001    10.468    3.871     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7953    .   1   1   5    TRP   HZ3    H   -2.391    8.285     0.481     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7954    .   1   1   5    TRP   N      N   -0.459    4.418     2.972     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7955    .   1   1   5    TRP   NE1    N   1.022     8.544     4.342     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   NE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7956    .   1   1   5    TRP   O      O   2.406     3.438     4.897     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7957    .   1   1   6    MET   C      C   0.587     3.244     7.408     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7958    .   1   1   6    MET   CA     C   0.781     4.658     6.848     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7959    .   1   1   6    MET   CB     C   -0.255    5.613     7.461     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7960    .   1   1   6    MET   CE     C   -1.294    6.526     11.385    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7961    .   1   1   6    MET   CG     C   -0.268    5.652     8.975     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7962    .   1   1   6    MET   H      H   -0.141    5.166     5.024     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7963    .   1   1   6    MET   HA     H   1.767     5.022     7.092     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7964    .   1   1   6    MET   HB2    H   -0.058    6.614     7.102     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7965    .   1   1   6    MET   HB3    H   -1.236    5.317     7.121     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7966    .   1   1   6    MET   HE1    H   -1.441    5.485     11.631    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7967    .   1   1   6    MET   HE2    H   -2.006    7.129     11.929    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7968    .   1   1   6    MET   HE3    H   -0.291    6.821     11.656    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7969    .   1   1   6    MET   HG2    H   -0.456    4.651     9.337     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7970    .   1   1   6    MET   HG3    H   0.704     5.976     9.312     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7971    .   1   1   6    MET   N      N   0.609     4.673     5.413     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7972    .   1   1   6    MET   O      O   1.160     2.879     8.432     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7973    .   1   1   6    MET   SD     S   -1.534    6.757     9.625     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   SD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7974    .   1   1   7    TRP   C      C   0.174     0.089     6.300     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7975    .   1   1   7    TRP   CA     C   -0.541    1.129     7.155     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7976    .   1   1   7    TRP   CB     C   -2.066    0.937     7.097     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7977    .   1   1   7    TRP   CD1    C   -2.443    2.596     9.026     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7978    .   1   1   7    TRP   CD2    C   -4.105    2.507     7.549     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7979    .   1   1   7    TRP   CE2    C   -4.428    3.461     8.526     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7980    .   1   1   7    TRP   CE3    C   -4.998    2.270     6.526     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7981    .   1   1   7    TRP   CG     C   -2.825    1.979     7.872     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7982    .   1   1   7    TRP   CH2    C   -6.478    3.918     7.473     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7983    .   1   1   7    TRP   CZ2    C   -5.615    4.176     8.497     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7984    .   1   1   7    TRP   CZ3    C   -6.179    2.974     6.494     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7985    .   1   1   7    TRP   H      H   -0.517    2.762     5.839     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7986    .   1   1   7    TRP   HA     H   -0.213    1.025     8.178     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7987    .   1   1   7    TRP   HB2    H   -2.379    1.012     6.066     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7988    .   1   1   7    TRP   HB3    H   -2.345    -0.036    7.471     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7989    .   1   1   7    TRP   HD1    H   -1.508    2.405     9.535     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7990    .   1   1   7    TRP   HE1    H   -3.342    4.084     10.204    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7991    .   1   1   7    TRP   HE3    H   -4.765    1.533     5.774     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7992    .   1   1   7    TRP   HH2    H   -7.416    4.447     7.412     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7993    .   1   1   7    TRP   HZ2    H   -5.860    4.912     9.247     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7994    .   1   1   7    TRP   HZ3    H   -6.889    2.799     5.698     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7995    .   1   1   7    TRP   N      N   -0.190    2.459     6.714     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7996    .   1   1   7    TRP   NE1    N   -3.393    3.507     9.410     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   NE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7997    .   1   1   7    TRP   O      O   1.100     0.420     5.538     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7998    .   1   1   8    THR   C      C   -0.664    -3.011    4.952     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   7999    .   1   1   8    THR   CA     C   0.413     -2.227    5.724     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8000    .   1   1   8    THR   CB     C   1.136     -3.149    6.745     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8001    .   1   1   8    THR   CG2    C   2.273     -2.408    7.445     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   CG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8002    .   1   1   8    THR   H      H   -0.961    -1.392    7.024     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8003    .   1   1   8    THR   HA     H   1.133     -1.790    5.053     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8004    .   1   1   8    THR   HB     H   1.538     -4.006    6.225     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8005    .   1   1   8    THR   HG1    H   0.157     -4.552    7.675     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HG1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8006    .   1   1   8    THR   HG21   H   3.005     -2.066    6.728     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HG21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8007    .   1   1   8    THR   HG22   H   2.756     -3.060    8.156     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HG22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8008    .   1   1   8    THR   HG23   H   1.865     -1.554    7.964     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HG23   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8009    .   1   1   8    THR   N      N   -0.215    -1.148    6.435     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8010    .   1   1   8    THR   O      O   -1.861    -2.846    5.250     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8011    .   1   1   8    THR   OG1    O   0.202     -3.591    7.755     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   OG1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8012    .   1   1   9    CYS   C      C   -0.994    -6.058    3.265     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8013    .   1   1   9    CYS   CA     C   -1.342    -4.589    3.297     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8014    .   1   1   9    CYS   CB     C   -1.599    -4.071    1.888     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8015    .   1   1   9    CYS   H      H   0.625     -3.972    3.627     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8016    .   1   1   9    CYS   HA     H   -2.242    -4.467    3.882     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8017    .   1   1   9    CYS   HB2    H   -2.499    -4.525    1.502     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8018    .   1   1   9    CYS   HB3    H   -1.734    -3.000    1.927     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8019    .   1   1   9    CYS   N      N   -0.296    -3.837    3.958     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8020    .   1   1   9    CYS   O      O   0.085     -6.459    3.748     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8021    .   1   1   9    CYS   SG     S   -0.274    -4.416    0.717     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8022    .   1   1   10   ASP   C      C   -2.428    -8.656    1.310     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8023    .   1   1   10   ASP   CA     C   -1.695    -8.278    2.589     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8024    .   1   1   10   ASP   CB     C   -2.307    -8.974    3.801     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8025    .   1   1   10   ASP   CG     C   -1.781    -10.360   4.024     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8026    .   1   1   10   ASP   H      H   -2.725    -6.478    2.362     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8027    .   1   1   10   ASP   HA     H   -0.641    -8.496    2.501     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8028    .   1   1   10   ASP   HB2    H   -2.105    -8.388    4.685     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8029    .   1   1   10   ASP   HB3    H   -3.373    -9.037    3.647     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8030    .   1   1   10   ASP   N      N   -1.886    -6.851    2.726     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8031    .   1   1   10   ASP   O      O   -2.707    -7.772    0.514     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8032    .   1   1   10   ASP   OD1    O   -2.384    -11.329   3.530     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   OD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8033    .   1   1   10   ASP   OD2    O   -0.747    -10.506   4.707     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   OD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8034    .   1   1   11   SER   C      C   -4.971    -9.878    0.055     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8035    .   1   1   11   SER   CA     C   -3.496    -10.217   -0.134    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8036    .   1   1   11   SER   CB     C   -3.298    -11.673   -0.570    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8037    .   1   1   11   SER   H      H   -2.535    -10.627   1.713     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8038    .   1   1   11   SER   HA     H   -3.111    -9.557    -0.900    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8039    .   1   1   11   SER   HB2    H   -3.882    -11.852   -1.459    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8040    .   1   1   11   SER   HB3    H   -2.257    -11.841   -0.798    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8041    .   1   1   11   SER   HG     H   -4.265    -13.232   -0.031    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   HG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8042    .   1   1   11   SER   N      N   -2.762    -9.907    1.082     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8043    .   1   1   11   SER   O      O   -5.719    -9.686    -0.906    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8044    .   1   1   11   SER   OG     O   -3.704    -12.596   0.434     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   OG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8045    .   1   1   12   GLU   C      C   -6.924    -7.935    1.639     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8046    .   1   1   12   GLU   CA     C   -6.722    -9.448    1.687     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8047    .   1   1   12   GLU   CB     C   -7.046    -10.016   3.063     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8048    .   1   1   12   GLU   CD     C   -7.254    -12.094   4.462     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8049    .   1   1   12   GLU   CG     C   -6.956    -11.528   3.107     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8050    .   1   1   12   GLU   H      H   -4.696    -9.957    2.008     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8051    .   1   1   12   GLU   HA     H   -7.377    -9.901    0.957     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8052    .   1   1   12   GLU   HB2    H   -6.346    -9.613    3.778     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8053    .   1   1   12   GLU   HB3    H   -8.047    -9.726    3.342     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8054    .   1   1   12   GLU   HG2    H   -7.659    -11.940   2.399     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8055    .   1   1   12   GLU   HG3    H   -5.956    -11.819   2.821     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8056    .   1   1   12   GLU   N      N   -5.368    -9.784    1.318     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8057    .   1   1   12   GLU   O      O   -7.707    -7.433    0.825     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8058    .   1   1   12   GLU   OE1    O   -8.438    -12.081   4.884     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   OE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8059    .   1   1   12   GLU   OE2    O   -6.326    -12.600   5.124     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   OE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8060    .   1   1   13   ARG   C      C   -5.286    -5.276    1.440     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8061    .   1   1   13   ARG   CA     C   -6.281    -5.758    2.455     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8062    .   1   1   13   ARG   CB     C   -5.932    -5.147    3.814     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8063    .   1   1   13   ARG   CD     C   -6.499    -4.790    6.228     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8064    .   1   1   13   ARG   CG     C   -6.933    -5.421    4.908     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8065    .   1   1   13   ARG   CZ     C   -4.391    -4.797    7.581     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   CZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8066    .   1   1   13   ARG   H      H   -5.659    -7.652    3.155     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8067    .   1   1   13   ARG   HA     H   -7.277    -5.455    2.165     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8068    .   1   1   13   ARG   HB2    H   -4.975    -5.533    4.132     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8069    .   1   1   13   ARG   HB3    H   -5.846    -4.076    3.698     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8070    .   1   1   13   ARG   HD2    H   -6.339    -3.733    6.071     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8071    .   1   1   13   ARG   HD3    H   -7.284    -4.929    6.955     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8072    .   1   1   13   ARG   HE     H   -5.108    -6.312    6.449     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8073    .   1   1   13   ARG   HG2    H   -7.891    -5.025    4.613     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8074    .   1   1   13   ARG   HG3    H   -6.988    -6.494    5.025     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8075    .   1   1   13   ARG   HH11   H   -5.359    -2.979    7.701     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HH11   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8076    .   1   1   13   ARG   HH12   H   -3.923    -3.085    8.590     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HH12   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8077    .   1   1   13   ARG   HH21   H   -3.179    -6.433    7.748     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HH21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8078    .   1   1   13   ARG   HH22   H   -2.666    -5.093    8.653     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HH22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8079    .   1   1   13   ARG   N      N   -6.232    -7.212    2.492     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8080    .   1   1   13   ARG   NE     N   -5.262    -5.386    6.745     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   NE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8081    .   1   1   13   ARG   NH1    N   -4.579    -3.542    7.982     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   NH1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8082    .   1   1   13   ARG   NH2    N   -3.341    -5.481    8.021     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   NH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8083    .   1   1   13   ARG   O      O   -4.115    -5.514    1.603     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8084    .   1   1   14   LYS   C      C   -4.728    -2.635    -0.514    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8085    .   1   1   14   LYS   CA     C   -4.857    -4.140    -0.647    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8086    .   1   1   14   LYS   CB     C   -5.410    -4.469    -2.041    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8087    .   1   1   14   LYS   CD     C   -6.175    -6.214    -3.717    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8088    .   1   1   14   LYS   CE     C   -7.480    -5.477    -4.022    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8089    .   1   1   14   LYS   CG     C   -5.666    -5.948    -2.293    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8090    .   1   1   14   LYS   H      H   -6.713    -4.474    0.313     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8091    .   1   1   14   LYS   HA     H   -3.890    -4.602    -0.527    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8092    .   1   1   14   LYS   HB2    H   -6.343    -3.941    -2.166    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8093    .   1   1   14   LYS   HB3    H   -4.709    -4.113    -2.782    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8094    .   1   1   14   LYS   HD2    H   -5.424    -5.888    -4.422    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8095    .   1   1   14   LYS   HD3    H   -6.336    -7.275    -3.832    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8096    .   1   1   14   LYS   HE2    H   -8.213    -5.734    -3.274    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8097    .   1   1   14   LYS   HE3    H   -7.298    -4.413    -3.989    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8098    .   1   1   14   LYS   HG2    H   -4.745    -6.494    -2.146    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8099    .   1   1   14   LYS   HG3    H   -6.403    -6.298    -1.585    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8100    .   1   1   14   LYS   HZ1    H   -7.338    -5.606    -6.121    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8101    .   1   1   14   LYS   HZ2    H   -8.898    -5.311    -5.549    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8102    .   1   1   14   LYS   HZ3    H   -8.243    -6.844    -5.402    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8103    .   1   1   14   LYS   N      N   -5.748    -4.640    0.393     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8104    .   1   1   14   LYS   NZ     N   -8.016    -5.828    -5.362    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8105    .   1   1   14   LYS   O      O   -5.651    -1.981    -0.042    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8106    .   1   1   15   CYS   C      C   -4.096    -0.070    -2.130    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8107    .   1   1   15   CYS   CA     C   -3.417    -0.642    -0.888    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8108    .   1   1   15   CYS   CB     C   -1.922    -0.290    -0.921    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8109    .   1   1   15   CYS   H      H   -2.861    -2.659    -1.194    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8110    .   1   1   15   CYS   HA     H   -3.879    -0.218    -0.011    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8111    .   1   1   15   CYS   HB2    H   -1.540    -0.469    -1.915    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8112    .   1   1   15   CYS   HB3    H   -1.802    0.757     -0.684    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8113    .   1   1   15   CYS   N      N   -3.601    -2.089    -0.901    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8114    .   1   1   15   CYS   O      O   -4.158    -0.752    -3.166    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8115    .   1   1   15   CYS   SG     S   -0.890    -1.247    0.240     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8116    .   1   1   16   CYS   C      C   -4.199    2.190     -4.239    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8117    .   1   1   16   CYS   CA     C   -5.246    1.743     -3.218    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8118    .   1   1   16   CYS   CB     C   -6.199    2.892     -2.845    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8119    .   1   1   16   CYS   H      H   -4.599    1.615     -1.195    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8120    .   1   1   16   CYS   HA     H   -5.820    0.956     -3.685    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8121    .   1   1   16   CYS   HB2    H   -5.702    3.547     -2.144    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8122    .   1   1   16   CYS   HB3    H   -6.442    3.445     -3.738    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8123    .   1   1   16   CYS   N      N   -4.627    1.128     -2.045    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8124    .   1   1   16   CYS   O      O   -3.000    2.280     -3.913    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8125    .   1   1   16   CYS   SG     S   -7.768    2.346     -2.074    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8126    .   1   1   17   LYS   C      C   -2.985    4.041     -6.247    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8127    .   1   1   17   LYS   CA     C   -3.818    2.812     -6.588    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8128    .   1   1   17   LYS   CB     C   -4.687    3.060     -7.824    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8129    .   1   1   17   LYS   CD     C   -4.828    3.614     -10.258   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8130    .   1   1   17   LYS   CE     C   -4.065    4.055     -11.497   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8131    .   1   1   17   LYS   CG     C   -3.910    3.433     -9.071    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8132    .   1   1   17   LYS   H      H   -5.613    2.307     -5.633    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8133    .   1   1   17   LYS   HA     H   -3.149    1.991     -6.796    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8134    .   1   1   17   LYS   HB2    H   -5.250    2.163     -8.035    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8135    .   1   1   17   LYS   HB3    H   -5.379    3.859     -7.604    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8136    .   1   1   17   LYS   HD2    H   -5.306    2.668     -10.467   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8137    .   1   1   17   LYS   HD3    H   -5.580    4.351     -10.018   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8138    .   1   1   17   LYS   HE2    H   -3.346    3.288     -11.741   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8139    .   1   1   17   LYS   HE3    H   -4.761    4.171     -12.314   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8140    .   1   1   17   LYS   HG2    H   -3.377    4.356     -8.891    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8141    .   1   1   17   LYS   HG3    H   -3.203    2.645     -9.288    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8142    .   1   1   17   LYS   HZ1    H   -3.992    6.104     -11.017   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8143    .   1   1   17   LYS   HZ2    H   -2.836    5.627     -12.144   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8144    .   1   1   17   LYS   HZ3    H   -2.631    5.234     -10.533   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8145    .   1   1   17   LYS   N      N   -4.653    2.417     -5.467    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8146    .   1   1   17   LYS   NZ     N   -3.344    5.334     -11.283   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8147    .   1   1   17   LYS   O      O   -3.480    5.005     -5.667    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8148    .   1   1   18   GLY   C      C   0.163     4.507     -5.216    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8149    .   1   1   18   GLY   CA     C   -0.795    5.024     -6.245    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8150    .   1   1   18   GLY   H      H   -1.402    3.184     -7.073    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8151    .   1   1   18   GLY   HA2    H   -0.258    5.321     -7.132    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   HA2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8152    .   1   1   18   GLY   HA3    H   -1.329    5.869     -5.837    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   HA3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8153    .   1   1   18   GLY   N      N   -1.724    3.973     -6.582    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8154    .   1   1   18   GLY   O      O   1.254     5.056     -4.991    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8155    .   1   1   19   MET   C      C   0.602     1.290     -4.092    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8156    .   1   1   19   MET   CA     C   0.522     2.720     -3.636    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8157    .   1   1   19   MET   CB     C   -0.125    2.814     -2.250    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8158    .   1   1   19   MET   CE     C   -2.668    4.326     -0.861    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8159    .   1   1   19   MET   CG     C   0.007     4.184     -1.603    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8160    .   1   1   19   MET   H      H   -1.150    3.092     -4.792    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8161    .   1   1   19   MET   HA     H   1.513     3.145     -3.603    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8162    .   1   1   19   MET   HB2    H   -1.174    2.580     -2.348    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8163    .   1   1   19   MET   HB3    H   0.336     2.084     -1.602    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8164    .   1   1   19   MET   HE1    H   -3.407    4.466     -0.085    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8165    .   1   1   19   MET   HE2    H   -2.826    3.366     -1.329    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8166    .   1   1   19   MET   HE3    H   -2.767    5.109     -1.597    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8167    .   1   1   19   MET   HG2    H   1.039     4.294     -1.302    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8168    .   1   1   19   MET   HG3    H   -0.247    4.943     -2.328    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8169    .   1   1   19   MET   N      N   -0.251    3.439     -4.596    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8170    .   1   1   19   MET   O      O   -0.327    0.788     -4.742    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8171    .   1   1   19   MET   SD     S   -1.025    4.386     -0.139    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   SD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8172    .   1   1   20   VAL   C      C   1.736     -1.578    -2.952    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8173    .   1   1   20   VAL   CA     C   1.879     -0.706    -4.186    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8174    .   1   1   20   VAL   CB     C   3.261     -0.919    -4.905    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8175    .   1   1   20   VAL   CG1    C   4.449     -0.552    -4.017    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   CG1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8176    .   1   1   20   VAL   CG2    C   3.397     -2.340    -5.439    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   CG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8177    .   1   1   20   VAL   H      H   2.379     1.086     -3.245    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8178    .   1   1   20   VAL   HA     H   1.080     -0.955    -4.870    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8179    .   1   1   20   VAL   HB     H   3.284     -0.244    -5.748    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8180    .   1   1   20   VAL   HG11   H   5.369     -0.717    -4.557    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG11   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8181    .   1   1   20   VAL   HG12   H   4.438     -1.170    -3.131    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG12   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8182    .   1   1   20   VAL   HG13   H   4.378     0.487     -3.732    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG13   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8183    .   1   1   20   VAL   HG21   H   4.355     -2.454    -5.924    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8184    .   1   1   20   VAL   HG22   H   2.606     -2.536    -6.148    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8185    .   1   1   20   VAL   HG23   H   3.325     -3.038    -4.617    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG23   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8186    .   1   1   20   VAL   N      N   1.683     0.649     -3.796    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8187    .   1   1   20   VAL   O      O   2.250     -1.237    -1.867    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8188    .   1   1   21   CYS   C      C   1.979     -4.313    -1.677    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8189    .   1   1   21   CYS   CA     C   0.717     -3.520    -1.998    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8190    .   1   1   21   CYS   CB     C   -0.468    -4.443    -2.323    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8191    .   1   1   21   CYS   H      H   0.579     -2.825    -3.965    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8192    .   1   1   21   CYS   HA     H   0.467     -2.914    -1.140    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8193    .   1   1   21   CYS   HB2    H   -1.257    -3.858    -2.770    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8194    .   1   1   21   CYS   HB3    H   -0.142    -5.194    -3.028    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8195    .   1   1   21   CYS   N      N   0.981     -2.634    -3.090    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8196    .   1   1   21   CYS   O      O   2.528     -5.017    -2.527    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8197    .   1   1   21   CYS   SG     S   -1.175    -5.304    -0.875    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8198    .   1   1   22   ARG   C      C   3.472     -5.021    1.508     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8199    .   1   1   22   ARG   CA     C   3.645     -4.754    -0.011    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8200    .   1   1   22   ARG   CB     C   4.799     -3.737    -0.307    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8201    .   1   1   22   ARG   CD     C   6.613     -5.372    -0.928    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8202    .   1   1   22   ARG   CG     C   6.229     -4.200    -0.051    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8203    .   1   1   22   ARG   CZ     C   8.700     -6.608    -1.448    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   CZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8204    .   1   1   22   ARG   H      H   1.911     -3.642    0.175     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8205    .   1   1   22   ARG   HA     H   3.821     -5.673    -0.547    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8206    .   1   1   22   ARG   HB2    H   4.747     -3.460    -1.350    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8207    .   1   1   22   ARG   HB3    H   4.622     -2.851    0.286     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8208    .   1   1   22   ARG   HD2    H   5.951     -6.199    -0.719    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8209    .   1   1   22   ARG   HD3    H   6.520     -5.084    -1.964    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8210    .   1   1   22   ARG   HE     H   8.403     -5.406    0.133     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8211    .   1   1   22   ARG   HG2    H   6.898     -3.380    -0.269    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8212    .   1   1   22   ARG   HG3    H   6.340     -4.476    0.986     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8213    .   1   1   22   ARG   HH11   H   7.208     -6.980    -2.798    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HH11   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8214    .   1   1   22   ARG   HH12   H   8.680     -7.771    -3.125    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HH12   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8215    .   1   1   22   ARG   HH21   H   10.381    -6.488    -0.312    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HH21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8216    .   1   1   22   ARG   HH22   H   10.536    -7.486    -1.686    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HH22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8217    .   1   1   22   ARG   N      N   2.436     -4.165    -0.471    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8218    .   1   1   22   ARG   NE     N   7.987     -5.789    -0.674    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   NE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8219    .   1   1   22   ARG   NH1    N   8.159     -7.154    -2.526    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   NH1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8220    .   1   1   22   ARG   NH2    N   9.954     -6.883    -1.129    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   NH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8221    .   1   1   22   ARG   O      O   2.338     -4.823    2.082     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8222    .   1   1   23   LEU   C      C   4.073     -4.478    4.357     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8223    .   1   1   23   LEU   CA     C   4.601     -5.700    3.612     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8224    .   1   1   23   LEU   CB     C   6.031     -6.011    4.057     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8225    .   1   1   23   LEU   CD1    C   8.093     -7.427    3.938     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8226    .   1   1   23   LEU   CD2    C   5.855     -8.456    3.512     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8227    .   1   1   23   LEU   CG     C   6.704     -7.203    3.374     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8228    .   1   1   23   LEU   H      H   5.343     -5.717    1.633     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8229    .   1   1   23   LEU   HA     H   3.970     -6.546    3.833     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8230    .   1   1   23   LEU   HB2    H   6.640     -5.139    3.869     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8231    .   1   1   23   LEU   HB3    H   6.022     -6.198    5.122     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8232    .   1   1   23   LEU   HD11   H   8.553     -8.271    3.442     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD11   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8233    .   1   1   23   LEU   HD12   H   8.024     -7.625    4.997     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD12   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8234    .   1   1   23   LEU   HD13   H   8.696     -6.545    3.781     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD13   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8235    .   1   1   23   LEU   HD21   H   6.375     -9.293    3.069     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8236    .   1   1   23   LEU   HD22   H   4.914     -8.312    3.001     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8237    .   1   1   23   LEU   HD23   H   5.669     -8.655    4.555     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD23   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8238    .   1   1   23   LEU   HG     H   6.814     -6.981    2.322     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8239    .   1   1   23   LEU   N      N   4.554     -5.475    2.160     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8240    .   1   1   23   LEU   O      O   3.540     -4.590    5.457     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8241    .   1   1   24   TRP   C      C   3.137     -1.431    2.906     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8242    .   1   1   24   TRP   CA     C   3.647     -2.111    4.171     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8243    .   1   1   24   TRP   CB     C   4.667     -1.220    4.905     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8244    .   1   1   24   TRP   CD1    C   5.653     0.749     3.645     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8245    .   1   1   24   TRP   CD2    C   6.852     -1.119    3.439     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8246    .   1   1   24   TRP   CE2    C   7.484     -0.102    2.702     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8247    .   1   1   24   TRP   CE3    C   7.423     -2.386    3.462     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8248    .   1   1   24   TRP   CG     C   5.681     -0.545    4.032     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8249    .   1   1   24   TRP   CH2    C   9.194     -1.576    2.031     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8250    .   1   1   24   TRP   CZ2    C   8.660     -0.321    1.993     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8251    .   1   1   24   TRP   CZ3    C   8.585     -2.604    2.757     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8252    .   1   1   24   TRP   H      H   4.728     -3.295    2.894     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8253    .   1   1   24   TRP   HA     H   2.833     -2.383    4.819     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8254    .   1   1   24   TRP   HB2    H   4.130     -0.441    5.422     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8255    .   1   1   24   TRP   HB3    H   5.196     -1.821    5.629     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8256    .   1   1   24   TRP   HD1    H   4.861     1.421     3.950     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8257    .   1   1   24   TRP   HE1    H   6.931     1.905     2.433     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8258    .   1   1   24   TRP   HE3    H   6.963     -3.184    4.023     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8259    .   1   1   24   TRP   HH2    H   10.105    -1.791    1.494     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8260    .   1   1   24   TRP   HZ2    H   9.150     0.458     1.427     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8261    .   1   1   24   TRP   HZ3    H   9.040     -3.583    2.765     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8262    .   1   1   24   TRP   N      N   4.227     -3.334    3.735     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8263    .   1   1   24   TRP   NE1    N   6.732     1.032     2.843     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   NE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8264    .   1   1   24   TRP   O      O   3.594     -1.791    1.817     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8265    .   1   1   25   CYS   C      C   2.808     1.194     1.409     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8266    .   1   1   25   CYS   CA     C   1.763     0.186     1.817     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8267    .   1   1   25   CYS   CB     C   0.397     0.852     1.994     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8268    .   1   1   25   CYS   H      H   1.811     -0.271    3.873     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8269    .   1   1   25   CYS   HA     H   1.701     -0.552    1.031     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8270    .   1   1   25   CYS   HB2    H   0.390     1.394     2.927     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8271    .   1   1   25   CYS   HB3    H   0.233     1.544     1.180     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8272    .   1   1   25   CYS   N      N   2.203     -0.518    3.008     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8273    .   1   1   25   CYS   O      O   3.099     2.144     2.139     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8274    .   1   1   25   CYS   SG     S   -1.016    -0.301    2.036     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8275    .   1   1   26   LYS   C      C   3.941     2.567     -1.405    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8276    .   1   1   26   LYS   CA     C   4.441     1.808     -0.211    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8277    .   1   1   26   LYS   CB     C   5.663     0.961     -0.593    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8278    .   1   1   26   LYS   CD     C   8.027     0.947     -1.453    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8279    .   1   1   26   LYS   CE     C   9.168     1.818     -1.966    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8280    .   1   1   26   LYS   CG     C   6.799     1.778     -1.159    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8281    .   1   1   26   LYS   H      H   3.098     0.214     -0.279    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8282    .   1   1   26   LYS   HA     H   4.724     2.499     0.568     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8283    .   1   1   26   LYS   HB2    H   6.018     0.446     0.286     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8284    .   1   1   26   LYS   HB3    H   5.364     0.231     -1.332    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8285    .   1   1   26   LYS   HD2    H   8.339     0.449     -0.548    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8286    .   1   1   26   LYS   HD3    H   7.779     0.211     -2.204    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8287    .   1   1   26   LYS   HE2    H   9.976     1.193     -2.309    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8288    .   1   1   26   LYS   HE3    H   8.802     2.405     -2.795    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8289    .   1   1   26   LYS   HG2    H   6.452     2.219     -2.083    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8290    .   1   1   26   LYS   HG3    H   7.020     2.565     -0.461    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8291    .   1   1   26   LYS   HZ1    H   10.111    2.209     -0.139    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8292    .   1   1   26   LYS   HZ2    H   8.947     3.363     -0.574    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8293    .   1   1   26   LYS   HZ3    H   10.430    3.336     -1.350    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8294    .   1   1   26   LYS   N      N   3.397     0.967     0.275     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8295    .   1   1   26   LYS   NZ     N   9.691     2.734     -0.932    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8296    .   1   1   26   LYS   O      O   3.127     2.063     -2.134    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8297    .   1   1   27   LYS   C      C   4.586     3.916     -3.998    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8298    .   1   1   27   LYS   CA     C   4.026     4.566     -2.737    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8299    .   1   1   27   LYS   CB     C   4.570     5.976     -2.592    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8300    .   1   1   27   LYS   CD     C   4.836     7.973     -1.091    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8301    .   1   1   27   LYS   CE     C   4.433     8.599     0.234     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8302    .   1   1   27   LYS   CG     C   4.089     6.677     -1.333    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8303    .   1   1   27   LYS   H      H   5.019     4.153     -0.924    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8304    .   1   1   27   LYS   HA     H   2.948     4.602     -2.795    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8305    .   1   1   27   LYS   HB2    H   5.646     5.923     -2.592    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8306    .   1   1   27   LYS   HB3    H   4.258     6.556     -3.447    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8307    .   1   1   27   LYS   HD2    H   5.897     7.770     -1.072    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8308    .   1   1   27   LYS   HD3    H   4.616     8.665     -1.890    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8309    .   1   1   27   LYS   HE2    H   3.379     8.836     0.198     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8310    .   1   1   27   LYS   HE3    H   4.609     7.883     1.023     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8311    .   1   1   27   LYS   HG2    H   3.039     6.895     -1.453    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8312    .   1   1   27   LYS   HG3    H   4.219     6.020     -0.488    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8313    .   1   1   27   LYS   HZ1    H   6.212     9.654     0.573     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8314    .   1   1   27   LYS   HZ2    H   4.881     10.243    1.427     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8315    .   1   1   27   LYS   HZ3    H   5.029     10.545    -0.222    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8316    .   1   1   27   LYS   N      N   4.399     3.775     -1.584    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8317    .   1   1   27   LYS   NZ     N   5.189     9.834     0.522     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8318    .   1   1   27   LYS   O      O   5.710     3.387     -4.004    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8319    .   1   1   28   LYS   C      C   5.003     4.391     -7.059    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8320    .   1   1   28   LYS   CA     C   4.242     3.343     -6.285    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8321    .   1   1   28   LYS   CB     C   3.057     2.787     -7.100    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8322    .   1   1   28   LYS   CD     C   2.253     1.480     -9.101    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8323    .   1   1   28   LYS   CE     C   2.642     0.638     -10.319   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8324    .   1   1   28   LYS   CG     C   3.467     2.023     -8.362    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8325    .   1   1   28   LYS   H      H   2.938     4.364     -4.973    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8326    .   1   1   28   LYS   HA     H   4.923     2.539     -6.042    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8327    .   1   1   28   LYS   HB2    H   2.488     2.119     -6.471    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8328    .   1   1   28   LYS   HB3    H   2.424     3.612     -7.394    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8329    .   1   1   28   LYS   HD2    H   1.687     0.860     -8.422    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8330    .   1   1   28   LYS   HD3    H   1.644     2.309     -9.425    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8331    .   1   1   28   LYS   HE2    H   3.266     -0.179    -9.991    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8332    .   1   1   28   LYS   HE3    H   1.740     0.237     -10.760   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8333    .   1   1   28   LYS   HG2    H   4.011     2.686     -9.019    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8334    .   1   1   28   LYS   HG3    H   4.101     1.197     -8.077    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8335    .   1   1   28   LYS   HZ1    H   4.306     1.754     -11.002   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8336    .   1   1   28   LYS   HZ2    H   2.834     2.232     -11.665   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8337    .   1   1   28   LYS   HZ3    H   3.559     0.811     -12.175   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8338    .   1   1   28   LYS   N      N   3.814     3.923     -5.042    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8339    .   1   1   28   LYS   NZ     N   3.378     1.409     -11.344   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8340    .   1   1   28   LYS   O      O   4.416     5.215     -7.777    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8341    .   1   1   29   LEU   C      C   7.412     4.869     -8.883    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8342    .   1   1   29   LEU   CA     C   7.151     5.367     -7.478    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8343    .   1   1   29   LEU   CB     C   8.469     5.491     -6.698    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8344    .   1   1   29   LEU   CD1    C   9.717     5.887     -4.551    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8345    .   1   1   29   LEU   CD2    C   7.604     7.133     -4.987    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8346    .   1   1   29   LEU   CG     C   8.347     5.826     -5.200    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8347    .   1   1   29   LEU   H      H   6.667     3.800     -6.178    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8348    .   1   1   29   LEU   HA     H   6.660     6.328     -7.515    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8349    .   1   1   29   LEU   HB2    H   9.001     4.556     -6.792    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8350    .   1   1   29   LEU   HB3    H   9.062     6.263     -7.165    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8351    .   1   1   29   LEU   HD11   H   10.311    6.652     -5.030    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD11   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8352    .   1   1   29   LEU   HD12   H   10.209    4.930     -4.658    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD12   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8353    .   1   1   29   LEU   HD13   H   9.608     6.120     -3.502    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD13   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8354    .   1   1   29   LEU   HD21   H   6.603     7.044     -5.383    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8355    .   1   1   29   LEU   HD22   H   8.125     7.928     -5.501    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8356    .   1   1   29   LEU   HD23   H   7.557     7.355     -3.931    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD23   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8357    .   1   1   29   LEU   HG     H   7.792     5.036     -4.714    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8358    .   1   1   29   LEU   N      N   6.285     4.428     -6.827    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8359    .   1   1   29   LEU   O      O   7.288     5.609     -9.868    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8360    .   1   1   30   TRP   C      C   6.864     1.957     -10.429   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8361    .   1   1   30   TRP   CA     C   7.966     2.959     -10.214   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8362    .   1   1   30   TRP   CB     C   9.327     2.261     -10.206   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8363    .   1   1   30   TRP   CD1    C   11.147    3.979     -10.701   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8364    .   1   1   30   TRP   CD2    C   11.048    3.332     -8.567    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8365    .   1   1   30   TRP   CE2    C   12.081    4.271     -8.696    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8366    .   1   1   30   TRP   CE3    C   10.792    2.781     -7.314    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8367    .   1   1   30   TRP   CG     C   10.464    3.161     -9.861    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8368    .   1   1   30   TRP   CH2    C   12.584    4.117     -6.407    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8369    .   1   1   30   TRP   CZ2    C   12.859    4.672     -7.620    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8370    .   1   1   30   TRP   CZ3    C   11.562    3.180     -6.249    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8371    .   1   1   30   TRP   H      H   7.767     3.070     -8.149    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8372    .   1   1   30   TRP   HA     H   7.942     3.702     -10.999   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8373    .   1   1   30   TRP   HB2    H   9.307     1.475     -9.466    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8374    .   1   1   30   TRP   HB3    H   9.515     1.835     -11.180   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8375    .   1   1   30   TRP   HD1    H   10.940    4.074     -11.758   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8376    .   1   1   30   TRP   HE1    H   12.760    5.301     -10.382   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8377    .   1   1   30   TRP   HE3    H   10.006    2.054     -7.172    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8378    .   1   1   30   TRP   HH2    H   13.162    4.397     -5.539    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8379    .   1   1   30   TRP   HZ2    H   13.654    5.396     -7.722    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8380    .   1   1   30   TRP   HZ3    H   11.375    2.763     -5.269    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8381    .   1   1   30   TRP   N      N   7.718     3.607     -8.968    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8382    .   1   1   30   TRP   NE1    N   12.123    4.652     -10.004   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   NE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8383    .   1   1   30   TRP   O      O   6.981     0.807     -9.949    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   16   .   8384    .   1   1   30   TRP   OXT    O   5.835     2.334     -11.021   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   OXT    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8385    .   1   1   1    TYR   C      C   -10.115   0.621     1.691     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8386    .   1   1   1    TYR   CA     C   -11.380   0.170     2.370     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8387    .   1   1   1    TYR   CB     C   -11.085   -0.535    3.710     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8388    .   1   1   1    TYR   CD1    C   -11.446   -3.006    3.552     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8389    .   1   1   1    TYR   CD2    C   -9.213    -2.203    3.464     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8390    .   1   1   1    TYR   CE1    C   -11.002   -4.287    3.421     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8391    .   1   1   1    TYR   CE2    C   -8.759    -3.490    3.332     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8392    .   1   1   1    TYR   CG     C   -10.566   -1.940    3.575     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8393    .   1   1   1    TYR   CZ     C   -9.660    -4.533    3.309     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8394    .   1   1   1    TYR   H1     H   -11.620   -1.521    1.202     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   H1     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8395    .   1   1   1    TYR   H2     H   -12.327   -0.127    0.597     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   H2     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8396    .   1   1   1    TYR   H3     H   -13.080   -0.935    1.869     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   H3     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8397    .   1   1   1    TYR   HA     H   -11.983   1.043     2.559     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8398    .   1   1   1    TYR   HB2    H   -10.336   0.034     4.240     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8399    .   1   1   1    TYR   HB3    H   -11.984   -0.563    4.309     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8400    .   1   1   1    TYR   HD1    H   -12.506   -2.819    3.638     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8401    .   1   1   1    TYR   HD2    H   -8.509    -1.384    3.484     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8402    .   1   1   1    TYR   HE1    H   -11.728   -5.083    3.406     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8403    .   1   1   1    TYR   HE2    H   -7.696    -3.659    3.244     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8404    .   1   1   1    TYR   HH     H   -9.702    -6.249    2.463     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HH     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8405    .   1   1   1    TYR   N      N   -12.159   -0.673    1.467     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8406    .   1   1   1    TYR   O      O   -9.607    -0.067    0.794     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8407    .   1   1   1    TYR   OH     O   -9.216    -5.822    3.182     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   OH     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8408    .   1   1   2    CYS   C      C   -7.318    2.228     2.464     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8409    .   1   1   2    CYS   CA     C   -8.440    2.278     1.465     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8410    .   1   1   2    CYS   CB     C   -8.637    3.709     0.974     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8411    .   1   1   2    CYS   H      H   -10.045   2.297     2.777     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8412    .   1   1   2    CYS   HA     H   -8.192    1.649     0.622     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8413    .   1   1   2    CYS   HB2    H   -9.588    3.797     0.472     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8414    .   1   1   2    CYS   HB3    H   -8.611    4.362     1.831     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8415    .   1   1   2    CYS   N      N   -9.624    1.768     2.067     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8416    .   1   1   2    CYS   O      O   -7.545    2.348     3.672     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8417    .   1   1   2    CYS   SG     S   -7.330    4.254     -0.169    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8418    .   1   1   3    GLN   C      C   -4.059    3.146     2.559     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8419    .   1   1   3    GLN   CA     C   -4.970    1.964     2.808     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8420    .   1   1   3    GLN   CB     C   -4.209    0.652     2.574     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8421    .   1   1   3    GLN   CD     C   -5.400    -0.726    4.357     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8422    .   1   1   3    GLN   CG     C   -4.992    -0.620    2.898     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8423    .   1   1   3    GLN   H      H   -6.030    2.053     0.997     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8424    .   1   1   3    GLN   HA     H   -5.322    1.990     3.826     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8425    .   1   1   3    GLN   HB2    H   -3.913    0.609     1.538     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8426    .   1   1   3    GLN   HB3    H   -3.318    0.664     3.185     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8427    .   1   1   3    GLN   HE21   H   -3.724    -1.694    4.811     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HE21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8428    .   1   1   3    GLN   HE22   H   -4.830    -1.406    6.103     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HE22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8429    .   1   1   3    GLN   HG2    H   -5.887    -0.635    2.295     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8430    .   1   1   3    GLN   HG3    H   -4.381    -1.473    2.646     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8431    .   1   1   3    GLN   N      N   -6.129    2.060     1.972     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8432    .   1   1   3    GLN   NE2    N   -4.571    -1.330    5.162     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   NE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8433    .   1   1   3    GLN   O      O   -3.899    3.589     1.415     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8434    .   1   1   3    GLN   OE1    O   -6.470    -0.278    4.757     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   OE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8435    .   1   1   4    LYS   C      C   -1.182    4.208     3.612     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8436    .   1   1   4    LYS   CA     C   -2.594    4.781     3.560     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8437    .   1   1   4    LYS   CB     C   -2.830    5.742     4.724     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8438    .   1   1   4    LYS   CD     C   -4.414    7.301     5.895     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8439    .   1   1   4    LYS   CE     C   -5.822    7.865     5.895     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8440    .   1   1   4    LYS   CG     C   -4.214    6.364     4.721     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8441    .   1   1   4    LYS   H      H   -3.780    3.327     4.501     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8442    .   1   1   4    LYS   HA     H   -2.746    5.299     2.626     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8443    .   1   1   4    LYS   HB2    H   -2.716    5.192     5.646     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8444    .   1   1   4    LYS   HB3    H   -2.097    6.534     4.693     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8445    .   1   1   4    LYS   HD2    H   -4.253    6.752     6.811     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8446    .   1   1   4    LYS   HD3    H   -3.706    8.112     5.828     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8447    .   1   1   4    LYS   HE2    H   -5.985    8.396     4.969     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8448    .   1   1   4    LYS   HE3    H   -6.516    7.042     5.958     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8449    .   1   1   4    LYS   HG2    H   -4.347    6.920     3.805     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8450    .   1   1   4    LYS   HG3    H   -4.950    5.573     4.771     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8451    .   1   1   4    LYS   HZ1    H   -5.933    8.315     7.936     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8452    .   1   1   4    LYS   HZ2    H   -7.041    9.147     6.984     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8453    .   1   1   4    LYS   HZ3    H   -5.424    9.608     6.981     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8454    .   1   1   4    LYS   N      N   -3.536    3.692     3.625     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8455    .   1   1   4    LYS   NZ     N   -6.065    8.789     7.021     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8456    .   1   1   4    LYS   O      O   -1.010    3.055     4.011     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8457    .   1   1   5    TRP   C      C   1.723     4.210     4.653     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8458    .   1   1   5    TRP   CA     C   1.237     4.531     3.242     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8459    .   1   1   5    TRP   CB     C   2.179     5.574     2.597     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8460    .   1   1   5    TRP   CD1    C   1.762     7.810     3.796     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8461    .   1   1   5    TRP   CD2    C   3.765     6.910     4.210     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8462    .   1   1   5    TRP   CE2    C   3.661     8.113     4.928     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8463    .   1   1   5    TRP   CE3    C   4.941     6.164     4.313     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8464    .   1   1   5    TRP   CG     C   2.533     6.730     3.496     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8465    .   1   1   5    TRP   CH2    C   5.822     7.837     5.819     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8466    .   1   1   5    TRP   CZ2    C   4.684     8.587     5.736     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8467    .   1   1   5    TRP   CZ3    C   5.959     6.636     5.117     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8468    .   1   1   5    TRP   H      H   -0.375    5.947     3.039     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8469    .   1   1   5    TRP   HA     H   1.253     3.622     2.658     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8470    .   1   1   5    TRP   HB2    H   3.100     5.088     2.312     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8471    .   1   1   5    TRP   HB3    H   1.705     5.971     1.713     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8472    .   1   1   5    TRP   HD1    H   0.768     7.974     3.410     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8473    .   1   1   5    TRP   HE1    H   2.081     9.485     5.024     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8474    .   1   1   5    TRP   HE3    H   5.058     5.233     3.778     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8475    .   1   1   5    TRP   HH2    H   6.643     8.171     6.435     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8476    .   1   1   5    TRP   HZ2    H   4.600     9.512     6.289     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8477    .   1   1   5    TRP   HZ3    H   6.877     6.074     5.209     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8478    .   1   1   5    TRP   N      N   -0.168    5.016     3.282     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8479    .   1   1   5    TRP   NE1    N   2.431     8.644     4.656     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   NE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8480    .   1   1   5    TRP   O      O   2.686     3.477     4.864     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8481    .   1   1   6    MET   C      C   0.801     3.254     7.495     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8482    .   1   1   6    MET   CA     C   1.334     4.598     7.004     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8483    .   1   1   6    MET   CB     C   0.731     5.743     7.826     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8484    .   1   1   6    MET   CE     C   -0.710    8.625     7.871     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8485    .   1   1   6    MET   CG     C   -0.781    5.848     7.710     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8486    .   1   1   6    MET   H      H   0.285     5.341     5.331     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8487    .   1   1   6    MET   HA     H   2.408     4.626     7.103     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8488    .   1   1   6    MET   HB2    H   0.979     5.586     8.865     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8489    .   1   1   6    MET   HB3    H   1.167     6.673     7.494     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8490    .   1   1   6    MET   HE1    H   -1.080    9.533     8.324     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8491    .   1   1   6    MET   HE2    H   -0.936    8.631     6.815     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8492    .   1   1   6    MET   HE3    H   0.359     8.569     8.010     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8493    .   1   1   6    MET   HG2    H   -1.029    5.994     6.670     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8494    .   1   1   6    MET   HG3    H   -1.217    4.920     8.051     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8495    .   1   1   6    MET   N      N   1.031     4.775     5.610     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8496    .   1   1   6    MET   O      O   1.075     2.839     8.618     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8497    .   1   1   6    MET   SD     S   -1.497    7.207     8.649     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   SD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8498    .   1   1   7    TRP   C      C   0.099     0.231     6.109     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8499    .   1   1   7    TRP   CA     C   -0.534    1.300     6.983     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8500    .   1   1   7    TRP   CB     C   -2.070    1.289     6.830     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8501    .   1   1   7    TRP   CD1    C   -2.374    2.909     8.824     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8502    .   1   1   7    TRP   CD2    C   -4.110    2.826     7.422     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8503    .   1   1   7    TRP   CE2    C   -4.400    3.756     8.437     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8504    .   1   1   7    TRP   CE3    C   -5.056    2.596     6.434     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8505    .   1   1   7    TRP   CG     C   -2.801    2.312     7.668     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8506    .   1   1   7    TRP   CH2    C   -6.512    4.205     7.495     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8507    .   1   1   7    TRP   CZ2    C   -5.600    4.454     8.481     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8508    .   1   1   7    TRP   CZ3    C   -6.249    3.284     6.479     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8509    .   1   1   7    TRP   H      H   -0.113    2.921     5.738     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8510    .   1   1   7    TRP   HA     H   -0.275    1.094     8.011     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8511    .   1   1   7    TRP   HB2    H   -2.318    1.481     5.796     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8512    .   1   1   7    TRP   HB3    H   -2.440    0.310     7.099     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8513    .   1   1   7    TRP   HD1    H   -1.412    2.721     9.282     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8514    .   1   1   7    TRP   HE1    H   -3.234    4.363     10.073    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8515    .   1   1   7    TRP   HE3    H   -4.864    1.878     5.653     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8516    .   1   1   7    TRP   HH2    H   -7.462    4.721     7.493     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8517    .   1   1   7    TRP   HZ2    H   -5.824    5.169     9.257     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8518    .   1   1   7    TRP   HZ3    H   -6.995    3.112     5.714     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8519    .   1   1   7    TRP   N      N   0.038     2.582     6.648     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8520    .   1   1   7    TRP   NE1    N   -3.319    3.800     9.273     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   NE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8521    .   1   1   7    TRP   O      O   1.029     0.509     5.333     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8522    .   1   1   8    THR   C      C   -0.888    -2.801    4.686     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8523    .   1   1   8    THR   CA     C   0.191     -2.082    5.511     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8524    .   1   1   8    THR   CB     C   0.834     -3.035    6.545     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8525    .   1   1   8    THR   CG2    C   2.043     -2.375    7.203     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   CG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8526    .   1   1   8    THR   H      H   -1.146    -1.167    6.799     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8527    .   1   1   8    THR   HA     H   0.956     -1.689    4.867     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8528    .   1   1   8    THR   HB     H   1.142     -3.947    6.055     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8529    .   1   1   8    THR   HG1    H   0.195     -2.949    8.403     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HG1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8530    .   1   1   8    THR   HG21   H   2.773     -2.101    6.456     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HG21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8531    .   1   1   8    THR   HG22   H   2.494     -3.056    7.911     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HG22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8532    .   1   1   8    THR   HG23   H   1.719     -1.484    7.718     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HG23   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8533    .   1   1   8    THR   N      N   -0.379    -0.971    6.223     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8534    .   1   1   8    THR   O      O   -2.081    -2.505    4.865     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8535    .   1   1   8    THR   OG1    O   -0.138    -3.336    7.582     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   OG1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8536    .   1   1   9    CYS   C      C   -1.201    -5.923    3.049     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8537    .   1   1   9    CYS   CA     C   -1.558    -4.452    3.090     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8538    .   1   1   9    CYS   CB     C   -1.889    -3.881    1.710     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8539    .   1   1   9    CYS   H      H   0.408     -3.911    3.482     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8540    .   1   1   9    CYS   HA     H   -2.430    -4.364    3.724     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8541    .   1   1   9    CYS   HB2    H   -2.693    -4.456    1.275     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8542    .   1   1   9    CYS   HB3    H   -2.215    -2.859    1.829     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8543    .   1   1   9    CYS   N      N   -0.520    -3.705    3.759     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8544    .   1   1   9    CYS   O      O   -0.118    -6.311    3.526     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8545    .   1   1   9    CYS   SG     S   -0.526    -3.894    0.535     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8546    .   1   1   10   ASP   C      C   -2.555    -8.758    1.304     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8547    .   1   1   10   ASP   CA     C   -1.920    -8.194    2.537     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8548    .   1   1   10   ASP   CB     C   -2.636    -8.814    3.765     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8549    .   1   1   10   ASP   CG     C   -2.105    -8.348    5.094     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8550    .   1   1   10   ASP   H      H   -2.864    -6.382    2.030     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8551    .   1   1   10   ASP   HA     H   -0.872    -8.443    2.571     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8552    .   1   1   10   ASP   HB2    H   -3.682    -8.554    3.723     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8553    .   1   1   10   ASP   HB3    H   -2.547    -9.888    3.714     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8554    .   1   1   10   ASP   N      N   -2.086    -6.743    2.514     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8555    .   1   1   10   ASP   O      O   -2.956    -8.009    0.423     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8556    .   1   1   10   ASP   OD1    O   -2.648    -7.399    5.651     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   OD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8557    .   1   1   10   ASP   OD2    O   -1.140    -8.946    5.617     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   OD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8558    .   1   1   11   SER   C      C   -4.889    -10.441   0.324     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8559    .   1   1   11   SER   CA     C   -3.377    -10.696   0.142     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8560    .   1   1   11   SER   CB     C   -3.084    -12.195   0.156     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8561    .   1   1   11   SER   H      H   -2.262    -10.636   1.922     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8562    .   1   1   11   SER   HA     H   -3.043    -10.261   -0.788    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8563    .   1   1   11   SER   HB2    H   -3.596    -12.644   0.992     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8564    .   1   1   11   SER   HB3    H   -3.426    -12.642   -0.765    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8565    .   1   1   11   SER   HG     H   -1.552    -12.683   1.218     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   HG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8566    .   1   1   11   SER   N      N   -2.677    -10.063   1.239     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8567    .   1   1   11   SER   O      O   -5.668    -10.411   -0.635    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8568    .   1   1   11   SER   OG     O   -1.683    -12.432   0.294     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   OG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8569    .   1   1   12   GLU   C      C   -6.919    -8.463    1.838     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8570    .   1   1   12   GLU   CA     C   -6.646    -9.956    1.937     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8571    .   1   1   12   GLU   CB     C   -6.912    -10.426   3.361     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8572    .   1   1   12   GLU   CD     C   -7.533    -12.763   2.718     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8573    .   1   1   12   GLU   CG     C   -6.661    -11.900   3.575     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8574    .   1   1   12   GLU   H      H   -4.588    -10.300   2.272     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8575    .   1   1   12   GLU   HA     H   -7.299    -10.494   1.263     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8576    .   1   1   12   GLU   HB2    H   -6.273    -9.873    4.032     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8577    .   1   1   12   GLU   HB3    H   -7.942    -10.216   3.609     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8578    .   1   1   12   GLU   HG2    H   -5.631    -12.113   3.336     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8579    .   1   1   12   GLU   HG3    H   -6.846    -12.139   4.610     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8580    .   1   1   12   GLU   N      N   -5.274    -10.238   1.574     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8581    .   1   1   12   GLU   O      O   -7.883    -8.032    1.207     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8582    .   1   1   12   GLU   OE1    O   -8.695    -12.999   3.086     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   OE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8583    .   1   1   12   GLU   OE2    O   -7.069    -13.232   1.669     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   OE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8584    .   1   1   13   ARG   C      C   -5.570    -5.641    1.269     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8585    .   1   1   13   ARG   CA     C   -6.240    -6.249    2.467     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8586    .   1   1   13   ARG   CB     C   -5.677    -5.627    3.746     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8587    .   1   1   13   ARG   CD     C   -5.813    -5.357    6.226     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8588    .   1   1   13   ARG   CG     C   -6.352    -6.097    5.022     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8589    .   1   1   13   ARG   CZ     C   -3.546    -4.695    6.988     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   CZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8590    .   1   1   13   ARG   H      H   -5.298    -8.070    2.920     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8591    .   1   1   13   ARG   HA     H   -7.300    -6.041    2.419     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8592    .   1   1   13   ARG   HB2    H   -4.628    -5.876    3.814     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8593    .   1   1   13   ARG   HB3    H   -5.772    -4.553    3.685     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8594    .   1   1   13   ARG   HD2    H   -6.010    -4.305    6.090     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8595    .   1   1   13   ARG   HD3    H   -6.315    -5.709    7.116     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8596    .   1   1   13   ARG   HE     H   -3.971    -6.371    6.021     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8597    .   1   1   13   ARG   HG2    H   -7.412    -5.903    4.942     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8598    .   1   1   13   ARG   HG3    H   -6.178    -7.155    5.146     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8599    .   1   1   13   ARG   HH11   H   -4.976    -3.305    7.475     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HH11   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8600    .   1   1   13   ARG   HH12   H   -3.389    -2.918    7.988     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HH12   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8601    .   1   1   13   ARG   HH21   H   -1.967    -5.877    6.639     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HH21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8602    .   1   1   13   ARG   HH22   H   -1.541    -4.415    7.445     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HH22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8603    .   1   1   13   ARG   N      N   -6.071    -7.682    2.463     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8604    .   1   1   13   ARG   NE     N   -4.374    -5.539    6.388     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   NE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8605    .   1   1   13   ARG   NH1    N   -4.003    -3.556    7.517     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   NH1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8606    .   1   1   13   ARG   NH2    N   -2.259    -5.002    7.049     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   NH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8607    .   1   1   13   ARG   O      O   -4.350    -5.671    1.167     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8608    .   1   1   14   LYS   C      C   -5.361    -3.066    -0.467    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8609    .   1   1   14   LYS   CA     C   -5.828    -4.472    -0.814    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8610    .   1   1   14   LYS   CB     C   -6.901    -4.392    -1.913    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8611    .   1   1   14   LYS   CD     C   -9.121    -3.382    -2.629    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8612    .   1   1   14   LYS   CE     C   -8.524    -2.516    -3.734    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8613    .   1   1   14   LYS   CG     C   -8.142    -3.607    -1.490    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8614    .   1   1   14   LYS   H      H   -7.324    -5.142    0.504     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8615    .   1   1   14   LYS   HA     H   -4.992    -5.051    -1.180    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8616    .   1   1   14   LYS   HB2    H   -6.469    -3.909    -2.779    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8617    .   1   1   14   LYS   HB3    H   -7.204    -5.392    -2.183    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8618    .   1   1   14   LYS   HD2    H   -9.392    -4.342    -3.046    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8619    .   1   1   14   LYS   HD3    H   -10.006   -2.901    -2.240    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8620    .   1   1   14   LYS   HE2    H   -8.077    -1.639    -3.291    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8621    .   1   1   14   LYS   HE3    H   -7.761    -3.084    -4.249    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8622    .   1   1   14   LYS   HG2    H   -8.647    -4.148    -0.704    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8623    .   1   1   14   LYS   HG3    H   -7.823    -2.651    -1.105    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8624    .   1   1   14   LYS   HZ1    H   -9.110    -1.657    -5.547    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8625    .   1   1   14   LYS   HZ2    H   -10.162   -1.379    -4.276    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8626    .   1   1   14   LYS   HZ3    H   -10.153   -2.883    -5.014    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8627    .   1   1   14   LYS   N      N   -6.352    -5.116    0.369     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8628    .   1   1   14   LYS   NZ     N   -9.546    -2.095    -4.712    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8629    .   1   1   14   LYS   O      O   -5.945    -2.403    0.395     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8630    .   1   1   15   CYS   C      C   -4.418    -0.453    -2.026    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8631    .   1   1   15   CYS   CA     C   -3.836    -1.299    -0.903    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8632    .   1   1   15   CYS   CB     C   -2.314    -1.243    -0.891    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8633    .   1   1   15   CYS   H      H   -3.845    -3.223    -1.720    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8634    .   1   1   15   CYS   HA     H   -4.230    -0.941    0.037     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8635    .   1   1   15   CYS   HB2    H   -1.930    -2.038    -0.267    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8636    .   1   1   15   CYS   HB3    H   -1.960    -1.386    -1.901    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8637    .   1   1   15   CYS   N      N   -4.310    -2.640    -1.086    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8638    .   1   1   15   CYS   O      O   -4.961    -1.004    -2.992    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8639    .   1   1   15   CYS   SG     S   -1.620    0.323     -0.284    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8640    .   1   1   16   CYS   C      C   -3.911    2.062     -3.992    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8641    .   1   1   16   CYS   CA     C   -4.924    1.702     -2.912    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8642    .   1   1   16   CYS   CB     C   -5.514    2.941     -2.257    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8643    .   1   1   16   CYS   H      H   -3.891    1.239     -1.142    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8644    .   1   1   16   CYS   HA     H   -5.728    1.153     -3.380    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8645    .   1   1   16   CYS   HB2    H   -4.751    3.428     -1.666    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8646    .   1   1   16   CYS   HB3    H   -5.872    3.619     -3.016    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8647    .   1   1   16   CYS   N      N   -4.358    0.836     -1.906    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8648    .   1   1   16   CYS   O      O   -2.689    2.080     -3.746    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8649    .   1   1   16   CYS   SG     S   -6.907    2.539     -1.161    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8650    .   1   1   17   LYS   C      C   -2.868    3.985     -6.023    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8651    .   1   1   17   LYS   CA     C   -3.577    2.683     -6.324    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8652    .   1   1   17   LYS   CB     C   -4.361    2.763     -7.642    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8653    .   1   1   17   LYS   CD     C   -6.281    3.789     -8.995    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8654    .   1   1   17   LYS   CE     C   -6.740    2.443     -9.597    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8655    .   1   1   17   LYS   CG     C   -5.586    3.659     -7.620    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8656    .   1   1   17   LYS   H      H   -5.379    2.165     -5.344    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8657    .   1   1   17   LYS   HA     H   -2.818    1.919     -6.416    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8658    .   1   1   17   LYS   HB2    H   -3.698    3.139     -8.405    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8659    .   1   1   17   LYS   HB3    H   -4.676    1.765     -7.905    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8660    .   1   1   17   LYS   HD2    H   -7.149    4.420     -8.883    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8661    .   1   1   17   LYS   HD3    H   -5.592    4.261     -9.679    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8662    .   1   1   17   LYS   HE2    H   -7.103    1.816     -8.798    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8663    .   1   1   17   LYS   HE3    H   -7.541    2.631     -10.294   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8664    .   1   1   17   LYS   HG2    H   -6.296    3.256     -6.913    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8665    .   1   1   17   LYS   HG3    H   -5.278    4.641     -7.291    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8666    .   1   1   17   LYS   HZ1    H   -4.838    1.498     -9.674    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8667    .   1   1   17   LYS   HZ2    H   -5.308    2.217     -11.124   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8668    .   1   1   17   LYS   HZ3    H   -6.007    0.789     -10.632   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8669    .   1   1   17   LYS   N      N   -4.414    2.288     -5.207    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8670    .   1   1   17   LYS   NZ     N   -5.652    1.702     -10.289   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8671    .   1   1   17   LYS   O      O   -3.450    4.912     -5.437    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8672    .   1   1   18   GLY   C      C   0.276     4.656     -5.114    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8673    .   1   1   18   GLY   CA     C   -0.773    5.146     -6.063    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8674    .   1   1   18   GLY   H      H   -1.246    3.314     -6.951    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8675    .   1   1   18   GLY   HA2    H   -0.311    5.540     -6.955    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   HA2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8676    .   1   1   18   GLY   HA3    H   -1.354    5.916     -5.579    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   HA3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8677    .   1   1   18   GLY   N      N   -1.624    4.040     -6.408    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8678    .   1   1   18   GLY   O      O   1.300     5.310     -4.864    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8679    .   1   1   19   MET   C      C   1.141     1.454     -4.214    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8680    .   1   1   19   MET   CA     C   0.877     2.815     -3.684    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8681    .   1   1   19   MET   CB     C   0.254     2.701     -2.303    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8682    .   1   1   19   MET   CE     C   -0.966    5.678     0.179     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8683    .   1   1   19   MET   CG     C   0.039     4.023     -1.657    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8684    .   1   1   19   MET   H      H   -0.854    3.061     -4.778    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8685    .   1   1   19   MET   HA     H   1.803     3.364     -3.607    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8686    .   1   1   19   MET   HB2    H   -0.700    2.204     -2.388    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8687    .   1   1   19   MET   HB3    H   0.904     2.112     -1.671    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8688    .   1   1   19   MET   HE1    H   -1.484    6.152     -0.642    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8689    .   1   1   19   MET   HE2    H   0.023     6.103     0.276     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8690    .   1   1   19   MET   HE3    H   -1.521    5.834     1.090     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8691    .   1   1   19   MET   HG2    H   1.016     4.422     -1.431    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8692    .   1   1   19   MET   HG3    H   -0.484    4.676     -2.339    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8693    .   1   1   19   MET   N      N   0.002     3.495     -4.574    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8694    .   1   1   19   MET   O      O   0.410     0.961     -5.084    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8695    .   1   1   19   MET   SD     S   -0.845    3.939     -0.124    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   SD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8696    .   1   1   20   VAL   C      C   2.167     -1.330    -2.883    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8697    .   1   1   20   VAL   CA     C   2.514     -0.463    -4.066    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8698    .   1   1   20   VAL   CB     C   4.020     -0.560    -4.392    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8699    .   1   1   20   VAL   CG1    C   4.396     -1.975    -4.804    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   CG1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8700    .   1   1   20   VAL   CG2    C   4.378     0.433     -5.493    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   CG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8701    .   1   1   20   VAL   H      H   2.720     1.352     -3.076    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8702    .   1   1   20   VAL   HA     H   1.934     -0.763    -4.926    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8703    .   1   1   20   VAL   HB     H   4.582     -0.301    -3.507    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8704    .   1   1   20   VAL   HG11   H   4.160     -2.658    -4.002    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG11   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8705    .   1   1   20   VAL   HG12   H   5.453     -2.023    -5.021    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG12   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8706    .   1   1   20   VAL   HG13   H   3.832     -2.248    -5.683    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG13   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8707    .   1   1   20   VAL   HG21   H   3.805     0.205     -6.380    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8708    .   1   1   20   VAL   HG22   H   5.431     0.372     -5.722    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8709    .   1   1   20   VAL   HG23   H   4.140     1.433     -5.164    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG23   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8710    .   1   1   20   VAL   N      N   2.157     0.861     -3.722    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8711    .   1   1   20   VAL   O      O   2.650     -1.098    -1.763    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8712    .   1   1   21   CYS   C      C   1.818     -4.174    -1.734    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8713    .   1   1   21   CYS   CA     C   0.802     -3.122    -2.078    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8714    .   1   1   21   CYS   CB     C   -0.507    -3.790    -2.495    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8715    .   1   1   21   CYS   H      H   0.977     -2.405    -4.031    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8716    .   1   1   21   CYS   HA     H   0.611     -2.516    -1.204    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8717    .   1   1   21   CYS   HB2    H   -1.198    -3.041    -2.852    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8718    .   1   1   21   CYS   HB3    H   -0.302    -4.485    -3.295    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8719    .   1   1   21   CYS   N      N   1.297     -2.269    -3.115    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8720    .   1   1   21   CYS   O      O   2.052     -5.094    -2.507    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8721    .   1   1   21   CYS   SG     S   -1.321    -4.719    -1.147    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8722    .   1   1   22   ARG   C      C   3.150     -5.165    1.387     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8723    .   1   1   22   ARG   CA     C   3.408     -4.950    -0.100    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8724    .   1   1   22   ARG   CB     C   4.824     -4.376    -0.248    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8725    .   1   1   22   ARG   CD     C   5.639     -5.354    -2.449    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8726    .   1   1   22   ARG   CG     C   5.330     -4.090    -1.630    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8727    .   1   1   22   ARG   CZ     C   4.458     -7.446    -3.083    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   CZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8728    .   1   1   22   ARG   H      H   2.236     -3.235    -0.040    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8729    .   1   1   22   ARG   HA     H   3.340     -5.881    -0.644    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8730    .   1   1   22   ARG   HB2    H   4.906     -3.461    0.318     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8731    .   1   1   22   ARG   HB3    H   5.509     -5.092    0.176     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8732    .   1   1   22   ARG   HD2    H   6.091     -5.052    -3.381    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8733    .   1   1   22   ARG   HD3    H   6.344     -5.959    -1.900    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8734    .   1   1   22   ARG   HE     H   3.598     -5.664    -2.735    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8735    .   1   1   22   ARG   HG2    H   4.614     -3.465    -2.136    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8736    .   1   1   22   ARG   HG3    H   6.248     -3.563    -1.428    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8737    .   1   1   22   ARG   HH11   H   6.466     -7.724    -2.788    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HH11   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8738    .   1   1   22   ARG   HH12   H   5.651     -9.111    -3.301    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HH12   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8739    .   1   1   22   ARG   HH21   H   2.438     -7.537    -3.430    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HH21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8740    .   1   1   22   ARG   HH22   H   3.249     -9.011    -3.675    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HH22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8741    .   1   1   22   ARG   N      N   2.440     -4.018    -0.599    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8742    .   1   1   22   ARG   NE     N   4.455     -6.158    -2.754    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   NE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8743    .   1   1   22   ARG   NH1    N   5.593     -8.139    -3.057    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   NH1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8744    .   1   1   22   ARG   NH2    N   3.310     -8.042    -3.419    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   NH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8745    .   1   1   22   ARG   O      O   1.997     -4.965    1.909     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8746    .   1   1   23   LEU   C      C   3.743     -4.455    4.199     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8747    .   1   1   23   LEU   CA     C   4.220     -5.712    3.527     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8748    .   1   1   23   LEU   CB     C   5.601     -6.102    4.045     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8749    .   1   1   23   LEU   CD1    C   7.579     -7.622    4.029     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8750    .   1   1   23   LEU   CD2    C   5.288     -8.593    3.863     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8751    .   1   1   23   LEU   CG     C   6.179     -7.409    3.500     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8752    .   1   1   23   LEU   H      H   5.084     -5.561    1.591     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8753    .   1   1   23   LEU   HA     H   3.516     -6.504    3.739     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8754    .   1   1   23   LEU   HB2    H   6.287     -5.304    3.808     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8755    .   1   1   23   LEU   HB3    H   5.538     -6.188    5.118     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8756    .   1   1   23   LEU   HD11   H   8.214     -6.807    3.712     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD11   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8757    .   1   1   23   LEU   HD12   H   7.971     -8.554    3.647     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD12   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8758    .   1   1   23   LEU   HD13   H   7.556     -7.659    5.107     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD13   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8759    .   1   1   23   LEU   HD21   H   5.187     -8.651    4.937     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8760    .   1   1   23   LEU   HD22   H   5.738     -9.503    3.495     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8761    .   1   1   23   LEU   HD23   H   4.314     -8.469    3.414     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD23   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8762    .   1   1   23   LEU   HG     H   6.232     -7.343    2.425     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8763    .   1   1   23   LEU   N      N   4.239     -5.500    2.087     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8764    .   1   1   23   LEU   O      O   3.183     -4.495    5.280     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8765    .   1   1   24   TRP   C      C   2.990     -1.393    2.663     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8766    .   1   1   24   TRP   CA     C   3.423     -2.100    3.935     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8767    .   1   1   24   TRP   CB     C   4.385     -1.232    4.776     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8768    .   1   1   24   TRP   CD1    C   5.584     0.577     3.460     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8769    .   1   1   24   TRP   CD2    C   6.825     -1.237    3.824     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8770    .   1   1   24   TRP   CE2    C   7.590     -0.313    3.094     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8771    .   1   1   24   TRP   CE3    C   7.398     -2.458    4.175     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8772    .   1   1   24   TRP   CG     C   5.543     -0.646    4.039     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8773    .   1   1   24   TRP   CH2    C   9.433     -1.773    3.068     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8774    .   1   1   24   TRP   CZ2    C   8.896     -0.571    2.713     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8775    .   1   1   24   TRP   CZ3    C   8.697     -2.713    3.793     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8776    .   1   1   24   TRP   H      H   4.547     -3.355    2.746     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8777    .   1   1   24   TRP   HA     H   2.562     -2.376    4.518     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8778    .   1   1   24   TRP   HB2    H   3.830     -0.407    5.197     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8779    .   1   1   24   TRP   HB3    H   4.774     -1.831    5.586     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8780    .   1   1   24   TRP   HD1    H   4.739     1.253     3.475     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8781    .   1   1   24   TRP   HE1    H   7.071     1.606     2.400     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8782    .   1   1   24   TRP   HE3    H   6.842     -3.195    4.736     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8783    .   1   1   24   TRP   HH2    H   10.449    -2.017    2.791     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8784    .   1   1   24   TRP   HZ2    H   9.479     0.145     2.153     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8785    .   1   1   24   TRP   HZ3    H   9.158     -3.653    4.053     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8786    .   1   1   24   TRP   N      N   3.986     -3.340    3.551     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8787    .   1   1   24   TRP   NE1    N   6.809     0.791     2.883     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   NE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8788    .   1   1   24   TRP   O      O   3.343     -1.848    1.559     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8789    .   1   1   25   CYS   C      C   2.905     1.417     1.294     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8790    .   1   1   25   CYS   CA     C   1.848     0.399     1.610     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8791    .   1   1   25   CYS   CB     C   0.476     1.047     1.756     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8792    .   1   1   25   CYS   H      H   1.908     -0.038    3.655     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8793    .   1   1   25   CYS   HA     H   1.816     -0.304    0.791     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8794    .   1   1   25   CYS   HB2    H   0.400     1.495     2.736     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8795    .   1   1   25   CYS   HB3    H   0.363     1.813     1.003     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8796    .   1   1   25   CYS   N      N   2.221     -0.351    2.777     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8797    .   1   1   25   CYS   O      O   3.142     2.344     2.060     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8798    .   1   1   25   CYS   SG     S   -0.912    -0.119    1.578     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8799    .   1   1   26   LYS   C      C   4.044     3.036     -1.245    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8800    .   1   1   26   LYS   CA     C   4.599     2.113     -0.208    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8801    .   1   1   26   LYS   CB     C   5.780     1.327     -0.781    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8802    .   1   1   26   LYS   CD     C   8.085     1.381     -1.830    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8803    .   1   1   26   LYS   CE     C   8.648     0.368     -0.843    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8804    .   1   1   26   LYS   CG     C   6.951     2.200     -1.224    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8805    .   1   1   26   LYS   H      H   3.314     0.469     -0.382    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8806    .   1   1   26   LYS   HA     H   4.930     2.673     0.654     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8807    .   1   1   26   LYS   HB2    H   6.131     0.644     -0.021    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8808    .   1   1   26   LYS   HB3    H   5.438     0.756     -1.632    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8809    .   1   1   26   LYS   HD2    H   7.708     0.851     -2.691    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8810    .   1   1   26   LYS   HD3    H   8.874     2.051     -2.139    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8811    .   1   1   26   LYS   HE2    H   8.993     0.891     0.036     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8812    .   1   1   26   LYS   HE3    H   7.867     -0.322    -0.565    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8813    .   1   1   26   LYS   HG2    H   6.595     2.903     -1.964    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8814    .   1   1   26   LYS   HG3    H   7.318     2.742     -0.366    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8815    .   1   1   26   LYS   HZ1    H   9.488     -0.838    -2.317    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8816    .   1   1   26   LYS   HZ2    H   10.069    -1.151    -0.775    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8817    .   1   1   26   LYS   HZ3    H   10.594    0.221     -1.603    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8818    .   1   1   26   LYS   N      N   3.562     1.224     0.194     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8819    .   1   1   26   LYS   NZ     N   9.775     -0.394    -1.422    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8820    .   1   1   26   LYS   O      O   3.615     2.589     -2.293    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8821    .   1   1   27   LYS   C      C   4.516     5.551     -2.944    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8822    .   1   1   27   LYS   CA     C   3.500     5.241     -1.903    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8823    .   1   1   27   LYS   CB     C   2.989     6.517     -1.224    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8824    .   1   1   27   LYS   CD     C   3.418     8.456     0.314     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8825    .   1   1   27   LYS   CE     C   4.439     9.161     1.192     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8826    .   1   1   27   LYS   CG     C   4.019     7.248     -0.374    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8827    .   1   1   27   LYS   H      H   4.423     4.597     -0.116    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8828    .   1   1   27   LYS   HA     H   2.675     4.764     -2.405    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8829    .   1   1   27   LYS   HB2    H   2.658     7.191     -2.000    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8830    .   1   1   27   LYS   HB3    H   2.143     6.249     -0.614    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8831    .   1   1   27   LYS   HD2    H   3.069     9.147     -0.437    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8832    .   1   1   27   LYS   HD3    H   2.587     8.137     0.925     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8833    .   1   1   27   LYS   HE2    H   4.857     8.448     1.887     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8834    .   1   1   27   LYS   HE3    H   5.224     9.554     0.564     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8835    .   1   1   27   LYS   HG2    H   4.390     6.568     0.378     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8836    .   1   1   27   LYS   HG3    H   4.829     7.563     -1.016    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8837    .   1   1   27   LYS   HZ1    H   3.414     10.974    1.316     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8838    .   1   1   27   LYS   HZ2    H   4.517     10.747    2.563     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8839    .   1   1   27   LYS   HZ3    H   3.059     9.915     2.558     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8840    .   1   1   27   LYS   N      N   4.029     4.298     -0.964    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8841    .   1   1   27   LYS   NZ     N   3.829     10.266    1.952     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8842    .   1   1   27   LYS   O      O   5.692     5.792     -2.641    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8843    .   1   1   28   LYS   C      C   4.916     7.309     -5.485    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8844    .   1   1   28   LYS   CA     C   4.981     5.838     -5.223    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8845    .   1   1   28   LYS   CB     C   4.734     4.990     -6.486    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8846    .   1   1   28   LYS   CD     C   5.579     4.322     -8.775    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8847    .   1   1   28   LYS   CE     C   6.409     4.741     -9.992    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8848    .   1   1   28   LYS   CG     C   5.655     5.347     -7.655    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8849    .   1   1   28   LYS   H      H   3.147     5.340     -4.324    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8850    .   1   1   28   LYS   HA     H   5.974     5.633     -4.847    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8851    .   1   1   28   LYS   HB2    H   4.882     3.950     -6.241    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8852    .   1   1   28   LYS   HB3    H   3.712     5.133     -6.803    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8853    .   1   1   28   LYS   HD2    H   5.955     3.378     -8.408    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8854    .   1   1   28   LYS   HD3    H   4.547     4.207     -9.073    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8855    .   1   1   28   LYS   HE2    H   6.446     3.913     -10.685   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8856    .   1   1   28   LYS   HE3    H   5.921     5.577     -10.471   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8857    .   1   1   28   LYS   HG2    H   5.366     6.310     -8.048    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8858    .   1   1   28   LYS   HG3    H   6.672     5.402     -7.293    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8859    .   1   1   28   LYS   HZ1    H   7.801     6.054     -9.159    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8860    .   1   1   28   LYS   HZ2    H   8.390     5.237     -10.489   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8861    .   1   1   28   LYS   HZ3    H   8.276     4.442     -9.017    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8862    .   1   1   28   LYS   N      N   4.098     5.529     -4.158    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8863    .   1   1   28   LYS   NZ     N   7.800     5.124     -9.639    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8864    .   1   1   28   LYS   O      O   4.103     7.794     -6.259    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8865    .   1   1   29   LEU   C      C   7.009     9.768     -5.744    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8866    .   1   1   29   LEU   CA     C   5.810     9.448     -4.847    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8867    .   1   1   29   LEU   CB     C   5.974     10.039    -3.433    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8868    .   1   1   29   LEU   CD1    C   4.576     12.113    -3.710    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8869    .   1   1   29   LEU   CD2    C   6.282     11.980    -1.884    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8870    .   1   1   29   LEU   CG     C   5.932     11.561    -3.298    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8871    .   1   1   29   LEU   H      H   6.260     7.553     -4.071    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8872    .   1   1   29   LEU   HA     H   4.903     9.823     -5.300    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8873    .   1   1   29   LEU   HB2    H   5.188     9.634     -2.814    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8874    .   1   1   29   LEU   HB3    H   6.918     9.692     -3.037    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8875    .   1   1   29   LEU   HD11   H   4.575     13.186    -3.589    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD11   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8876    .   1   1   29   LEU   HD12   H   3.806     11.681    -3.087    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD12   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8877    .   1   1   29   LEU   HD13   H   4.382     11.868    -4.744    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD13   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8878    .   1   1   29   LEU   HD21   H   5.575     11.546    -1.192    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8879    .   1   1   29   LEU   HD22   H   6.245     13.058    -1.810    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8880    .   1   1   29   LEU   HD23   H   7.277     11.637    -1.643    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD23   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8881    .   1   1   29   LEU   HG     H   6.665     11.980    -3.967    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8882    .   1   1   29   LEU   N      N   5.713     8.018     -4.741    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8883    .   1   1   29   LEU   O      O   7.331     10.927    -6.023    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8884    .   1   1   30   TRP   C      C   8.256     8.735     -8.485    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8885    .   1   1   30   TRP   CA     C   8.777     8.760     -7.063    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8886    .   1   1   30   TRP   CB     C   9.678     7.541     -6.808    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8887    .   1   1   30   TRP   CD1    C   11.224    7.347     -8.857    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8888    .   1   1   30   TRP   CD2    C   12.284    7.786     -6.939    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8889    .   1   1   30   TRP   CE2    C   13.239    7.709     -7.972    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8890    .   1   1   30   TRP   CE3    C   12.719    8.051     -5.639    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8891    .   1   1   30   TRP   CG     C   10.999    7.567     -7.528    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8892    .   1   1   30   TRP   CH2    C   14.992    8.145     -6.459    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8893    .   1   1   30   TRP   CZ2    C   14.597    7.887     -7.741    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8894    .   1   1   30   TRP   CZ3    C   14.069    8.227     -5.412    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8895    .   1   1   30   TRP   H      H   7.299     7.836     -5.924    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8896    .   1   1   30   TRP   HA     H   9.330     9.670     -6.881    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8897    .   1   1   30   TRP   HB2    H   9.886     7.470     -5.751    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8898    .   1   1   30   TRP   HB3    H   9.146     6.654     -7.119    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8899    .   1   1   30   TRP   HD1    H   10.446    7.142     -9.579    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8900    .   1   1   30   TRP   HE1    H   12.970    7.335     -10.022   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8901    .   1   1   30   TRP   HE3    H   12.017    8.118     -4.820    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8902    .   1   1   30   TRP   HH2    H   16.039    8.290     -6.236    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8903    .   1   1   30   TRP   HZ2    H   15.330    7.830     -8.533    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8904    .   1   1   30   TRP   HZ3    H   14.422    8.432     -4.413    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8905    .   1   1   30   TRP   N      N   7.641     8.709     -6.192    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8906    .   1   1   30   TRP   NE1    N   12.566    7.440     -9.130    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   NE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8907    .   1   1   30   TRP   O      O   7.803     7.668     -8.936    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   17   .   8908    .   1   1   30   TRP   OXT    O   8.267     9.780     -9.149    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   OXT    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   8909    .   1   1   1    TYR   C      C   -10.678   0.447     1.862     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   8910    .   1   1   1    TYR   CA     C   -12.045   0.713     2.475     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   8911    .   1   1   1    TYR   CB     C   -11.957   0.825     4.009     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   8912    .   1   1   1    TYR   CD1    C   -10.119   2.132     5.157     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   8913    .   1   1   1    TYR   CD2    C   -11.970   3.323     4.276     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   8914    .   1   1   1    TYR   CE1    C   -9.558    3.318     5.576     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   8915    .   1   1   1    TYR   CE2    C   -11.420   4.507     4.692     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   8916    .   1   1   1    TYR   CG     C   -11.337   2.116     4.500     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   8917    .   1   1   1    TYR   CZ     C   -10.215   4.503     5.337     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   8918    .   1   1   1    TYR   H1     H   -12.988   -0.398    1.061     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   H1     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   8919    .   1   1   1    TYR   H2     H   -13.870   -0.288    2.509     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   H2     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   8920    .   1   1   1    TYR   H3     H   -12.493   -1.281    2.398     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   H3     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   8921    .   1   1   1    TYR   HA     H   -12.442   1.627     2.057     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   8922    .   1   1   1    TYR   HB2    H   -12.954   0.772     4.412     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   8923    .   1   1   1    TYR   HB3    H   -11.372   0.002     4.394     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   8924    .   1   1   1    TYR   HD1    H   -9.602    1.202     5.345     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   8925    .   1   1   1    TYR   HD2    H   -12.924   3.336     3.768     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   8926    .   1   1   1    TYR   HE1    H   -8.606    3.311     6.087     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   8927    .   1   1   1    TYR   HE2    H   -11.940   5.434     4.500     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   8928    .   1   1   1    TYR   HH     H   -8.772    5.724     5.380     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HH     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   8929    .   1   1   1    TYR   N      N   -12.922   -0.383    2.100     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   8930    .   1   1   1    TYR   O      O   -10.420   -0.669    1.375     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   8931    .   1   1   1    TYR   OH     O   -9.666    5.683     5.746     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   OH     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   8932    .   1   1   2    CYS   C      C   -7.445    1.628     2.283     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   8933    .   1   1   2    CYS   CA     C   -8.521    1.287     1.266     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   8934    .   1   1   2    CYS   CB     C   -8.442    2.212     0.061     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   8935    .   1   1   2    CYS   H      H   -10.031   2.267     2.333     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   8936    .   1   1   2    CYS   HA     H   -8.394    0.266     0.942     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   8937    .   1   1   2    CYS   HB2    H   -9.333    2.111     -0.538    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   8938    .   1   1   2    CYS   HB3    H   -8.367    3.218     0.440     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   8939    .   1   1   2    CYS   N      N   -9.815    1.420     1.880     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   8940    .   1   1   2    CYS   O      O   -7.687    2.416     3.204     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   8941    .   1   1   2    CYS   SG     S   -7.020    1.934     -1.012    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   8942    .   1   1   3    GLN   C      C   -4.456    2.554     2.823     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   8943    .   1   1   3    GLN   CA     C   -5.197    1.254     3.075     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   8944    .   1   1   3    GLN   CB     C   -4.200    0.086     3.033     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   8945    .   1   1   3    GLN   CD     C   -5.500    -1.422    4.584     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   8946    .   1   1   3    GLN   CG     C   -4.812    -1.292    3.249     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   8947    .   1   1   3    GLN   H      H   -6.128    0.558     1.287     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   8948    .   1   1   3    GLN   HA     H   -5.645    1.292     4.056     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   8949    .   1   1   3    GLN   HB2    H   -3.676    0.096     2.092     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   8950    .   1   1   3    GLN   HB3    H   -3.474    0.251     3.816     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   8951    .   1   1   3    GLN   HE21   H   -3.804    -1.999    5.428     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HE21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   8952    .   1   1   3    GLN   HE22   H   -5.190    -1.872    6.462     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HE22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   8953    .   1   1   3    GLN   HG2    H   -5.538    -1.477    2.470     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   8954    .   1   1   3    GLN   HG3    H   -4.029    -2.034    3.188     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   8955    .   1   1   3    GLN   N      N   -6.272    1.074     2.108     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   8956    .   1   1   3    GLN   NE2    N   -4.760    -1.807    5.583     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   NE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   8957    .   1   1   3    GLN   O      O   -4.410    3.051     1.695     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   8958    .   1   1   3    GLN   OE1    O   -6.697    -1.170    4.713     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   OE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   8959    .   1   1   4    LYS   C      C   -1.676    3.983     3.597     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   8960    .   1   1   4    LYS   CA     C   -3.148    4.334     3.806     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   8961    .   1   1   4    LYS   CB     C   -3.358    5.123     5.106     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   8962    .   1   1   4    LYS   CD     C   -5.078    6.228     6.682     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   8963    .   1   1   4    LYS   CE     C   -4.737    7.728     6.589     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   8964    .   1   1   4    LYS   CG     C   -4.829    5.437     5.385     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   8965    .   1   1   4    LYS   H      H   -3.999    2.658     4.740     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   8966    .   1   1   4    LYS   HA     H   -3.502    4.913     2.966     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   8967    .   1   1   4    LYS   HB2    H   -2.967    4.550     5.934     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   8968    .   1   1   4    LYS   HB3    H   -2.823    6.055     5.035     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   8969    .   1   1   4    LYS   HD2    H   -6.124    6.138     6.940     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   8970    .   1   1   4    LYS   HD3    H   -4.489    5.780     7.468     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   8971    .   1   1   4    LYS   HE2    H   -5.258    8.145     5.740     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   8972    .   1   1   4    LYS   HE3    H   -5.092    8.214     7.485     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   8973    .   1   1   4    LYS   HG2    H   -5.209    6.023     4.562     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   8974    .   1   1   4    LYS   HG3    H   -5.370    4.503     5.431     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   8975    .   1   1   4    LYS   HZ1    H   -2.736    7.584     7.188     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   8976    .   1   1   4    LYS   HZ2    H   -3.148    9.039     6.471     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   8977    .   1   1   4    LYS   HZ3    H   -2.936    7.691     5.505     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   8978    .   1   1   4    LYS   N      N   -3.905    3.104     3.873     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   8979    .   1   1   4    LYS   NZ     N   -3.297    8.011     6.424     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   8980    .   1   1   4    LYS   O      O   -1.269    2.879     3.934     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   8981    .   1   1   5    TRP   C      C   1.366     4.322     4.015     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   8982    .   1   1   5    TRP   CA     C   0.544     4.612     2.759     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   8983    .   1   1   5    TRP   CB     C   1.228     5.726     1.907     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   8984    .   1   1   5    TRP   CD1    C   2.526     7.274     3.491     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   8985    .   1   1   5    TRP   CD2    C   0.724     8.223     2.585     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   8986    .   1   1   5    TRP   CE2    C   1.339     9.144     3.453     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   8987    .   1   1   5    TRP   CE3    C   -0.422    8.612     1.901     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   8988    .   1   1   5    TRP   CG     C   1.489     7.015     2.645     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   8989    .   1   1   5    TRP   CH2    C   -0.271    10.774    2.969     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   8990    .   1   1   5    TRP   CZ2    C   0.849     10.416    3.653     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   8991    .   1   1   5    TRP   CZ3    C   -0.905    9.888     2.096     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   8992    .   1   1   5    TRP   H      H   -1.223    5.824     2.951     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   8993    .   1   1   5    TRP   HA     H   0.518     3.701     2.179     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   8994    .   1   1   5    TRP   HB2    H   2.181     5.361     1.553     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   8995    .   1   1   5    TRP   HB3    H   0.603     5.947     1.055     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   8996    .   1   1   5    TRP   HD1    H   3.295     6.558     3.746     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   8997    .   1   1   5    TRP   HE1    H   3.041     8.938     4.643     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   8998    .   1   1   5    TRP   HE3    H   -0.931    7.945     1.222     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   8999    .   1   1   5    TRP   HH2    H   -0.685    11.764    3.093     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9000    .   1   1   5    TRP   HZ2    H   1.335     11.099    4.334     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9001    .   1   1   5    TRP   HZ3    H   -1.792    10.208    1.572     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9002    .   1   1   5    TRP   N      N   -0.868    4.922     3.091     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9003    .   1   1   5    TRP   NE1    N   2.422     8.534     3.996     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   NE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9004    .   1   1   5    TRP   O      O   2.403     3.683     3.955     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9005    .   1   1   6    MET   C      C   1.178     3.249     6.993     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9006    .   1   1   6    MET   CA     C   1.552     4.613     6.413     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9007    .   1   1   6    MET   CB     C   1.171     5.751     7.366     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9008    .   1   1   6    MET   CE     C   2.181     6.536     11.324    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9009    .   1   1   6    MET   CG     C   1.758     5.631     8.754     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9010    .   1   1   6    MET   H      H   0.076     5.353     5.092     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9011    .   1   1   6    MET   HA     H   2.619     4.640     6.243     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9012    .   1   1   6    MET   HB2    H   1.498     6.689     6.936     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9013    .   1   1   6    MET   HB3    H   0.094     5.776     7.454     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9014    .   1   1   6    MET   HE1    H   1.737     5.616     11.674    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9015    .   1   1   6    MET   HE2    H   2.060     7.304     12.075    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9016    .   1   1   6    MET   HE3    H   3.233     6.379     11.139    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9017    .   1   1   6    MET   HG2    H   1.357     4.738     9.213     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9018    .   1   1   6    MET   HG3    H   2.826     5.526     8.647     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9019    .   1   1   6    MET   N      N   0.894     4.812     5.137     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9020    .   1   1   6    MET   O      O   1.847     2.717     7.874     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9021    .   1   1   6    MET   SD     S   1.381     7.046     9.804     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   SD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9022    .   1   1   7    TRP   C      C   0.380     0.274     6.128     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9023    .   1   1   7    TRP   CA     C   -0.345    1.377     6.889     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9024    .   1   1   7    TRP   CB     C   -1.861    1.246     6.665     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9025    .   1   1   7    TRP   CD1    C   -2.327    2.937     8.561     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9026    .   1   1   7    TRP   CD2    C   -4.151    2.149     7.535     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9027    .   1   1   7    TRP   CE2    C   -4.554    3.052     8.532     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9028    .   1   1   7    TRP   CE3    C   -5.126    1.524     6.757     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9029    .   1   1   7    TRP   CG     C   -2.724    2.091     7.560     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9030    .   1   1   7    TRP   CH2    C   -6.822    2.717     7.991     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9031    .   1   1   7    TRP   CZ2    C   -5.892    3.343     8.769     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9032    .   1   1   7    TRP   CZ3    C   -6.449    1.814     6.992     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9033    .   1   1   7    TRP   H      H   -0.306    3.140     5.721     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9034    .   1   1   7    TRP   HA     H   -0.135    1.273     7.943     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9035    .   1   1   7    TRP   HB2    H   -2.081    1.540     5.650     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9036    .   1   1   7    TRP   HB3    H   -2.154    0.215     6.792     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9037    .   1   1   7    TRP   HD1    H   -1.298    3.114     8.839     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9038    .   1   1   7    TRP   HE1    H   -3.410    4.168     9.885     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9039    .   1   1   7    TRP   HE3    H   -4.855    0.821     5.984     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9040    .   1   1   7    TRP   HH2    H   -7.872    2.916     8.144     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9041    .   1   1   7    TRP   HZ2    H   -6.201    4.039     9.534     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9042    .   1   1   7    TRP   HZ3    H   -7.215    1.338     6.397     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9043    .   1   1   7    TRP   N      N   0.137     2.680     6.463     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9044    .   1   1   7    TRP   NE1    N   -3.427    3.519     9.145     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   NE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9045    .   1   1   7    TRP   O      O   1.380     0.523     5.434     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9046    .   1   1   8    THR   C      C   -0.668    -2.768    4.853     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9047    .   1   1   8    THR   CA     C   0.470     -2.056    5.602     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9048    .   1   1   8    THR   CB     C   1.128     -3.016    6.640     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9049    .   1   1   8    THR   CG2    C   2.313     -2.352    7.344     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   CG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9050    .   1   1   8    THR   H      H   -0.862    -1.099    6.854     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9051    .   1   1   8    THR   HA     H   1.222     -1.688    4.915     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9052    .   1   1   8    THR   HB     H   1.481     -3.896    6.120     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9053    .   1   1   8    THR   HG1    H   0.688     -3.645    8.422     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HG1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9054    .   1   1   8    THR   HG21   H   1.977     -1.440    7.811     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HG21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9055    .   1   1   8    THR   HG22   H   3.098     -2.118    6.642     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HG22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9056    .   1   1   8    THR   HG23   H   2.701     -3.013    8.104     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HG23   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9057    .   1   1   8    THR   N      N   -0.089    -0.926    6.274     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9058    .   1   1   8    THR   O      O   -1.854    -2.439    5.086     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9059    .   1   1   8    THR   OG1    O   0.172     -3.421    7.637     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   OG1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9060    .   1   1   9    CYS   C      C   -1.127    -5.884    3.206     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9061    .   1   1   9    CYS   CA     C   -1.445    -4.405    3.320     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9062    .   1   1   9    CYS   CB     C   -1.854    -3.765    1.982     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9063    .   1   1   9    CYS   H      H   0.538     -3.944    3.654     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9064    .   1   1   9    CYS   HA     H   -2.277    -4.327    4.005     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9065    .   1   1   9    CYS   HB2    H   -2.662    -4.338    1.551     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9066    .   1   1   9    CYS   HB3    H   -2.209    -2.765    2.178     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9067    .   1   1   9    CYS   N      N   -0.371    -3.695    3.951     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9068    .   1   1   9    CYS   O      O   -0.096    -6.345    3.719     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9069    .   1   1   9    CYS   SG     S   -0.553    -3.656    0.727     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9070    .   1   1   10   ASP   C      C   -2.416    -8.405    1.096     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9071    .   1   1   10   ASP   CA     C   -1.895    -8.060    2.455     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9072    .   1   1   10   ASP   CB     C   -2.791    -8.820    3.465     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9073    .   1   1   10   ASP   CG     C   -2.447    -8.652    4.913     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9074    .   1   1   10   ASP   H      H   -2.812    -6.204    2.194     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9075    .   1   1   10   ASP   HA     H   -0.868    -8.367    2.576     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9076    .   1   1   10   ASP   HB2    H   -3.809    -8.480    3.340     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9077    .   1   1   10   ASP   HB3    H   -2.757    -9.870    3.220     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9078    .   1   1   10   ASP   N      N   -2.024    -6.624    2.610     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9079    .   1   1   10   ASP   O      O   -2.593    -7.528    0.251     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9080    .   1   1   10   ASP   OD1    O   -1.528    -9.316    5.400     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   OD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9081    .   1   1   10   ASP   OD2    O   -3.141    -7.910    5.604     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   OD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9082    .   1   1   11   SER   C      C   -4.859    -9.790    -0.047    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9083    .   1   1   11   SER   CA     C   -3.367    -10.100   -0.286    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9084    .   1   1   11   SER   CB     C   -3.135    -11.593   -0.469    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9085    .   1   1   11   SER   H      H   -2.298    -10.351   1.484     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9086    .   1   1   11   SER   HA     H   -3.006    -9.554    -1.145    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9087    .   1   1   11   SER   HB2    H   -3.621    -12.127   0.334     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9088    .   1   1   11   SER   HB3    H   -3.532    -11.915   -1.420    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9089    .   1   1   11   SER   HG     H   -1.588    -12.785   -0.709    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   HG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9090    .   1   1   11   SER   N      N   -2.654    -9.668    0.877     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9091    .   1   1   11   SER   O      O   -5.606    -9.471    -0.971    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9092    .   1   1   11   SER   OG     O   -1.738    -11.872   -0.431    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   OG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9093    .   1   1   12   GLU   C      C   -6.807    -8.017    1.678     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9094    .   1   1   12   GLU   CA     C   -6.594    -9.537    1.681     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9095    .   1   1   12   GLU   CB     C   -6.783    -10.085   3.101     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9096    .   1   1   12   GLU   CD     C   -6.464    -12.018   4.680     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9097    .   1   1   12   GLU   CG     C   -6.445    -11.561   3.245     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9098    .   1   1   12   GLU   H      H   -4.561    -10.063   1.897     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9099    .   1   1   12   GLU   HA     H   -7.296    -10.010   1.013     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9100    .   1   1   12   GLU   HB2    H   -6.149    -9.532    3.778     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9101    .   1   1   12   GLU   HB3    H   -7.813    -9.944    3.396     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9102    .   1   1   12   GLU   HG2    H   -7.169    -12.141   2.691     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9103    .   1   1   12   GLU   HG3    H   -5.461    -11.734   2.836     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9104    .   1   1   12   GLU   N      N   -5.240    -9.827    1.234     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9105    .   1   1   12   GLU   O      O   -7.503    -7.476    0.805     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9106    .   1   1   12   GLU   OE1    O   -7.357    -12.797   5.064     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   OE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9107    .   1   1   12   GLU   OE2    O   -5.576    -11.595   5.457     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   OE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9108    .   1   1   13   ARG   C      C   -5.512    -5.297    1.548     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9109    .   1   1   13   ARG   CA     C   -6.212    -5.880    2.744     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9110    .   1   1   13   ARG   CB     C   -5.512    -5.375    4.026     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9111    .   1   1   13   ARG   CD     C   -5.379    -5.230    6.539     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9112    .   1   1   13   ARG   CG     C   -6.123    -5.838    5.345     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9113    .   1   1   13   ARG   CZ     C   -2.939    -4.930    7.095     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   CZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9114    .   1   1   13   ARG   H      H   -5.619    -7.829    3.290     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9115    .   1   1   13   ARG   HA     H   -7.244    -5.567    2.745     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9116    .   1   1   13   ARG   HB2    H   -4.485    -5.709    4.006     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9117    .   1   1   13   ARG   HB3    H   -5.518    -4.295    4.011     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9118    .   1   1   13   ARG   HD2    H   -5.420    -4.153    6.453     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9119    .   1   1   13   ARG   HD3    H   -5.870    -5.534    7.452     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9120    .   1   1   13   ARG   HE     H   -3.768    -6.538    6.206     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9121    .   1   1   13   ARG   HG2    H   -7.156    -5.529    5.380     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9122    .   1   1   13   ARG   HG3    H   -6.062    -6.915    5.402     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9123    .   1   1   13   ARG   HH11   H   -4.062    -3.355    7.764     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HH11   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9124    .   1   1   13   ARG   HH12   H   -2.395    -3.191    8.039     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HH12   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9125    .   1   1   13   ARG   HH21   H   -1.524    -6.326    6.649     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HH21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9126    .   1   1   13   ARG   HH22   H   -0.926    -4.898    7.397     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HH22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9127    .   1   1   13   ARG   N      N   -6.159    -7.336    2.640     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9128    .   1   1   13   ARG   NE     N   -3.964    -5.642    6.590     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   NE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9129    .   1   1   13   ARG   NH1    N   -3.147    -3.751    7.674     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   NH1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9130    .   1   1   13   ARG   NH2    N   -1.710    -5.423    7.047     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   NH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9131    .   1   1   13   ARG   O      O   -4.326    -5.535    1.358     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9132    .   1   1   14   LYS   C      C   -5.354    -2.540    -0.317    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9133    .   1   1   14   LYS   CA     C   -5.662    -4.016    -0.454    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9134    .   1   1   14   LYS   CB     C   -6.570    -4.328    -1.648    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9135    .   1   1   14   LYS   CD     C   -8.906    -4.375    -2.608    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9136    .   1   1   14   LYS   CE     C   -8.952    -5.901    -2.727    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9137    .   1   1   14   LYS   CG     C   -8.022    -3.916    -1.456    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9138    .   1   1   14   LYS   H      H   -7.140    -4.315    1.001     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9139    .   1   1   14   LYS   HA     H   -4.720    -4.524    -0.604    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9140    .   1   1   14   LYS   HB2    H   -6.186    -3.820    -2.520    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9141    .   1   1   14   LYS   HB3    H   -6.537    -5.393    -1.821    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9142    .   1   1   14   LYS   HD2    H   -9.910    -4.008    -2.447    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9143    .   1   1   14   LYS   HD3    H   -8.519    -3.964    -3.528    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9144    .   1   1   14   LYS   HE2    H   -9.584    -6.159    -3.565    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9145    .   1   1   14   LYS   HE3    H   -7.955    -6.270    -2.913    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9146    .   1   1   14   LYS   HG2    H   -8.391    -4.350    -0.539    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9147    .   1   1   14   LYS   HG3    H   -8.059    -2.840    -1.386    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9148    .   1   1   14   LYS   HZ1    H   -9.530    -7.587    -1.652    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9149    .   1   1   14   LYS   HZ2    H   -10.462   -6.224    -1.319    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9150    .   1   1   14   LYS   HZ3    H   -8.917    -6.364    -0.666    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9151    .   1   1   14   LYS   N      N   -6.218    -4.553    0.758     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9152    .   1   1   14   LYS   NZ     N   -9.496    -6.558    -1.510    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9153    .   1   1   14   LYS   O      O   -6.192    -1.746    0.137     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9154    .   1   1   15   CYS   C      C   -4.092    -0.055    -1.803    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9155    .   1   1   15   CYS   CA     C   -3.690    -0.827    -0.554    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9156    .   1   1   15   CYS   CB     C   -2.181    -0.815    -0.352    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9157    .   1   1   15   CYS   H      H   -3.548    -2.861    -1.046    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9158    .   1   1   15   CYS   HA     H   -4.177    -0.379    0.298     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9159    .   1   1   15   CYS   HB2    H   -1.901    -1.649    0.273     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9160    .   1   1   15   CYS   HB3    H   -1.703    -0.926    -1.314    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9161    .   1   1   15   CYS   N      N   -4.152    -2.184    -0.675    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9162    .   1   1   15   CYS   O      O   -4.384    -0.661    -2.841    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9163    .   1   1   15   CYS   SG     S   -1.524    0.684     0.419     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9164    .   1   1   16   CYS   C      C   -3.700    2.072     -4.017    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9165    .   1   1   16   CYS   CA     C   -4.592    2.092     -2.792    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9166    .   1   1   16   CYS   CB     C   -4.792    3.530     -2.308    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9167    .   1   1   16   CYS   H      H   -3.792    1.693     -0.894    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9168    .   1   1   16   CYS   HA     H   -5.560    1.709     -3.076    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9169    .   1   1   16   CYS   HB2    H   -3.853    3.904     -1.925    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9170    .   1   1   16   CYS   HB3    H   -5.102    4.142     -3.141    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9171    .   1   1   16   CYS   N      N   -4.107    1.249     -1.711    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9172    .   1   1   16   CYS   O      O   -2.486    1.831     -3.934    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9173    .   1   1   16   CYS   SG     S   -6.034    3.705     -0.989    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9174    .   1   1   17   LYS   C      C   -2.931    3.751     -6.362    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9175    .   1   1   17   LYS   CA     C   -3.587    2.399     -6.380    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9176    .   1   1   17   LYS   CB     C   -4.519    2.206     -7.558    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9177    .   1   1   17   LYS   CD     C   -6.179    0.643     -8.601    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9178    .   1   1   17   LYS   CE     C   -6.759    -0.758    -8.553    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9179    .   1   1   17   LYS   CG     C   -5.075    0.797     -7.595    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9180    .   1   1   17   LYS   H      H   -5.290    2.308     -5.175    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9181    .   1   1   17   LYS   HA     H   -2.815    1.643     -6.392    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9182    .   1   1   17   LYS   HB2    H   -5.338    2.905     -7.478    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9183    .   1   1   17   LYS   HB3    H   -3.981    2.386     -8.477    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9184    .   1   1   17   LYS   HD2    H   -6.958    1.356     -8.373    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9185    .   1   1   17   LYS   HD3    H   -5.787    0.833     -9.589    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9186    .   1   1   17   LYS   HE2    H   -7.555    -0.822    -9.278    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9187    .   1   1   17   LYS   HE3    H   -5.981    -1.461    -8.810    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9188    .   1   1   17   LYS   HG2    H   -4.276    0.120     -7.861    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9189    .   1   1   17   LYS   HG3    H   -5.443    0.536     -6.614    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9190    .   1   1   17   LYS   HZ1    H   -7.999    -0.391    -6.906    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9191    .   1   1   17   LYS   HZ2    H   -6.551    -1.137    -6.493    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9192    .   1   1   17   LYS   HZ3    H   -7.778    -2.020    -7.226    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9193    .   1   1   17   LYS   N      N   -4.309    2.258     -5.155    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9194    .   1   1   17   LYS   NZ     N   -7.300    -1.097    -7.212    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9195    .   1   1   17   LYS   O      O   -3.542    4.750     -5.953    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9196    .   1   1   18   GLY   C      C   0.013     4.689     -5.378    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9197    .   1   1   18   GLY   CA     C   -0.904    4.952     -6.546    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9198    .   1   1   18   GLY   H      H   -1.309    3.014     -7.217    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9199    .   1   1   18   GLY   HA2    H   -0.326    5.159     -7.435    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   HA2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9200    .   1   1   18   GLY   HA3    H   -1.538    5.794     -6.311    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   HA3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9201    .   1   1   18   GLY   N      N   -1.704    3.783     -6.750    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9202    .   1   1   18   GLY   O      O   0.740     5.557     -4.918    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9203    .   1   1   19   MET   C      C   1.133     1.572     -4.196    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9204    .   1   1   19   MET   CA     C   0.744     2.981     -3.812    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9205    .   1   1   19   MET   CB     C   -0.012    2.952     -2.466    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9206    .   1   1   19   MET   CE     C   -1.984    5.941     -0.348    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9207    .   1   1   19   MET   CG     C   -0.447    4.312     -1.964    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9208    .   1   1   19   MET   H      H   -0.791    2.874     -5.184    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9209    .   1   1   19   MET   HA     H   1.624     3.600     -3.727    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9210    .   1   1   19   MET   HB2    H   -0.895    2.343     -2.583    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9211    .   1   1   19   MET   HB3    H   0.625     2.501     -1.722    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9212    .   1   1   19   MET   HE1    H   -2.614    6.063     0.520     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9213    .   1   1   19   MET   HE2    H   -2.520    6.266     -1.228    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9214    .   1   1   19   MET   HE3    H   -1.087    6.531     -0.237    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9215    .   1   1   19   MET   HG2    H   0.454     4.826     -1.661    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9216    .   1   1   19   MET   HG3    H   -0.937    4.854     -2.759    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9217    .   1   1   19   MET   N      N   -0.092    3.483     -4.860    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9218    .   1   1   19   MET   O      O   0.493     0.958     -5.076    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9219    .   1   1   19   MET   SD     S   -1.538    4.219     -0.534    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   SD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9220    .   1   1   20   VAL   C      C   2.128     -1.121    -2.661    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9221    .   1   1   20   VAL   CA     C   2.564     -0.282    -3.829    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9222    .   1   1   20   VAL   CB     C   4.106     -0.367    -3.986    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9223    .   1   1   20   VAL   CG1    C   4.544     -1.792    -4.282    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   CG1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9224    .   1   1   20   VAL   CG2    C   4.593     0.577     -5.078    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   CG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9225    .   1   1   20   VAL   H      H   2.595     1.597     -2.890    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9226    .   1   1   20   VAL   HA     H   2.086     -0.633    -4.731    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9227    .   1   1   20   VAL   HB     H   4.555     -0.066    -3.052    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9228    .   1   1   20   VAL   HG11   H   4.220     -2.439    -3.482    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG11   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9229    .   1   1   20   VAL   HG12   H   5.621     -1.824    -4.359    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG12   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9230    .   1   1   20   VAL   HG13   H   4.105     -2.119    -5.214    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG13   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9231    .   1   1   20   VAL   HG21   H   4.334     1.591     -4.816    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9232    .   1   1   20   VAL   HG22   H   4.123     0.315     -6.014    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9233    .   1   1   20   VAL   HG23   H   5.665     0.492     -5.177    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG23   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9234    .   1   1   20   VAL   N      N   2.129     1.057     -3.571    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9235    .   1   1   20   VAL   O      O   2.425     -0.791    -1.505    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9236    .   1   1   21   CYS   C      C   1.823     -4.133    -1.673    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9237    .   1   1   21   CYS   CA     C   0.858     -2.999    -1.930    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9238    .   1   1   21   CYS   CB     C   -0.520    -3.533    -2.326    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9239    .   1   1   21   CYS   H      H   1.213     -2.392    -3.885    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9240    .   1   1   21   CYS   HA     H   0.761     -2.413    -1.029    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9241    .   1   1   21   CYS   HB2    H   -1.125    -2.716    -2.687    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9242    .   1   1   21   CYS   HB3    H   -0.392    -4.257    -3.116    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9243    .   1   1   21   CYS   N      N   1.385     -2.153    -2.949    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9244    .   1   1   21   CYS   O      O   2.109     -4.941    -2.564    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9245    .   1   1   21   CYS   SG     S   -1.445    -4.347    -0.969    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9246    .   1   1   22   ARG   C      C   2.984     -5.403    1.419     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9247    .   1   1   22   ARG   CA     C   3.266     -5.158    -0.026    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9248    .   1   1   22   ARG   CB     C   4.727     -4.685    -0.163    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9249    .   1   1   22   ARG   CD     C   5.444     -6.083    -2.178    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9250    .   1   1   22   ARG   CG     C   5.318     -4.683    -1.548    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9251    .   1   1   22   ARG   CZ     C   3.937     -8.071    -2.217    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   CZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9252    .   1   1   22   ARG   H      H   2.122     -3.445    0.152     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9253    .   1   1   22   ARG   HA     H   3.130     -6.063    -0.601    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9254    .   1   1   22   ARG   HB2    H   4.764     -3.662    0.184     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9255    .   1   1   22   ARG   HB3    H   5.378     -5.258    0.473     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9256    .   1   1   22   ARG   HD2    H   5.922     -5.976    -3.141    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9257    .   1   1   22   ARG   HD3    H   6.071     -6.694    -1.548    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9258    .   1   1   22   ARG   HE     H   3.416     -6.158    -2.651    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9259    .   1   1   22   ARG   HG2    H   4.748     -4.028    -2.185    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9260    .   1   1   22   ARG   HG3    H   6.307     -4.302    -1.357    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9261    .   1   1   22   ARG   HH11   H   5.879     -8.552    -1.730    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HH11   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9262    .   1   1   22   ARG   HH12   H   4.800     -9.874    -1.737    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HH12   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9263    .   1   1   22   ARG   HH21   H   1.941     -7.975    -2.655    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HH21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9264    .   1   1   22   ARG   HH22   H   2.510     -9.537    -2.268    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HH22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9265    .   1   1   22   ARG   N      N   2.358     -4.148    -0.491    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9266    .   1   1   22   ARG   NE     N   4.156     -6.758    -2.383    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   NE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9267    .   1   1   22   ARG   NH1    N   4.943     -8.890    -1.874    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   NH1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9268    .   1   1   22   ARG   NH2    N   2.716     -8.562    -2.395    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   NH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9269    .   1   1   22   ARG   O      O   1.891     -5.038    1.935     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9270    .   1   1   23   LEU   C      C   3.571     -4.870    4.243     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9271    .   1   1   23   LEU   CA     C   3.888     -6.179    3.553     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9272    .   1   1   23   LEU   CB     C   5.169     -6.789    4.147     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9273    .   1   1   23   LEU   CD1    C   6.752     -8.698    4.467     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9274    .   1   1   23   LEU   CD2    C   4.297     -9.116    4.511     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9275    .   1   1   23   LEU   CG     C   5.409     -8.279    3.894     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9276    .   1   1   23   LEU   H      H   4.769     -6.229    1.575     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9277    .   1   1   23   LEU   HA     H   3.059     -6.848    3.722     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9278    .   1   1   23   LEU   HB2    H   6.011     -6.247    3.745     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9279    .   1   1   23   LEU   HB3    H   5.146     -6.630    5.215     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9280    .   1   1   23   LEU   HD11   H   6.906     -9.751    4.284     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD11   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9281    .   1   1   23   LEU   HD12   H   6.765     -8.510    5.529     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD12   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9282    .   1   1   23   LEU   HD13   H   7.538     -8.132    3.990     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD13   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9283    .   1   1   23   LEU   HD21   H   4.242     -8.918    5.572     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9284    .   1   1   23   LEU   HD22   H   4.515     -10.162   4.357     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9285    .   1   1   23   LEU   HD23   H   3.353     -8.876    4.047     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD23   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9286    .   1   1   23   LEU   HG     H   5.422     -8.466    2.832     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9287    .   1   1   23   LEU   N      N   3.976     -5.969    2.103     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9288    .   1   1   23   LEU   O      O   2.937     -4.853    5.284     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9289    .   1   1   24   TRP   C      C   3.258     -1.668    2.859     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9290    .   1   1   24   TRP   CA     C   3.691     -2.474    4.090     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9291    .   1   1   24   TRP   CB     C   4.900     -1.817    4.790     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9292    .   1   1   24   TRP   CD1    C   6.189     -0.187    3.338     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9293    .   1   1   24   TRP   CD2    C   7.088     -2.224    3.381     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9294    .   1   1   24   TRP   CE2    C   7.876     -1.403    2.548     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9295    .   1   1   24   TRP   CE3    C   7.460     -3.554    3.562     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9296    .   1   1   24   TRP   CG     C   6.014     -1.414    3.872     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9297    .   1   1   24   TRP   CH2    C   9.348     -3.181    2.100     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9298    .   1   1   24   TRP   CZ2    C   9.009     -1.872    1.903     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9299    .   1   1   24   TRP   CZ3    C   8.585     -4.019    2.921     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9300    .   1   1   24   TRP   H      H   4.541     -3.864    2.823     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9301    .   1   1   24   TRP   HA     H   2.869     -2.573    4.777     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9302    .   1   1   24   TRP   HB2    H   4.568     -0.929    5.306     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9303    .   1   1   24   TRP   HB3    H   5.300     -2.511    5.516     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9304    .   1   1   24   TRP   HD1    H   5.507     0.627     3.539     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9305    .   1   1   24   TRP   HE1    H   7.609     0.640     2.059     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9306    .   1   1   24   TRP   HE3    H   6.882     -4.211    4.195     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9307    .   1   1   24   TRP   HH2    H   10.223    -3.590    1.616     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9308    .   1   1   24   TRP   HZ2    H   9.612     -1.242    1.264     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9309    .   1   1   24   TRP   HZ3    H   8.888     -5.049    3.047     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9310    .   1   1   24   TRP   N      N   4.007     -3.787    3.641     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9311    .   1   1   24   TRP   NE1    N   7.303     -0.160    2.543     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   NE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9312    .   1   1   24   TRP   O      O   3.539     -2.085    1.728     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9313    .   1   1   25   CYS   C      C   3.311     1.258     1.657     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9314    .   1   1   25   CYS   CA     C   2.201     0.280     1.944     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9315    .   1   1   25   CYS   CB     C   0.890     1.020     2.185     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9316    .   1   1   25   CYS   H      H   2.293     -0.291    3.959     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9317    .   1   1   25   CYS   HA     H   2.090     -0.361    1.081     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9318    .   1   1   25   CYS   HB2    H   0.913     1.474     3.166     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9319    .   1   1   25   CYS   HB3    H   0.797     1.794     1.439     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9320    .   1   1   25   CYS   N      N   2.566     -0.572    3.057     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9321    .   1   1   25   CYS   O      O   3.962     1.764     2.576     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9322    .   1   1   25   CYS   SG     S   -0.598    -0.016    2.096     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9323    .   1   1   26   LYS   C      C   4.012     3.294     -1.104    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9324    .   1   1   26   LYS   CA     C   4.580     2.389     -0.030    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9325    .   1   1   26   LYS   CB     C   5.741     1.540     -0.578    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9326    .   1   1   26   LYS   CD     C   8.066     1.435     -1.577    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9327    .   1   1   26   LYS   CE     C   7.629     0.557     -2.745    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9328    .   1   1   26   LYS   CG     C   6.931     2.335     -1.084    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9329    .   1   1   26   LYS   H      H   2.961     1.101     -0.283    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9330    .   1   1   26   LYS   HA     H   4.925     2.972     0.810     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9331    .   1   1   26   LYS   HB2    H   6.089     0.882     0.203     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9332    .   1   1   26   LYS   HB3    H   5.361     0.940     -1.393    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9333    .   1   1   26   LYS   HD2    H   8.890     2.055     -1.898    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9334    .   1   1   26   LYS   HD3    H   8.389     0.804     -0.762    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9335    .   1   1   26   LYS   HE2    H   6.876     -0.134    -2.395    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9336    .   1   1   26   LYS   HE3    H   7.206     1.184     -3.514    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9337    .   1   1   26   LYS   HG2    H   6.601     2.962     -1.900    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9338    .   1   1   26   LYS   HG3    H   7.285     2.958     -0.280    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9339    .   1   1   26   LYS   HZ1    H   8.421     -0.812    -4.104    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9340    .   1   1   26   LYS   HZ2    H   9.158     -0.866    -2.601    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9341    .   1   1   26   LYS   HZ3    H   9.497     0.403     -3.664    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9342    .   1   1   26   LYS   N      N   3.533     1.510     0.403     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9343    .   1   1   26   LYS   NZ     N   8.748     -0.227    -3.309    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9344    .   1   1   26   LYS   O      O   3.170     2.857     -1.870    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9345    .   1   1   27   LYS   C      C   4.447     5.145     -3.537    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9346    .   1   1   27   LYS   CA     C   3.942     5.491     -2.135    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9347    .   1   1   27   LYS   CB     C   4.386     6.914     -1.790    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9348    .   1   1   27   LYS   CD     C   6.285     8.536     -1.517    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9349    .   1   1   27   LYS   CE     C   7.790     8.695     -1.417    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9350    .   1   1   27   LYS   CG     C   5.899     7.108     -1.820    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9351    .   1   1   27   LYS   H      H   5.097     4.843     -0.481    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9352    .   1   1   27   LYS   HA     H   2.864     5.455     -2.128    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9353    .   1   1   27   LYS   HB2    H   3.943     7.596     -2.502    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9354    .   1   1   27   LYS   HB3    H   4.031     7.163     -0.800    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9355    .   1   1   27   LYS   HD2    H   5.921     9.167     -2.313    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9356    .   1   1   27   LYS   HD3    H   5.831     8.837     -0.585    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9357    .   1   1   27   LYS   HE2    H   8.232     8.410     -2.360    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9358    .   1   1   27   LYS   HE3    H   8.016     9.731     -1.215    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9359    .   1   1   27   LYS   HG2    H   6.362     6.455     -1.097    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9360    .   1   1   27   LYS   HG3    H   6.255     6.852     -2.806    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9361    .   1   1   27   LYS   HZ1    H   7.908     8.028     0.574     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9362    .   1   1   27   LYS   HZ2    H   9.371     8.077     -0.216    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9363    .   1   1   27   LYS   HZ3    H   8.296     6.837     -0.564    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9364    .   1   1   27   LYS   N      N   4.438     4.540     -1.141    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9365    .   1   1   27   LYS   NZ     N   8.365     7.850     -0.344    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9366    .   1   1   27   LYS   O      O   5.408     4.371     -3.705    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9367    .   1   1   28   LYS   C      C   3.586     6.781     -6.591    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9368    .   1   1   28   LYS   CA     C   4.180     5.576     -5.887    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9369    .   1   1   28   LYS   CB     C   3.577     4.282     -6.468    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9370    .   1   1   28   LYS   CD     C   5.628     3.371     -7.603    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9371    .   1   1   28   LYS   CE     C   6.215     2.713     -8.852    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9372    .   1   1   28   LYS   CG     C   4.178     3.814     -7.790    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9373    .   1   1   28   LYS   H      H   3.008     6.265     -4.363    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9374    .   1   1   28   LYS   HA     H   5.255     5.568     -5.974    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9375    .   1   1   28   LYS   HB2    H   3.708     3.490     -5.745    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9376    .   1   1   28   LYS   HB3    H   2.518     4.439     -6.613    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9377    .   1   1   28   LYS   HD2    H   6.231     4.234     -7.362    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9378    .   1   1   28   LYS   HD3    H   5.670     2.669     -6.784    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9379    .   1   1   28   LYS   HE2    H   7.198     2.335     -8.617    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9380    .   1   1   28   LYS   HE3    H   5.577     1.884     -9.126    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9381    .   1   1   28   LYS   HG2    H   3.594     2.991     -8.173    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9382    .   1   1   28   LYS   HG3    H   4.147     4.644     -8.482    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9383    .   1   1   28   LYS   HZ1    H   6.874     4.481     -9.753    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9384    .   1   1   28   LYS   HZ2    H   5.410     3.914     -10.411   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9385    .   1   1   28   LYS   HZ3    H   6.854     3.158     -10.761   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9386    .   1   1   28   LYS   N      N   3.804     5.713     -4.519    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9387    .   1   1   28   LYS   NZ     N   6.328     3.632     -10.000   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9388    .   1   1   28   LYS   O      O   2.614     7.359     -6.101    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9389    .   1   1   29   LEU   C      C   3.013     7.675     -9.670    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9390    .   1   1   29   LEU   CA     C   3.615     8.280     -8.434    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9391    .   1   1   29   LEU   CB     C   4.662     9.370     -8.785    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9392    .   1   1   29   LEU   CD1    C   4.088     10.902    -6.845    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9393    .   1   1   29   LEU   CD2    C   6.129     9.453     -6.696    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9394    .   1   1   29   LEU   CG     C   5.214     10.241    -7.623    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9395    .   1   1   29   LEU   H      H   5.011     6.786     -7.960    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9396    .   1   1   29   LEU   HA     H   2.815     8.713     -7.850    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9397    .   1   1   29   LEU   HB2    H   5.503     8.881     -9.253    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9398    .   1   1   29   LEU   HB3    H   4.218     10.029    -9.516    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9399    .   1   1   29   LEU   HD11   H   3.497     11.512    -7.512    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD11   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9400    .   1   1   29   LEU   HD12   H   4.508     11.527    -6.072    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD12   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9401    .   1   1   29   LEU   HD13   H   3.462     10.147    -6.394    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD13   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9402    .   1   1   29   LEU   HD21   H   5.575     8.641     -6.250    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9403    .   1   1   29   LEU   HD22   H   6.513     10.100    -5.922    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9404    .   1   1   29   LEU   HD23   H   6.951     9.049     -7.269    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD23   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9405    .   1   1   29   LEU   HG     H   5.787     11.044    -8.066    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9406    .   1   1   29   LEU   N      N   4.177     7.204     -7.659    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9407    .   1   1   29   LEU   O      O   1.789     7.565     -9.794    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9408    .   1   1   30   TRP   C      C   4.488     5.402     -11.859   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9409    .   1   1   30   TRP   CA     C   3.482     6.512     -11.718   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9410    .   1   1   30   TRP   CB     C   3.494     7.391     -12.994   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9411    .   1   1   30   TRP   CD1    C   2.899     9.886     -12.994   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9412    .   1   1   30   TRP   CD2    C   1.114     8.540     -13.046   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9413    .   1   1   30   TRP   CE2    C   0.668     9.876     -13.066   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9414    .   1   1   30   TRP   CE3    C   0.165     7.520     -13.066   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9415    .   1   1   30   TRP   CG     C   2.552     8.570     -13.008   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9416    .   1   1   30   TRP   CH2    C   -1.586    9.190     -13.127   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9417    .   1   1   30   TRP   CZ2    C   -0.681    10.213    -13.108   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9418    .   1   1   30   TRP   CZ3    C   -1.174    7.853     -13.105   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9419    .   1   1   30   TRP   H      H   4.827     7.352     -10.397   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9420    .   1   1   30   TRP   HA     H   2.502     6.088     -11.559   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9421    .   1   1   30   TRP   HB2    H   4.488     7.785     -13.130   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9422    .   1   1   30   TRP   HB3    H   3.256     6.767     -13.842   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9423    .   1   1   30   TRP   HD1    H   3.919     10.241    -12.965   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9424    .   1   1   30   TRP   HE1    H   1.765     11.660    -13.047   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9425    .   1   1   30   TRP   HE3    H   0.468     6.484     -13.048   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9426    .   1   1   30   TRP   HH2    H   -2.644    9.405     -13.156   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9427    .   1   1   30   TRP   HZ2    H   -1.018    11.240    -13.126   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9428    .   1   1   30   TRP   HZ3    H   -1.921    7.071     -13.120   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9429    .   1   1   30   TRP   N      N   3.864     7.228     -10.539   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9430    .   1   1   30   TRP   NE1    N   1.770     10.674    -13.045   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   NE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9431    .   1   1   30   TRP   O      O   4.195     4.253     -11.475   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   18   .   9432    .   1   1   30   TRP   OXT    O   5.637     5.692     -12.232   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   OXT    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9433    .   1   1   1    TYR   C      C   -10.604   -0.094    2.206     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9434    .   1   1   1    TYR   CA     C   -11.844   0.192     3.034     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9435    .   1   1   1    TYR   CB     C   -12.508   1.498     2.546     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9436    .   1   1   1    TYR   CD1    C   -13.585   2.850     4.394     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9437    .   1   1   1    TYR   CD2    C   -14.985   1.456     3.066     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9438    .   1   1   1    TYR   CE1    C   -14.675   3.259     5.131     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9439    .   1   1   1    TYR   CE2    C   -16.084   1.862     3.799     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9440    .   1   1   1    TYR   CG     C   -13.717   1.941     3.351     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9441    .   1   1   1    TYR   CZ     C   -15.924   2.764     4.831     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9442    .   1   1   1    TYR   H1     H   -12.287   0.514     5.029     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   H1     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9443    .   1   1   1    TYR   H2     H   -10.713   0.987     4.591     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   H2     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9444    .   1   1   1    TYR   H3     H   -11.093   -0.630    4.745     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   H3     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9445    .   1   1   1    TYR   HA     H   -12.536   -0.628    2.928     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9446    .   1   1   1    TYR   HB2    H   -11.784   2.298     2.573     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9447    .   1   1   1    TYR   HB3    H   -12.825   1.359     1.522     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9448    .   1   1   1    TYR   HD1    H   -12.608   3.244     4.635     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9449    .   1   1   1    TYR   HD2    H   -15.113   0.750     2.259     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9450    .   1   1   1    TYR   HE1    H   -14.537   3.967     5.936     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9451    .   1   1   1    TYR   HE2    H   -17.060   1.468     3.555     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9452    .   1   1   1    TYR   HH     H   -17.549   2.406     5.824     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HH     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9453    .   1   1   1    TYR   N      N   -11.467   0.289     4.435     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9454    .   1   1   1    TYR   O      O   -10.485   -1.143    1.577     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9455    .   1   1   1    TYR   OH     O   -17.018   3.174     5.568     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   OH     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9456    .   1   1   2    CYS   C      C   -7.276    1.036     2.384     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9457    .   1   1   2    CYS   CA     C   -8.457    0.721     1.488     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9458    .   1   1   2    CYS   CB     C   -8.542    1.713     0.343     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9459    .   1   1   2    CYS   H      H   -9.739    1.611     2.826     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9460    .   1   1   2    CYS   HA     H   -8.364    -0.278    1.090     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9461    .   1   1   2    CYS   HB2    H   -9.408    1.490     -0.258    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9462    .   1   1   2    CYS   HB3    H   -8.634    2.693     0.782     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9463    .   1   1   2    CYS   N      N   -9.663    0.814     2.258     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9464    .   1   1   2    CYS   O      O   -7.437    1.694     3.418     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9465    .   1   1   2    CYS   SG     S   -7.120    1.745     -0.766    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9466    .   1   1   3    GLN   C      C   -4.138    1.990     2.390     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9467    .   1   1   3    GLN   CA     C   -4.938    0.784     2.822     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9468    .   1   1   3    GLN   CB     C   -4.069    -0.463    2.884     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9469    .   1   1   3    GLN   CD     C   -5.146    -1.344    4.963     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9470    .   1   1   3    GLN   CG     C   -4.744    -1.637    3.537     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9471    .   1   1   3    GLN   H      H   -6.035    0.138     1.137     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9472    .   1   1   3    GLN   HA     H   -5.324    0.975     3.809     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9473    .   1   1   3    GLN   HB2    H   -3.806    -0.765    1.882     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9474    .   1   1   3    GLN   HB3    H   -3.169    -0.241    3.436     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9475    .   1   1   3    GLN   HE21   H   -3.410    -2.008    5.597     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HE21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9476    .   1   1   3    GLN   HE22   H   -4.520    -1.450    6.815     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HE22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9477    .   1   1   3    GLN   HG2    H   -5.629    -1.891    2.972     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9478    .   1   1   3    GLN   HG3    H   -4.056    -2.471    3.535     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9479    .   1   1   3    GLN   N      N   -6.111    0.587     2.007     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9480    .   1   1   3    GLN   NE2    N   -4.273    -1.625    5.882     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   NE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9481    .   1   1   3    GLN   O      O   -3.806    2.148     1.217     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9482    .   1   1   3    GLN   OE1    O   -6.241    -0.868    5.228     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   OE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9483    .   1   1   4    LYS   C      C   -1.599    3.789     3.172     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9484    .   1   1   4    LYS   CA     C   -3.096    4.053     3.100     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9485    .   1   1   4    LYS   CB     C   -3.462    5.111     4.140     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9486    .   1   1   4    LYS   CD     C   -5.202    6.486     5.281     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9487    .   1   1   4    LYS   CE     C   -6.690    6.719     5.508     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9488    .   1   1   4    LYS   CG     C   -4.940    5.422     4.234     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9489    .   1   1   4    LYS   H      H   -4.103    2.623     4.263     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9490    .   1   1   4    LYS   HA     H   -3.355    4.426     2.120     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9491    .   1   1   4    LYS   HB2    H   -3.133    4.765     5.109     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9492    .   1   1   4    LYS   HB3    H   -2.935    6.024     3.905     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9493    .   1   1   4    LYS   HD2    H   -4.754    6.172     6.213     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9494    .   1   1   4    LYS   HD3    H   -4.745    7.410     4.957     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9495    .   1   1   4    LYS   HE2    H   -7.132    5.792     5.842     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9496    .   1   1   4    LYS   HE3    H   -6.807    7.465     6.280     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9497    .   1   1   4    LYS   HG2    H   -5.286    5.778     3.274     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9498    .   1   1   4    LYS   HG3    H   -5.472    4.521     4.503     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9499    .   1   1   4    LYS   HZ1    H   -8.396    7.342     4.519     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9500    .   1   1   4    LYS   HZ2    H   -7.353    6.440     3.546     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9501    .   1   1   4    LYS   HZ3    H   -6.982    8.040     3.909     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9502    .   1   1   4    LYS   N      N   -3.833    2.835     3.346     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9503    .   1   1   4    LYS   NZ     N   -7.396    7.166     4.289     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9504    .   1   1   4    LYS   O      O   -1.173    2.740     3.637     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9505    .   1   1   5    TRP   C      C   1.228     4.443     4.149     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9506    .   1   1   5    TRP   CA     C   0.653     4.762     2.760     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9507    .   1   1   5    TRP   CB     C   1.180     6.152     2.302     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9508    .   1   1   5    TRP   CD1    C   1.706     7.723     4.273     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9509    .   1   1   5    TRP   CD2    C   -0.350    8.003     3.435     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9510    .   1   1   5    TRP   CE2    C   -0.180    8.879     4.522     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9511    .   1   1   5    TRP   CE3    C   -1.569    8.012     2.753     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9512    .   1   1   5    TRP   CG     C   0.876     7.259     3.295     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9513    .   1   1   5    TRP   CH2    C   -2.356    9.731     4.260     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9514    .   1   1   5    TRP   CZ2    C   -1.179    9.746     4.944     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9515    .   1   1   5    TRP   CZ3    C   -2.556    8.875     3.173     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9516    .   1   1   5    TRP   H      H   -1.262    5.624     2.513     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9517    .   1   1   5    TRP   HA     H   0.974     4.018     2.045     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9518    .   1   1   5    TRP   HB2    H   2.252     6.102     2.177     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9519    .   1   1   5    TRP   HB3    H   0.724     6.413     1.358     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9520    .   1   1   5    TRP   HD1    H   2.708     7.357     4.438     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9521    .   1   1   5    TRP   HE1    H   1.462     9.153     5.788     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9522    .   1   1   5    TRP   HE3    H   -1.751    7.368     1.906     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9523    .   1   1   5    TRP   HH2    H   -3.157    10.392    4.557     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9524    .   1   1   5    TRP   HZ2    H   -1.043    10.414    5.783     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9525    .   1   1   5    TRP   HZ3    H   -3.505    8.891     2.657     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9526    .   1   1   5    TRP   N      N   -0.823    4.797     2.793     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9527    .   1   1   5    TRP   NE1    N   1.072     8.680     5.017     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   NE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9528    .   1   1   5    TRP   O      O   2.292     3.867     4.281     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9529    .   1   1   6    MET   C      C   0.530     3.313     7.085     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9530    .   1   1   6    MET   CA     C   0.890     4.687     6.544     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9531    .   1   1   6    MET   CB     C   0.229     5.778     7.394     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9532    .   1   1   6    MET   CE     C   -1.573    6.558     9.934     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9533    .   1   1   6    MET   CG     C   -1.292    5.786     7.297     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9534    .   1   1   6    MET   H      H   -0.345    5.292     4.942     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9535    .   1   1   6    MET   HA     H   1.959     4.821     6.596     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9536    .   1   1   6    MET   HB2    H   0.504     5.623     8.427     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9537    .   1   1   6    MET   HB3    H   0.596     6.742     7.073     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9538    .   1   1   6    MET   HE1    H   -0.497    6.599     10.020    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9539    .   1   1   6    MET   HE2    H   -1.907    5.546     10.111    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9540    .   1   1   6    MET   HE3    H   -2.020    7.218     10.664    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9541    .   1   1   6    MET   HG2    H   -1.569    5.951     6.266     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9542    .   1   1   6    MET   HG3    H   -1.663    4.823     7.614     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9543    .   1   1   6    MET   N      N   0.494     4.840     5.159     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9544    .   1   1   6    MET   O      O   0.916     2.952     8.189     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9545    .   1   1   6    MET   SD     S   -2.074    7.062     8.291     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   SD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9546    .   1   1   7    TRP   C      C   0.101     0.174     5.955     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9547    .   1   1   7    TRP   CA     C   -0.627    1.240     6.756     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9548    .   1   1   7    TRP   CB     C   -2.155    1.077     6.645     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9549    .   1   1   7    TRP   CD1    C   -2.546    2.703     8.624     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9550    .   1   1   7    TRP   CD2    C   -4.313    2.428     7.287     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9551    .   1   1   7    TRP   CE2    C   -4.658    3.340     8.298     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9552    .   1   1   7    TRP   CE3    C   -5.261    2.094     6.340     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9553    .   1   1   7    TRP   CG     C   -2.954    2.044     7.493     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9554    .   1   1   7    TRP   CH2    C   -6.828    3.565     7.421     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9555    .   1   1   7    TRP   CZ2    C   -5.917    3.919     8.372     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9556    .   1   1   7    TRP   CZ3    C   -6.512    2.660     6.413     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9557    .   1   1   7    TRP   H      H   -0.443    2.834     5.409     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9558    .   1   1   7    TRP   HA     H   -0.335    1.139     7.790     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9559    .   1   1   7    TRP   HB2    H   -2.446    1.236     5.617     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9560    .   1   1   7    TRP   HB3    H   -2.433    0.073     6.929     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9561    .   1   1   7    TRP   HD1    H   -1.559    2.618     9.054     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9562    .   1   1   7    TRP   HE1    H   -3.525    4.079     9.892     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9563    .   1   1   7    TRP   HE3    H   -5.023    1.384     5.567     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9564    .   1   1   7    TRP   HH2    H   -7.823    3.986     7.443     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9565    .   1   1   7    TRP   HZ2    H   -6.185    4.626     9.142     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9566    .   1   1   7    TRP   HZ3    H   -7.259    2.402     5.676     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9567    .   1   1   7    TRP   N      N   -0.205    2.548     6.317     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9568    .   1   1   7    TRP   NE1    N   -3.565    3.498     9.098     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   NE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9569    .   1   1   7    TRP   O      O   1.012     0.485     5.179     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9570    .   1   1   8    THR   C      C   -0.683    -2.916    4.696     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9571    .   1   1   8    THR   CA     C   0.390     -2.148    5.480     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9572    .   1   1   8    THR   CB     C   1.060     -3.079    6.517     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9573    .   1   1   8    THR   CG2    C   2.097     -2.320    7.348     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   CG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9574    .   1   1   8    THR   H      H   -0.957    -1.277    6.800     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9575    .   1   1   8    THR   HA     H   1.140     -1.726    4.825     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9576    .   1   1   8    THR   HB     H   1.548     -3.893    6.002     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9577    .   1   1   8    THR   HG1    H   0.240     -3.270    8.298     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HG1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9578    .   1   1   8    THR   HG21   H   2.871     -1.925    6.707     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HG21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9579    .   1   1   8    THR   HG22   H   2.538     -2.983    8.077     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HG22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9580    .   1   1   8    THR   HG23   H   1.609     -1.501    7.857     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HG23   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9581    .   1   1   8    THR   N      N   -0.245    -1.056    6.163     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9582    .   1   1   8    THR   O      O   -1.882    -2.652    4.897     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9583    .   1   1   8    THR   OG1    O   0.064     -3.603    7.409     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   OG1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9584    .   1   1   9    CYS   C      C   -1.050    -6.063    3.101     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9585    .   1   1   9    CYS   CA     C   -1.348    -4.572    3.130     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9586    .   1   1   9    CYS   CB     C   -1.565    -4.037    1.717     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9587    .   1   1   9    CYS   H      H   0.616     -4.064    3.579     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9588    .   1   1   9    CYS   HA     H   -2.259    -4.426    3.692     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9589    .   1   1   9    CYS   HB2    H   -2.489    -4.440    1.329     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9590    .   1   1   9    CYS   HB3    H   -1.646    -2.959    1.762     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9591    .   1   1   9    CYS   N      N   -0.315    -3.841    3.815     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9592    .   1   1   9    CYS   O      O   0.051     -6.501    3.464     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9593    .   1   1   9    CYS   SG     S   -0.267    -4.446    0.532     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9594    .   1   1   10   ASP   C      C   -2.716    -8.641    1.321     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9595    .   1   1   10   ASP   CA     C   -1.959    -8.278    2.579     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9596    .   1   1   10   ASP   CB     C   -2.669    -8.981    3.772     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9597    .   1   1   10   ASP   CG     C   -2.132    -8.651    5.150     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9598    .   1   1   10   ASP   H      H   -2.855    -6.398    2.355     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9599    .   1   1   10   ASP   HA     H   -0.928    -8.590    2.512     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9600    .   1   1   10   ASP   HB2    H   -3.715    -8.713    3.761     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9601    .   1   1   10   ASP   HB3    H   -2.592    -10.047   3.622     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9602    .   1   1   10   ASP   N      N   -2.032    -6.828    2.682     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9603    .   1   1   10   ASP   O      O   -3.034    -7.759    0.522     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9604    .   1   1   10   ASP   OD1    O   -2.859    -8.016    5.940     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   OD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9605    .   1   1   10   ASP   OD2    O   -1.006    -9.036    5.488     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   OD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9606    .   1   1   11   SER   C      C   -5.312    -9.807    0.230     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9607    .   1   1   11   SER   CA     C   -3.866    -10.301   0.009     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9608    .   1   1   11   SER   CB     C   -3.830    -11.818   -0.153    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9609    .   1   1   11   SER   H      H   -2.683    -10.588   1.743     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9610    .   1   1   11   SER   HA     H   -3.467    -9.832    -0.879    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9611    .   1   1   11   SER   HB2    H   -4.243    -12.274   0.734     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9612    .   1   1   11   SER   HB3    H   -4.413    -12.106   -1.015    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9613    .   1   1   11   SER   HG     H   -2.138    -12.486   0.544     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   HG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9614    .   1   1   11   SER   N      N   -3.036    -9.900    1.137     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9615    .   1   1   11   SER   O      O   -6.072    -9.608    -0.709    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9616    .   1   1   11   SER   OG     O   -2.491    -12.272   -0.326    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   OG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9617    .   1   1   12   GLU   C      C   -6.996    -7.576    1.797     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9618    .   1   1   12   GLU   CA     C   -6.949    -9.103    1.896     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9619    .   1   1   12   GLU   CB     C   -7.176    -9.503    3.330     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9620    .   1   1   12   GLU   CD     C   -6.929    -11.238   5.065     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9621    .   1   1   12   GLU   CG     C   -6.999    -10.970   3.601     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9622    .   1   1   12   GLU   H      H   -4.961    -9.756    2.167     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9623    .   1   1   12   GLU   HA     H   -7.710    -9.549    1.276     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9624    .   1   1   12   GLU   HB2    H   -6.473    -8.964    3.947     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9625    .   1   1   12   GLU   HB3    H   -8.178    -9.221    3.616     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9626    .   1   1   12   GLU   HG2    H   -7.841    -11.505   3.185     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9627    .   1   1   12   GLU   HG3    H   -6.087    -11.308   3.131     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9628    .   1   1   12   GLU   N      N   -5.642    -9.581    1.487     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9629    .   1   1   12   GLU   O      O   -7.654    -7.015    0.927     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9630    .   1   1   12   GLU   OE1    O   -5.821    -11.149   5.647     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   OE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9631    .   1   1   12   GLU   OE2    O   -7.980    -11.490   5.678     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   OE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9632    .   1   1   13   ARG   C      C   -5.274    -5.030    1.590     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9633    .   1   1   13   ARG   CA     C   -6.183    -5.465    2.714     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9634    .   1   1   13   ARG   CB     C   -5.534    -5.002    4.026     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9635    .   1   1   13   ARG   CD     C   -5.434    -4.927    6.526     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9636    .   1   1   13   ARG   CG     C   -6.250    -5.376    5.307     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9637    .   1   1   13   ARG   CZ     C   -2.977    -5.025    7.080     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   CZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9638    .   1   1   13   ARG   H      H   -5.769    -7.429    3.355     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9639    .   1   1   13   ARG   HA     H   -7.164    -5.028    2.622     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9640    .   1   1   13   ARG   HB2    H   -4.537    -5.414    4.082     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9641    .   1   1   13   ARG   HB3    H   -5.451    -3.925    3.994     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9642    .   1   1   13   ARG   HD2    H   -5.296    -3.857    6.465     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9643    .   1   1   13   ARG   HD3    H   -5.978    -5.166    7.427     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9644    .   1   1   13   ARG   HE     H   -4.042    -6.485    6.207     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9645    .   1   1   13   ARG   HG2    H   -7.211    -4.886    5.322     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9646    .   1   1   13   ARG   HG3    H   -6.387    -6.446    5.341     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9647    .   1   1   13   ARG   HH11   H   -3.850    -3.313    7.762     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HH11   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9648    .   1   1   13   ARG   HH12   H   -2.173    -3.403    8.037     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HH12   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9649    .   1   1   13   ARG   HH21   H   -1.833    -6.623    6.614     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HH21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9650    .   1   1   13   ARG   HH22   H   -0.982    -5.309    7.357     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HH22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9651    .   1   1   13   ARG   N      N   -6.271    -6.917    2.689     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9652    .   1   1   13   ARG   NE     N   -4.099    -5.572    6.580     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   NE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9653    .   1   1   13   ARG   NH1    N   -3.000    -3.838    7.665     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   NH1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9654    .   1   1   13   ARG   NH2    N   -1.846    -5.700    7.023     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   NH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9655    .   1   1   13   ARG   O      O   -4.124    -5.378    1.608     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9656    .   1   1   14   LYS   C      C   -4.681    -2.351    -0.402    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9657    .   1   1   14   LYS   CA     C   -4.926    -3.864    -0.479    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9658    .   1   1   14   LYS   CB     C   -5.433    -4.316    -1.864    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9659    .   1   1   14   LYS   CD     C   -7.302    -4.454    -3.560    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9660    .   1   1   14   LYS   CE     C   -6.533    -3.757    -4.679    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9661    .   1   1   14   LYS   CG     C   -6.874    -3.959    -2.176    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9662    .   1   1   14   LYS   H      H   -6.729    -4.106    0.603     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9663    .   1   1   14   LYS   HA     H   -3.966    -4.328    -0.301    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9664    .   1   1   14   LYS   HB2    H   -4.806    -3.863    -2.616    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9665    .   1   1   14   LYS   HB3    H   -5.329    -5.388    -1.931    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9666    .   1   1   14   LYS   HD2    H   -7.116    -5.516    -3.624    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9667    .   1   1   14   LYS   HD3    H   -8.359    -4.267    -3.690    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9668    .   1   1   14   LYS   HE2    H   -6.694    -2.694    -4.608    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9669    .   1   1   14   LYS   HE3    H   -5.480    -3.967    -4.562    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9670    .   1   1   14   LYS   HG2    H   -7.521    -4.394    -1.428    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9671    .   1   1   14   LYS   HG3    H   -6.960    -2.883    -2.150    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9672    .   1   1   14   LYS   HZ1    H   -6.798    -5.219    -6.159    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9673    .   1   1   14   LYS   HZ2    H   -6.462    -3.688    -6.765    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9674    .   1   1   14   LYS   HZ3    H   -7.980    -4.025    -6.153    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9675    .   1   1   14   LYS   N      N   -5.777    -4.340    0.603     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9676    .   1   1   14   LYS   NZ     N   -6.963    -4.204    -6.015    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9677    .   1   1   14   LYS   O      O   -5.585    -1.586    -0.021    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9678    .   1   1   15   CYS   C      C   -3.824    0.250     -1.787    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9679    .   1   1   15   CYS   CA     C   -3.069    -0.513    -0.722    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9680    .   1   1   15   CYS   CB     C   -1.566    -0.346    -0.963    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9681    .   1   1   15   CYS   H      H   -2.779    -2.599    -0.974    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9682    .   1   1   15   CYS   HA     H   -3.319    -0.072    0.230     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9683    .   1   1   15   CYS   HB2    H   -1.332    -0.685    -1.961    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9684    .   1   1   15   CYS   HB3    H   -1.316    0.701     -0.884    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9685    .   1   1   15   CYS   N      N   -3.457    -1.935    -0.727    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9686    .   1   1   15   CYS   O      O   -4.212    -0.321    -2.821    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9687    .   1   1   15   CYS   SG     S   -0.494    -1.262    0.187     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9688    .   1   1   16   CYS   C      C   -4.025    2.591     -3.767    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9689    .   1   1   16   CYS   CA     C   -4.762    2.389     -2.449    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9690    .   1   1   16   CYS   CB     C   -5.083    3.719     -1.772    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9691    .   1   1   16   CYS   H      H   -3.745    1.888     -0.674    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9692    .   1   1   16   CYS   HA     H   -5.697    1.898     -2.674    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9693    .   1   1   16   CYS   HB2    H   -4.170    4.153     -1.389    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9694    .   1   1   16   CYS   HB3    H   -5.528    4.393     -2.487    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9695    .   1   1   16   CYS   N      N   -4.048    1.515     -1.535    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9696    .   1   1   16   CYS   O      O   -2.846    2.219     -3.912    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9697    .   1   1   16   CYS   SG     S   -6.238    3.536     -0.380    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9698    .   1   1   17   LYS   C      C   -3.084    4.408     -6.004    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9699    .   1   1   17   LYS   CA     C   -4.148    3.342     -6.035    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9700    .   1   1   17   LYS   CB     C   -5.211    3.609     -7.113    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9701    .   1   1   17   LYS   CD     C   -6.959    1.903     -6.376    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9702    .   1   1   17   LYS   CE     C   -7.738    0.665     -6.768    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9703    .   1   1   17   LYS   CG     C   -6.061    2.385     -7.502    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9704    .   1   1   17   LYS   H      H   -5.634    3.459     -4.568    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9705    .   1   1   17   LYS   HA     H   -3.650    2.413     -6.269    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9706    .   1   1   17   LYS   HB2    H   -5.876    4.378     -6.751    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9707    .   1   1   17   LYS   HB3    H   -4.715    3.969     -8.002    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9708    .   1   1   17   LYS   HD2    H   -6.349    1.672     -5.515    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9709    .   1   1   17   LYS   HD3    H   -7.654    2.689     -6.121    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9710    .   1   1   17   LYS   HE2    H   -8.347    0.893     -7.630    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9711    .   1   1   17   LYS   HE3    H   -7.043    -0.122    -7.019    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9712    .   1   1   17   LYS   HG2    H   -6.683    2.638     -8.344    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9713    .   1   1   17   LYS   HG3    H   -5.395    1.582     -7.783    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9714    .   1   1   17   LYS   HZ1    H   -9.347    0.902     -5.441    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9715    .   1   1   17   LYS   HZ2    H   -8.059    0.090     -4.800    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9716    .   1   1   17   LYS   HZ3    H   -9.066    -0.709    -5.865    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9717    .   1   1   17   LYS   N      N   -4.716    3.149     -4.731    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9718    .   1   1   17   LYS   NZ     N   -8.611    0.205     -5.673    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9719    .   1   1   17   LYS   O      O   -3.269    5.492     -5.418    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9720    .   1   1   18   GLY   C      C   0.143     4.487     -5.508    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9721    .   1   1   18   GLY   CA     C   -0.823    4.943     -6.565    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9722    .   1   1   18   GLY   H      H   -1.905    3.205     -7.030    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9723    .   1   1   18   GLY   HA2    H   -0.343    4.912     -7.531    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   HA2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9724    .   1   1   18   GLY   HA3    H   -1.135    5.952     -6.345    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   HA3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9725    .   1   1   18   GLY   N      N   -1.963    4.078     -6.581    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9726    .   1   1   18   GLY   O      O   1.131     5.154     -5.204    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9727    .   1   1   19   MET   C      C   1.043     1.368     -4.314    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9728    .   1   1   19   MET   CA     C   0.658     2.773     -3.907    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9729    .   1   1   19   MET   CB     C   -0.077    2.758     -2.556    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9730    .   1   1   19   MET   CE     C   -1.891    5.853     -0.450    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9731    .   1   1   19   MET   CG     C   -0.468    4.138     -2.067    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9732    .   1   1   19   MET   H      H   -0.994    2.884     -5.162    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9733    .   1   1   19   MET   HA     H   1.552     3.370     -3.811    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9734    .   1   1   19   MET   HB2    H   -0.977    2.168     -2.658    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9735    .   1   1   19   MET   HB3    H   0.562     2.301     -1.814    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9736    .   1   1   19   MET   HE1    H   -2.524    6.008     0.412     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9737    .   1   1   19   MET   HE2    H   -2.419    6.158     -1.342    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9738    .   1   1   19   MET   HE3    H   -0.989    6.438     -0.345    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9739    .   1   1   19   MET   HG2    H   0.448     4.669     -1.846    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9740    .   1   1   19   MET   HG3    H   -1.009    4.651     -2.849    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9741    .   1   1   19   MET   N      N   -0.165    3.356     -4.919    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9742    .   1   1   19   MET   O      O   0.380     0.748     -5.147    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9743    .   1   1   19   MET   SD     S   -1.468    4.116     -0.570    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   SD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9744    .   1   1   20   VAL   C      C   2.226     -1.293    -2.802    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9745    .   1   1   20   VAL   CA     C   2.587     -0.434    -3.993    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9746    .   1   1   20   VAL   CB     C   4.134     -0.418    -4.171    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9747    .   1   1   20   VAL   CG1    C   4.665     -1.808    -4.491    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   CG1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9748    .   1   1   20   VAL   CG2    C   4.551     0.577     -5.250    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   CG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9749    .   1   1   20   VAL   H      H   2.554     1.436     -3.066    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9750    .   1   1   20   VAL   HA     H   2.121     -0.821    -4.887    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9751    .   1   1   20   VAL   HB     H   4.571     -0.104    -3.233    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9752    .   1   1   20   VAL   HG11   H   4.232     -2.154    -5.417    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG11   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9753    .   1   1   20   VAL   HG12   H   4.399     -2.485    -3.693    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG12   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9754    .   1   1   20   VAL   HG13   H   5.739     -1.768    -4.586    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG13   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9755    .   1   1   20   VAL   HG21   H   4.099     0.298     -6.190    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9756    .   1   1   20   VAL   HG22   H   5.627     0.569     -5.353    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9757    .   1   1   20   VAL   HG23   H   4.224     1.568     -4.973    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG23   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9758    .   1   1   20   VAL   N      N   2.084     0.879     -3.731    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9759    .   1   1   20   VAL   O      O   2.499     -0.918    -1.652    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9760    .   1   1   21   CYS   C      C   2.181     -4.317    -1.709    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9761    .   1   1   21   CYS   CA     C   1.105     -3.275    -2.030    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9762    .   1   1   21   CYS   CB     C   -0.202    -3.939    -2.504    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9763    .   1   1   21   CYS   H      H   1.445     -2.666    -4.002    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9764    .   1   1   21   CYS   HA     H   0.904     -2.682    -1.150    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9765    .   1   1   21   CYS   HB2    H   -0.822    -3.193    -2.979    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9766    .   1   1   21   CYS   HB3    H   0.062     -4.687    -3.238    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9767    .   1   1   21   CYS   N      N   1.586     -2.399    -3.069    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9768    .   1   1   21   CYS   O      O   2.689     -5.002    -2.607    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9769    .   1   1   21   CYS   SG     S   -1.239    -4.757    -1.219    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9770    .   1   1   22   ARG   C      C   3.296     -5.403    1.566     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9771    .   1   1   22   ARG   CA     C   3.512     -5.316    0.037     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9772    .   1   1   22   ARG   CB     C   4.919     -4.799    -0.314    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9773    .   1   1   22   ARG   CD     C   7.306     -5.348    -0.694    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9774    .   1   1   22   ARG   CG     C   5.991     -5.870    -0.267    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9775    .   1   1   22   ARG   CZ     C   9.626     -6.120    -0.266    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   CZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9776    .   1   1   22   ARG   H      H   2.105     -3.822    0.218     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9777    .   1   1   22   ARG   HA     H   3.349     -6.277    -0.428    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9778    .   1   1   22   ARG   HB2    H   4.898     -4.382    -1.311    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9779    .   1   1   22   ARG   HB3    H   5.186     -4.020    0.386     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9780    .   1   1   22   ARG   HD2    H   7.199     -5.072    -1.732    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9781    .   1   1   22   ARG   HD3    H   7.537     -4.482    -0.091    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9782    .   1   1   22   ARG   HE     H   8.030     -7.292    -0.620    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9783    .   1   1   22   ARG   HG2    H   6.124     -6.241    0.735     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9784    .   1   1   22   ARG   HG3    H   5.713     -6.681    -0.923    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9785    .   1   1   22   ARG   HH11   H   9.512     -4.075    -0.451    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HH11   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9786    .   1   1   22   ARG   HH12   H   11.047    -4.662    -0.027    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HH12   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9787    .   1   1   22   ARG   HH21   H   10.108    -8.089    -0.081    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HH21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9788    .   1   1   22   ARG   HH22   H   11.418    -7.035    0.181     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HH22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9789    .   1   1   22   ARG   N      N   2.540     -4.395    -0.451    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9790    .   1   1   22   ARG   NE     N   8.344     -6.362    -0.540    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   NE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9791    .   1   1   22   ARG   NH1    N   10.091    -4.869    -0.252    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   NH1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9792    .   1   1   22   ARG   NH2    N   10.446    -7.141    -0.043    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   NH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9793    .   1   1   22   ARG   O      O   2.233     -4.968    2.063     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9794    .   1   1   23   LEU   C      C   3.872     -4.690    4.432     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9795    .   1   1   23   LEU   CA     C   4.231     -6.029    3.787     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9796    .   1   1   23   LEU   CB     C   5.563     -6.543    4.393     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9797    .   1   1   23   LEU   CD1    C   4.920     -9.005    4.366     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9798    .   1   1   23   LEU   CD2    C   6.544     -8.125    2.657     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9799    .   1   1   23   LEU   CG     C   6.016     -7.988    4.075     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9800    .   1   1   23   LEU   H      H   5.052     -6.317    1.864     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9801    .   1   1   23   LEU   HA     H   3.449     -6.732    4.031     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9802    .   1   1   23   LEU   HB2    H   6.347     -5.883    4.054     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9803    .   1   1   23   LEU   HB3    H   5.489     -6.445    5.466     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9804    .   1   1   23   LEU   HD11   H   4.637     -8.943    5.407     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD11   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9805    .   1   1   23   LEU   HD12   H   5.288     -9.998    4.152     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD12   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9806    .   1   1   23   LEU   HD13   H   4.061     -8.800    3.744     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD13   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9807    .   1   1   23   LEU   HD21   H   7.360     -7.434    2.504     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9808    .   1   1   23   LEU   HD22   H   5.752     -7.923    1.954     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9809    .   1   1   23   LEU   HD23   H   6.899     -9.133    2.506     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD23   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9810    .   1   1   23   LEU   HG     H   6.819     -8.224    4.757     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9811    .   1   1   23   LEU   N      N   4.280     -5.932    2.316     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9812    .   1   1   23   LEU   O      O   3.425     -4.650    5.567     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9813    .   1   1   24   TRP   C      C   3.272     -1.557    2.840     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9814    .   1   1   24   TRP   CA     C   3.673     -2.313    4.110     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9815    .   1   1   24   TRP   CB     C   4.772     -1.564    4.892     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9816    .   1   1   24   TRP   CD1    C   6.069     0.172     3.588     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9817    .   1   1   24   TRP   CD2    C   7.062     -1.823    3.629     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9818    .   1   1   24   TRP   CE2    C   7.870     -0.940    2.888     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9819    .   1   1   24   TRP   CE3    C   7.481     -3.142    3.793     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9820    .   1   1   24   TRP   CG     C   5.919     -1.079    4.069     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9821    .   1   1   24   TRP   CH2    C   9.452     -2.639    2.491     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9822    .   1   1   24   TRP   CZ2    C   9.069     -1.340    2.314     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9823    .   1   1   24   TRP   CZ3    C   8.671     -3.536    3.219     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9824    .   1   1   24   TRP   H      H   4.531     -3.685    2.834     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9825    .   1   1   24   TRP   HA     H   2.812     -2.470    4.737     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9826    .   1   1   24   TRP   HB2    H   4.335     -0.700    5.372     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9827    .   1   1   24   TRP   HB3    H   5.163     -2.221    5.655     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9828    .   1   1   24   TRP   HD1    H   5.326     0.937     3.773     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9829    .   1   1   24   TRP   HE1    H   7.560     1.094     2.441     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9830    .   1   1   24   TRP   HE3    H   6.885     -3.846    4.356     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9831    .   1   1   24   TRP   HH2    H   10.379    -2.993    2.061     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9832    .   1   1   24   TRP   HZ2    H   9.693     -0.664    1.749     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9833    .   1   1   24   TRP   HZ3    H   9.012     -4.553    3.333     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9834    .   1   1   24   TRP   N      N   4.097     -3.614    3.711     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9835    .   1   1   24   TRP   NE1    N   7.240     0.275     2.878     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   NE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9836    .   1   1   24   TRP   O      O   3.686     -1.961    1.742     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9837    .   1   1   25   CYS   C      C   3.092     1.336     1.521     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9838    .   1   1   25   CYS   CA     C   2.076     0.256     1.798     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9839    .   1   1   25   CYS   CB     C   0.684     0.871     1.958     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9840    .   1   1   25   CYS   H      H   2.122     -0.243    3.833     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9841    .   1   1   25   CYS   HA     H   2.063     -0.417    0.953     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9842    .   1   1   25   CYS   HB2    H   0.646     1.416     2.891     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9843    .   1   1   25   CYS   HB3    H   0.508     1.557     1.143     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9844    .   1   1   25   CYS   N      N   2.467     -0.524    2.959     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9845    .   1   1   25   CYS   O      O   3.593     1.994     2.438     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9846    .   1   1   25   CYS   SG     S   -0.681    -0.332    1.979     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9847    .   1   1   26   LYS   C      C   3.783     3.255     -1.302    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9848    .   1   1   26   LYS   CA     C   4.371     2.473     -0.157    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9849    .   1   1   26   LYS   CB     C   5.609     1.707     -0.630    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9850    .   1   1   26   LYS   CD     C   7.885     1.724     -1.697    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9851    .   1   1   26   LYS   CE     C   8.522     0.913     -0.580    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9852    .   1   1   26   LYS   CG     C   6.721     2.567     -1.198    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9853    .   1   1   26   LYS   H      H   2.938     0.978     -0.409    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9854    .   1   1   26   LYS   HA     H   4.643     3.124     0.659     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9855    .   1   1   26   LYS   HB2    H   6.002     1.167     0.218     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9856    .   1   1   26   LYS   HB3    H   5.305     0.995     -1.384    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9857    .   1   1   26   LYS   HD2    H   7.525     1.046     -2.457    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9858    .   1   1   26   LYS   HD3    H   8.631     2.378     -2.124    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9859    .   1   1   26   LYS   HE2    H   8.916     1.586     0.165     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9860    .   1   1   26   LYS   HE3    H   7.773     0.278     -0.130    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9861    .   1   1   26   LYS   HG2    H   6.327     3.149     -2.018    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9862    .   1   1   26   LYS   HG3    H   7.065     3.230     -0.420    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9863    .   1   1   26   LYS   HZ1    H   10.349    0.653     -1.522    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9864    .   1   1   26   LYS   HZ2    H   9.271     -0.607    -1.788    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9865    .   1   1   26   LYS   HZ3    H   10.066    -0.471    -0.313    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9866    .   1   1   26   LYS   N      N   3.395     1.514     0.276     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9867    .   1   1   26   LYS   NZ     N   9.614     0.070     -1.077    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9868    .   1   1   26   LYS   O      O   3.084     2.688     -2.095    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9869    .   1   1   27   LYS   C      C   4.496     5.143     -3.659    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9870    .   1   1   27   LYS   CA     C   3.543     5.317     -2.506    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9871    .   1   1   27   LYS   CB     C   3.496     6.807     -2.198    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9872    .   1   1   27   LYS   CD     C   2.663     8.752     -0.968    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9873    .   1   1   27   LYS   CE     C   1.812     9.301     0.151     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9874    .   1   1   27   LYS   CG     C   2.589     7.245     -1.078    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9875    .   1   1   27   LYS   H      H   4.564     4.974     -0.677    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9876    .   1   1   27   LYS   HA     H   2.557     4.974     -2.781    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9877    .   1   1   27   LYS   HB2    H   4.495     7.126     -1.950    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9878    .   1   1   27   LYS   HB3    H   3.195     7.322     -3.098    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9879    .   1   1   27   LYS   HD2    H   3.688     9.041     -0.799    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9880    .   1   1   27   LYS   HD3    H   2.329     9.175     -1.903    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9881    .   1   1   27   LYS   HE2    H   0.783     9.029     -0.030    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9882    .   1   1   27   LYS   HE3    H   2.139     8.869     1.085     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9883    .   1   1   27   LYS   HG2    H   1.577     6.940     -1.295    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9884    .   1   1   27   LYS   HG3    H   2.924     6.805     -0.150    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9885    .   1   1   27   LYS   HZ1    H   1.293     11.148    0.962     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9886    .   1   1   27   LYS   HZ2    H   1.668     11.204    -0.680    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9887    .   1   1   27   LYS   HZ3    H   2.901     11.055    0.455     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9888    .   1   1   27   LYS   N      N   4.027     4.539     -1.373    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9889    .   1   1   27   LYS   NZ     N   1.925     10.770    0.228     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9890    .   1   1   27   LYS   O      O   5.687     4.874     -3.447    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9891    .   1   1   28   LYS   C      C   5.564     6.626     -6.093    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9892    .   1   1   28   LYS   CA     C   4.869     5.273     -5.995    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9893    .   1   1   28   LYS   CB     C   4.103     4.953     -7.277    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9894    .   1   1   28   LYS   CD     C   2.387     5.586     -8.936    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9895    .   1   1   28   LYS   CE     C   1.338     6.590     -9.302    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9896    .   1   1   28   LYS   CG     C   3.041     5.950     -7.639    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9897    .   1   1   28   LYS   H      H   3.038     5.426     -4.975    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9898    .   1   1   28   LYS   HA     H   5.610     4.511     -5.823    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9899    .   1   1   28   LYS   HB2    H   4.803     4.903     -8.097    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9900    .   1   1   28   LYS   HB3    H   3.634     3.986     -7.163    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9901    .   1   1   28   LYS   HD2    H   3.133     5.560     -9.715    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9902    .   1   1   28   LYS   HD3    H   1.929     4.614     -8.838    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9903    .   1   1   28   LYS   HE2    H   0.857     6.282     -10.215   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9904    .   1   1   28   LYS   HE3    H   0.634     6.579     -8.484    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9905    .   1   1   28   LYS   HG2    H   2.293     5.966     -6.860    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9906    .   1   1   28   LYS   HG3    H   3.491     6.927     -7.732    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9907    .   1   1   28   LYS   HZ1    H   2.088     8.387     -8.515    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9908    .   1   1   28   LYS   HZ2    H   1.246     8.585     -9.963    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9909    .   1   1   28   LYS   HZ3    H   2.800     7.939     -9.962    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9910    .   1   1   28   LYS   N      N   4.005     5.293     -4.856    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9911    .   1   1   28   LYS   NZ     N   1.893     7.958     -9.443    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9912    .   1   1   28   LYS   O      O   4.935     7.676     -5.863    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9913    .   1   1   29   LEU   C      C   7.157     8.651     -7.664    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9914    .   1   1   29   LEU   CA     C   7.613     7.831     -6.465    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9915    .   1   1   29   LEU   CB     C   9.135     7.503     -6.509    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9916    .   1   1   29   LEU   CD1    C   11.509    8.184     -6.073    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9917    .   1   1   29   LEU   CD2    C   10.286    9.321     -7.886    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9918    .   1   1   29   LEU   CG     C   10.148    8.683     -6.503    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9919    .   1   1   29   LEU   H      H   7.294     5.750     -6.524    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9920    .   1   1   29   LEU   HA     H   7.405     8.402     -5.573    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9921    .   1   1   29   LEU   HB2    H   9.359     6.882     -5.654    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9922    .   1   1   29   LEU   HB3    H   9.316     6.915     -7.397    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9923    .   1   1   29   LEU   HD11   H   11.445    7.762     -5.081    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD11   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9924    .   1   1   29   LEU   HD12   H   12.210    9.006     -6.070    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD12   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9925    .   1   1   29   LEU   HD13   H   11.849    7.426     -6.764    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD13   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9926    .   1   1   29   LEU   HD21   H   10.987    10.141    -7.837    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9927    .   1   1   29   LEU   HD22   H   9.323     9.689     -8.209    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9928    .   1   1   29   LEU   HD23   H   10.640    8.584     -8.590    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD23   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9929    .   1   1   29   LEU   HG     H   9.826     9.438     -5.802    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9930    .   1   1   29   LEU   N      N   6.843     6.611     -6.376    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9931    .   1   1   29   LEU   O      O   7.001     9.880     -7.571    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9932    .   1   1   30   TRP   C      C   5.004     8.499     -10.117   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9933    .   1   1   30   TRP   CA     C   6.513     8.631     -9.960    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9934    .   1   1   30   TRP   CB     C   7.264     8.038     -11.157   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9935    .   1   1   30   TRP   CD1    C   6.174     8.493     -13.423   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9936    .   1   1   30   TRP   CD2    C   7.753     9.968     -12.856   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9937    .   1   1   30   TRP   CE2    C   7.235     10.328    -14.109   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9938    .   1   1   30   TRP   CE3    C   8.763     10.754    -12.294   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9939    .   1   1   30   TRP   CG     C   7.055     8.789     -12.433   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9940    .   1   1   30   TRP   CH2    C   8.679     12.187    -14.242   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9941    .   1   1   30   TRP   CZ2    C   7.692     11.436    -14.813   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9942    .   1   1   30   TRP   CZ3    C   9.215     11.855    -12.995   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9943    .   1   1   30   TRP   H      H   6.989     7.007     -8.736    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9944    .   1   1   30   TRP   HA     H   6.757     9.679     -9.870    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9945    .   1   1   30   TRP   HB2    H   8.322     8.041     -10.942   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9946    .   1   1   30   TRP   HB3    H   6.939     7.020     -11.309   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9947    .   1   1   30   TRP   HD1    H   5.499     7.651     -13.401   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9948    .   1   1   30   TRP   HE1    H   5.742     9.421     -15.256   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9949    .   1   1   30   TRP   HE3    H   9.188     10.509    -11.330   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9950    .   1   1   30   TRP   HH2    H   9.061     13.056    -14.757   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9951    .   1   1   30   TRP   HZ2    H   7.290     11.710    -15.779   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9952    .   1   1   30   TRP   HZ3    H   9.997     12.475    -12.579   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9953    .   1   1   30   TRP   N      N   6.917     7.984     -8.753    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9954    .   1   1   30   TRP   NE1    N   6.277     9.415     -14.430   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   NE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9955    .   1   1   30   TRP   O      O   4.515     7.429     -10.521   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   19   .   9956    .   1   1   30   TRP   OXT    O   4.286     9.456     -9.818    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   OXT    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   9957    .   1   1   1    TYR   C      C   -9.728    -0.707    2.839     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   9958    .   1   1   1    TYR   CA     C   -10.946   -0.665    3.750     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   9959    .   1   1   1    TYR   CB     C   -12.211   -0.281    2.955     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   9960    .   1   1   1    TYR   CD1    C   -13.503   -2.360    2.385     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   9961    .   1   1   1    TYR   CD2    C   -12.278   -1.308    0.642     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   9962    .   1   1   1    TYR   CE1    C   -13.926   -3.328    1.511     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   9963    .   1   1   1    TYR   CE2    C   -12.701   -2.274    -0.242    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   9964    .   1   1   1    TYR   CG     C   -12.672   -1.335    1.972     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   9965    .   1   1   1    TYR   CZ     C   -13.523   -3.283    0.199     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   CZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   9966    .   1   1   1    TYR   H1     H   -9.869    0.025     5.372     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   H1     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   9967    .   1   1   1    TYR   H2     H   -11.515   0.291     5.486     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   H2     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   9968    .   1   1   1    TYR   H3     H   -10.582   1.262     4.462     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   H3     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   9969    .   1   1   1    TYR   HA     H   -11.078   -1.642    4.191     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   9970    .   1   1   1    TYR   HB2    H   -13.023   -0.101    3.642     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   9971    .   1   1   1    TYR   HB3    H   -12.015   0.625     2.400     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   9972    .   1   1   1    TYR   HD1    H   -13.822   -2.395    3.417     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   9973    .   1   1   1    TYR   HD2    H   -11.632   -0.515    0.297     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   9974    .   1   1   1    TYR   HE1    H   -14.577   -4.116    1.864     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   9975    .   1   1   1    TYR   HE2    H   -12.382   -2.237    -1.273    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   9976    .   1   1   1    TYR   HH     H   -14.864   -4.460    -0.483    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   HH     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   9977    .   1   1   1    TYR   N      N   -10.713   0.299     4.828     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   9978    .   1   1   1    TYR   O      O   -9.081    -1.746    2.697     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   9979    .   1   1   1    TYR   OH     O   -13.939   -4.254    -0.675    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   1    TYR   OH     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   9980    .   1   1   2    CYS   C      C   -7.124    0.933     2.312     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   9981    .   1   1   2    CYS   CA     C   -8.248    0.523     1.399     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   9982    .   1   1   2    CYS   CB     C   -8.455    1.576     0.313     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   9983    .   1   1   2    CYS   H      H   -9.978    1.215     2.325     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   9984    .   1   1   2    CYS   HA     H   -8.030    -0.438    0.958     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   9985    .   1   1   2    CYS   HB2    H   -9.422    1.444     -0.145    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   9986    .   1   1   2    CYS   HB3    H   -8.408    2.539     0.796     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   9987    .   1   1   2    CYS   N      N   -9.421    0.414     2.224     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   9988    .   1   1   2    CYS   O      O   -7.365    1.617     3.319     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   9989    .   1   1   2    CYS   SG     S   -7.195    1.576     -1.016    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   2    CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   9990    .   1   1   3    GLN   C      C   -4.124    2.095     2.553     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   9991    .   1   1   3    GLN   CA     C   -4.834    0.806     2.891     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   9992    .   1   1   3    GLN   CB     C   -3.850    -0.362    2.947     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   9993    .   1   1   3    GLN   CD     C   -5.244    -1.676    4.591     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   9994    .   1   1   3    GLN   CG     C   -4.482    -1.700    3.287     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   9995    .   1   1   3    GLN   H      H   -5.809    0.103     1.134     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   9996    .   1   1   3    GLN   HA     H   -5.271    0.926     3.870     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   9997    .   1   1   3    GLN   HB2    H   -3.329    -0.450    2.007     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   9998    .   1   1   3    GLN   HB3    H   -3.121    -0.140    3.711     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   9999    .   1   1   3    GLN   HE21   H   -3.620    -2.182    5.574     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HE21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10000   .   1   1   3    GLN   HE22   H   -5.040    -1.942    6.531     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HE22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10001   .   1   1   3    GLN   HG2    H   -5.168    -1.972    2.497     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10002   .   1   1   3    GLN   HG3    H   -3.704    -2.444    3.356     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10003   .   1   1   3    GLN   N      N   -5.936    0.547     1.997     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10004   .   1   1   3    GLN   NE2    N   -4.576    -1.964    5.666     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   NE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10005   .   1   1   3    GLN   O      O   -3.946    2.438     1.375     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10006   .   1   1   3    GLN   OE1    O   -6.433    -1.404    4.618     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   3    GLN   OE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10007   .   1   1   4    LYS   C      C   -1.554    3.801     3.558     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10008   .   1   1   4    LYS   CA     C   -3.044    4.063     3.455     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10009   .   1   1   4    LYS   CB     C   -3.463    5.040     4.554     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10010   .   1   1   4    LYS   CD     C   -5.266    6.354     5.670     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10011   .   1   1   4    LYS   CE     C   -6.754    6.617     5.779     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10012   .   1   1   4    LYS   CG     C   -4.950    5.332     4.600     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10013   .   1   1   4    LYS   H      H   -3.952    2.479     4.486     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10014   .   1   1   4    LYS   HA     H   -3.272    4.491     2.491     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10015   .   1   1   4    LYS   HB2    H   -3.174    4.627     5.510     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10016   .   1   1   4    LYS   HB3    H   -2.937    5.972     4.406     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10017   .   1   1   4    LYS   HD2    H   -4.913    5.975     6.616     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10018   .   1   1   4    LYS   HD3    H   -4.758    7.276     5.433     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10019   .   1   1   4    LYS   HE2    H   -7.148    6.881     4.809     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10020   .   1   1   4    LYS   HE3    H   -7.232    5.711     6.120     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10021   .   1   1   4    LYS   HG2    H   -5.261    5.718     3.641     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10022   .   1   1   4    LYS   HG3    H   -5.483    4.417     4.815     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10023   .   1   1   4    LYS   HZ1    H   -8.064    7.910     6.773     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10024   .   1   1   4    LYS   HZ2    H   -6.537    8.572     6.500     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10025   .   1   1   4    LYS   HZ3    H   -6.753    7.432     7.703     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10026   .   1   1   4    LYS   N      N   -3.753    2.816     3.587     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10027   .   1   1   4    LYS   NZ     N   -7.047    7.699     6.743     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10028   .   1   1   4    LYS   O      O   -1.147    2.732     3.982     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   4    LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10029   .   1   1   5    TRP   C      C   1.321     4.359     4.568     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10030   .   1   1   5    TRP   CA     C   0.711     4.712     3.200     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10031   .   1   1   5    TRP   CB     C   1.305     6.041     2.687     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10032   .   1   1   5    TRP   CD1    C   1.826     7.703     4.575     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10033   .   1   1   5    TRP   CD2    C   -0.133    8.084     3.569     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10034   .   1   1   5    TRP   CE2    C   0.047     9.043     4.581     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10035   .   1   1   5    TRP   CE3    C   -1.302    8.131     2.806     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10036   .   1   1   5    TRP   CG     C   1.027     7.230     3.580     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10037   .   1   1   5    TRP   CH2    C   -2.023    10.046    4.084     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10038   .   1   1   5    TRP   CZ2    C   -0.893    10.029    4.846     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10039   .   1   1   5    TRP   CZ3    C   -2.232    9.111     3.072     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   CZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10040   .   1   1   5    TRP   H      H   -1.173    5.662     3.016     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10041   .   1   1   5    TRP   HA     H   0.971     3.934     2.498     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10042   .   1   1   5    TRP   HB2    H   2.376     5.932     2.610     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10043   .   1   1   5    TRP   HB3    H   0.902     6.254     1.708     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10044   .   1   1   5    TRP   HD1    H   2.778     7.261     4.834     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10045   .   1   1   5    TRP   HE1    H   1.626     9.309     5.921     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10046   .   1   1   5    TRP   HE3    H   -1.487    7.422     2.013     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10047   .   1   1   5    TRP   HH2    H   -2.782    10.796    4.258     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10048   .   1   1   5    TRP   HZ2    H   -0.751    10.763    5.625     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10049   .   1   1   5    TRP   HZ3    H   -3.144    9.160     2.495     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10050   .   1   1   5    TRP   N      N   -0.762    4.805     3.242     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10051   .   1   1   5    TRP   NE1    N   1.247     8.789     5.177     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   NE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10052   .   1   1   5    TRP   O      O   2.398     3.787     4.654     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   5    TRP   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10053   .   1   1   6    MET   C      C   0.707     3.047     7.413     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10054   .   1   1   6    MET   CA     C   1.098     4.459     6.969     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10055   .   1   1   6    MET   CB     C   0.508     5.514     7.901     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10056   .   1   1   6    MET   CE     C   1.233     6.448     11.882    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10057   .   1   1   6    MET   CG     C   0.996     5.434     9.322     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10058   .   1   1   6    MET   H      H   -0.225    5.174     5.486     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10059   .   1   1   6    MET   HA     H   2.174     4.549     6.972     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10060   .   1   1   6    MET   HB2    H   0.747     6.495     7.518     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10061   .   1   1   6    MET   HB3    H   -0.565    5.393     7.907     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10062   .   1   1   6    MET   HE1    H   0.978     7.204     12.610    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10063   .   1   1   6    MET   HE2    H   2.304     6.432     11.739    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10064   .   1   1   6    MET   HE3    H   0.899     5.483     12.232    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10065   .   1   1   6    MET   HG2    H   0.635     4.508     9.749     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10066   .   1   1   6    MET   HG3    H   2.073     5.413     9.280     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10067   .   1   1   6    MET   N      N   0.626     4.710     5.621     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10068   .   1   1   6    MET   O      O   1.198     2.518     8.410     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10069   .   1   1   6    MET   SD     S   0.429     6.817     10.328    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   6    MET   SD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10070   .   1   1   7    TRP   C      C   0.096     0.089     6.104     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10071   .   1   1   7    TRP   CA     C   -0.671    1.125     6.920     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10072   .   1   1   7    TRP   CB     C   -2.169    1.059     6.560     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10073   .   1   1   7    TRP   CD1    C   -2.708    2.943     8.255     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10074   .   1   1   7    TRP   CD2    C   -4.490    2.077     7.227     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10075   .   1   1   7    TRP   CE2    C   -4.923    3.083     8.106     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10076   .   1   1   7    TRP   CE3    C   -5.435    1.395     6.472     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10077   .   1   1   7    TRP   CG     C   -3.068    1.999     7.332     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10078   .   1   1   7    TRP   CH2    C   -7.165    2.730     7.490     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10079   .   1   1   7    TRP   CZ2    C   -6.261    3.418     8.246     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10080   .   1   1   7    TRP   CZ3    C   -6.763    1.727     6.612     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   CZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10081   .   1   1   7    TRP   H      H   -0.396    2.908     5.818     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10082   .   1   1   7    TRP   HA     H   -0.550    0.920     7.973     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10083   .   1   1   7    TRP   HB2    H   -2.279    1.306     5.514     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10084   .   1   1   7    TRP   HB3    H   -2.525    0.051     6.714     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10085   .   1   1   7    TRP   HD1    H   -1.690    3.132     8.562     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10086   .   1   1   7    TRP   HE1    H   -3.817    4.312     9.392     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10087   .   1   1   7    TRP   HE3    H   -5.142    0.608     5.795     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10088   .   1   1   7    TRP   HH2    H   -8.217    2.958     7.568     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10089   .   1   1   7    TRP   HZ2    H   -6.591    4.190     8.924     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10090   .   1   1   7    TRP   HZ3    H   -7.506    1.203     6.027     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10091   .   1   1   7    TRP   N      N   -0.142    2.448     6.644     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10092   .   1   1   7    TRP   NE1    N   -3.819    3.594     8.721     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   NE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10093   .   1   1   7    TRP   O      O   1.063     0.423     5.402     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   7    TRP   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10094   .   1   1   8    THR   C      C   -0.723    -2.949    4.644     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10095   .   1   1   8    THR   CA     C   0.343     -2.207    5.449     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10096   .   1   1   8    THR   CB     C   1.057     -3.188    6.417     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10097   .   1   1   8    THR   CG2    C   2.117     -2.466    7.255     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   CG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10098   .   1   1   8    THR   H      H   -1.059    -1.402    6.767     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10099   .   1   1   8    THR   HA     H   1.063     -1.744    4.791     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10100   .   1   1   8    THR   HB     H   1.533     -3.965    5.839     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10101   .   1   1   8    THR   HG1    H   0.460     -4.624    7.604     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HG1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10102   .   1   1   8    THR   HG21   H   2.610     -3.171    7.908     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HG21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10103   .   1   1   8    THR   HG22   H   1.640     -1.700    7.848     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HG22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10104   .   1   1   8    THR   HG23   H   2.847     -1.994    6.613     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   HG23   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10105   .   1   1   8    THR   N      N   -0.304    -1.149    6.192     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10106   .   1   1   8    THR   O      O   -1.920    -2.772    4.922     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10107   .   1   1   8    THR   OG1    O   0.096     -3.782    7.304     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   8    THR   OG1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10108   .   1   1   9    CYS   C      C   -0.969    -5.916    2.717     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10109   .   1   1   9    CYS   CA     C   -1.384    -4.487    2.955     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10110   .   1   1   9    CYS   CB     C   -1.784    -3.798    1.655     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10111   .   1   1   9    CYS   H      H   0.578     -3.901    3.348     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10112   .   1   1   9    CYS   HA     H   -2.242    -4.506    3.611     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10113   .   1   1   9    CYS   HB2    H   -2.599    -4.343    1.203     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10114   .   1   1   9    CYS   HB3    H   -2.116    -2.795    1.881     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10115   .   1   1   9    CYS   N      N   -0.351    -3.757    3.651     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10116   .   1   1   9    CYS   O      O   0.215     -6.246    2.814     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10117   .   1   1   9    CYS   SG     S   -0.471    -3.677    0.419     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   9    CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10118   .   1   1   10   ASP   C      C   -2.833    -8.638    1.222     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10119   .   1   1   10   ASP   CA     C   -1.745    -8.181    2.183     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10120   .   1   1   10   ASP   CB     C   -1.771    -9.019    3.493     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10121   .   1   1   10   ASP   CG     C   -0.588    -8.767    4.412     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10122   .   1   1   10   ASP   H      H   -2.861    -6.415    2.339     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10123   .   1   1   10   ASP   HA     H   -0.788    -8.287    1.694     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10124   .   1   1   10   ASP   HB2    H   -2.669    -8.790    4.045     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10125   .   1   1   10   ASP   HB3    H   -1.776    -10.068   3.236     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10126   .   1   1   10   ASP   N      N   -1.943    -6.760    2.433     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10127   .   1   1   10   ASP   O      O   -3.230    -7.872    0.352     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10128   .   1   1   10   ASP   OD1    O   0.544     -9.241    4.103     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   OD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10129   .   1   1   10   ASP   OD2    O   -0.762    -8.115    5.478     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   10   ASP   OD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10130   .   1   1   11   SER   C      C   -5.707    -9.761    0.664     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10131   .   1   1   11   SER   CA     C   -4.307    -10.386   0.449     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10132   .   1   1   11   SER   CB     C   -4.354    -11.919   0.599     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10133   .   1   1   11   SER   H      H   -3.048    -10.398   2.135     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10134   .   1   1   11   SER   HA     H   -3.975    -10.152   -0.552    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10135   .   1   1   11   SER   HB2    H   -3.349    -12.311   0.570     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10136   .   1   1   11   SER   HB3    H   -4.795    -12.154   1.556     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10137   .   1   1   11   SER   HG     H   -5.716    -13.174   0.022     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   HG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10138   .   1   1   11   SER   N      N   -3.331    -9.847    1.376     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10139   .   1   1   11   SER   O      O   -6.363    -9.343    -0.299    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10140   .   1   1   11   SER   OG     O   -5.124    -12.553   -0.427    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   11   SER   OG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10141   .   1   1   12   GLU   C      C   -7.511    -7.635    2.242     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10142   .   1   1   12   GLU   CA     C   -7.470    -9.159    2.236     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10143   .   1   1   12   GLU   CB     C   -7.921    -9.706    3.585     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10144   .   1   1   12   GLU   CD     C   -9.127    -11.728   2.721     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10145   .   1   1   12   GLU   CG     C   -8.047    -11.218   3.630     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10146   .   1   1   12   GLU   H      H   -5.542    -9.942    2.644     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10147   .   1   1   12   GLU   HA     H   -8.147    -9.519    1.477     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10148   .   1   1   12   GLU   HB2    H   -7.215    -9.401    4.343     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10149   .   1   1   12   GLU   HB3    H   -8.887    -9.282    3.817     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10150   .   1   1   12   GLU   HG2    H   -7.107    -11.651   3.316     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10151   .   1   1   12   GLU   HG3    H   -8.261    -11.531   4.640     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10152   .   1   1   12   GLU   N      N   -6.133    -9.661    1.912     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10153   .   1   1   12   GLU   O      O   -8.467    -7.015    1.765     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10154   .   1   1   12   GLU   OE1    O   -8.818    -12.180   1.600     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   OE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10155   .   1   1   12   GLU   OE2    O   -10.322   -11.679   3.107     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   12   GLU   OE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10156   .   1   1   13   ARG   C      C   -5.569    -5.194    1.636     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10157   .   1   1   13   ARG   CA     C   -6.399    -5.605    2.801     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10158   .   1   1   13   ARG   CB     C   -5.773    -5.105    4.087     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10159   .   1   1   13   ARG   CD     C   -7.875    -4.574    5.433     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10160   .   1   1   13   ARG   CG     C   -6.579    -5.384    5.346     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10161   .   1   1   13   ARG   CZ     C   -10.218   -4.629    4.558     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   CZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10162   .   1   1   13   ARG   H      H   -5.804    -7.568    3.231     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10163   .   1   1   13   ARG   HA     H   -7.386    -5.181    2.695     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10164   .   1   1   13   ARG   HB2    H   -4.805    -5.568    4.199     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10165   .   1   1   13   ARG   HB3    H   -5.634    -4.037    4.006     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10166   .   1   1   13   ARG   HD2    H   -8.247    -4.646    6.442     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10167   .   1   1   13   ARG   HD3    H   -7.635    -3.542    5.222     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10168   .   1   1   13   ARG   HE     H   -8.648    -5.649    3.799     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10169   .   1   1   13   ARG   HG2    H   -6.858    -6.424    5.297     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10170   .   1   1   13   ARG   HG3    H   -5.966    -5.194    6.213     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10171   .   1   1   13   ARG   HH11   H   -9.994    -3.430    6.212     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HH11   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10172   .   1   1   13   ARG   HH12   H   -11.589   -3.517    5.596     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HH12   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10173   .   1   1   13   ARG   HH21   H   -10.856   -5.712    2.929     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HH21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10174   .   1   1   13   ARG   HH22   H   -12.062   -4.812    3.732     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   HH22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10175   .   1   1   13   ARG   N      N   -6.507    -7.035    2.802     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10176   .   1   1   13   ARG   NE     N   -8.932    -5.020    4.497     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   NE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10177   .   1   1   13   ARG   NH1    N   -10.625   -3.793    5.519     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   NH1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10178   .   1   1   13   ARG   NH2    N   -11.096   -5.080    3.670     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   NH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10179   .   1   1   13   ARG   O      O   -4.377    -5.478    1.586     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   13   ARG   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10180   .   1   1   14   LYS   C      C   -5.190    -2.661    -0.373    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10181   .   1   1   14   LYS   CA     C   -5.505    -4.129    -0.488    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10182   .   1   1   14   LYS   CB     C   -6.340    -4.395    -1.741    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10183   .   1   1   14   LYS   CD     C   -7.573    -6.054    -3.198    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10184   .   1   1   14   LYS   CE     C   -6.702    -5.846    -4.436    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10185   .   1   1   14   LYS   CG     C   -6.798    -5.840    -1.900    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10186   .   1   1   14   LYS   H      H   -7.137    -4.355    0.844     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10187   .   1   1   14   LYS   HA     H   -4.577    -4.678    -0.554    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10188   .   1   1   14   LYS   HB2    H   -7.215    -3.767    -1.720    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10189   .   1   1   14   LYS   HB3    H   -5.743    -4.132    -2.602    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10190   .   1   1   14   LYS   HD2    H   -7.949    -7.066    -3.215    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10191   .   1   1   14   LYS   HD3    H   -8.402    -5.365    -3.227    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10192   .   1   1   14   LYS   HE2    H   -7.313    -5.994    -5.313    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10193   .   1   1   14   LYS   HE3    H   -6.322    -4.836    -4.440    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10194   .   1   1   14   LYS   HG2    H   -5.938    -6.493    -1.894    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10195   .   1   1   14   LYS   HG3    H   -7.436    -6.093    -1.067    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10196   .   1   1   14   LYS   HZ1    H   -5.901    -7.781    -4.451    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10197   .   1   1   14   LYS   HZ2    H   -4.904    -6.643    -3.697    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10198   .   1   1   14   LYS   HZ3    H   -5.022    -6.681    -5.361    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10199   .   1   1   14   LYS   N      N   -6.187    -4.558    0.705     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10200   .   1   1   14   LYS   NZ     N   -5.567    -6.797    -4.483    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10201   .   1   1   14   LYS   O      O   -6.013    -1.873    0.134     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   14   LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10202   .   1   1   15   CYS   C      C   -4.116    -0.127    -1.885    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10203   .   1   1   15   CYS   CA     C   -3.578    -0.936    -0.722    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10204   .   1   1   15   CYS   CB     C   -2.057    -0.905    -0.689    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10205   .   1   1   15   CYS   H      H   -3.457    -2.950    -1.268    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10206   .   1   1   15   CYS   HA     H   -3.963    -0.514    0.193     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10207   .   1   1   15   CYS   HB2    H   -1.703    -1.702    -0.054    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10208   .   1   1   15   CYS   HB3    H   -1.685    -1.066    -1.690    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10209   .   1   1   15   CYS   N      N   -4.033    -2.292    -0.825    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10210   .   1   1   15   CYS   O      O   -4.564    -0.692    -2.895    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10211   .   1   1   15   CYS   SG     S   -1.343    0.633     -0.073    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   15   CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10212   .   1   1   16   CYS   C      C   -3.682    2.175     -3.950    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10213   .   1   1   16   CYS   CA     C   -4.636    2.029     -2.760    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10214   .   1   1   16   CYS   CB     C   -4.979    3.390     -2.160    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10215   .   1   1   16   CYS   H      H   -3.703    1.566     -0.945    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10216   .   1   1   16   CYS   HA     H   -5.548    1.568     -3.100    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10217   .   1   1   16   CYS   HB2    H   -4.076    3.844     -1.780    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10218   .   1   1   16   CYS   HB3    H   -5.389    4.016     -2.940    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10219   .   1   1   16   CYS   N      N   -4.093    1.163     -1.752    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10220   .   1   1   16   CYS   O      O   -2.442    2.128     -3.797    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10221   .   1   1   16   CYS   SG     S   -6.199    3.339     -0.780    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   16   CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10222   .   1   1   17   LYS   C      C   -2.771    3.844     -6.305    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10223   .   1   1   17   LYS   CA     C   -3.474    2.500     -6.344    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10224   .   1   1   17   LYS   CB     C   -4.331    2.318     -7.610    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10225   .   1   1   17   LYS   CD     C   -4.383    -0.251    -7.392    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10226   .   1   1   17   LYS   CE     C   -5.835    -0.389    -6.942    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10227   .   1   1   17   LYS   CG     C   -4.144    0.958     -8.311    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10228   .   1   1   17   LYS   H      H   -5.231    2.287     -5.193    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10229   .   1   1   17   LYS   HA     H   -2.703    1.744     -6.330    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10230   .   1   1   17   LYS   HB2    H   -5.372    2.420     -7.342    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10231   .   1   1   17   LYS   HB3    H   -4.075    3.097     -8.312    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10232   .   1   1   17   LYS   HD2    H   -4.106    -1.149    -7.925    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10233   .   1   1   17   LYS   HD3    H   -3.753    -0.152    -6.519    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10234   .   1   1   17   LYS   HE2    H   -5.903    -1.210    -6.245    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10235   .   1   1   17   LYS   HE3    H   -6.127    0.526     -6.449    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10236   .   1   1   17   LYS   HG2    H   -4.838    0.894     -9.135    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10237   .   1   1   17   LYS   HG3    H   -3.136    0.909     -8.699    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10238   .   1   1   17   LYS   HZ1    H   -6.454    -1.492    -8.597    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10239   .   1   1   17   LYS   HZ2    H   -6.835    0.155     -8.718    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10240   .   1   1   17   LYS   HZ3    H   -7.708    -0.856    -7.693    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10241   .   1   1   17   LYS   N      N   -4.253    2.304     -5.137    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10242   .   1   1   17   LYS   NZ     N   -6.760    -0.651    -8.066    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10243   .   1   1   17   LYS   O      O   -3.331    4.841     -5.843    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   17   LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10244   .   1   1   18   GLY   C      C   0.429     4.662     -5.700    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10245   .   1   1   18   GLY   CA     C   -0.696    5.004     -6.648    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10246   .   1   1   18   GLY   H      H   -1.198    3.059     -7.233    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10247   .   1   1   18   GLY   HA2    H   -0.300    5.270     -7.618    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   HA2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10248   .   1   1   18   GLY   HA3    H   -1.261    5.827     -6.238    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   HA3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10249   .   1   1   18   GLY   N      N   -1.552    3.850     -6.773    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10250   .   1   1   18   GLY   O      O   1.498     5.288     -5.685    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   18   GLY   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10251   .   1   1   19   MET   C      C   1.444     1.698     -4.435    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10252   .   1   1   19   MET   CA     C   1.128     3.098     -3.982    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10253   .   1   1   19   MET   CB     C   0.531     3.029     -2.574    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10254   .   1   1   19   MET   CE     C   -1.213    5.896     -0.174    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10255   .   1   1   19   MET   CG     C   0.100     4.358     -2.015    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10256   .   1   1   19   MET   H      H   -0.725    3.248     -4.931    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10257   .   1   1   19   MET   HA     H   2.020     3.706     -3.971    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10258   .   1   1   19   MET   HB2    H   -0.334    2.382     -2.599    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10259   .   1   1   19   MET   HB3    H   1.264     2.600     -1.907    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10260   .   1   1   19   MET   HE1    H   -1.777    5.957     0.745     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10261   .   1   1   19   MET   HE2    H   -1.826    6.226     -0.998    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10262   .   1   1   19   MET   HE3    H   -0.333    6.517     -0.101    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10263   .   1   1   19   MET   HG2    H   0.993     4.946     -1.861    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10264   .   1   1   19   MET   HG3    H   -0.556    4.848     -2.718    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10265   .   1   1   19   MET   N      N   0.171     3.648     -4.904    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10266   .   1   1   19   MET   O      O   0.805     1.185     -5.365    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10267   .   1   1   19   MET   SD     S   -0.734    4.204     -0.434    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   19   MET   SD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10268   .   1   1   20   VAL   C      C   2.194     -1.075    -2.904    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10269   .   1   1   20   VAL   CA     C   2.708     -0.275    -4.070    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10270   .   1   1   20   VAL   CB     C   4.243     -0.489    -4.200    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10271   .   1   1   20   VAL   CG1    C   4.572     -1.943    -4.510    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   CG1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10272   .   1   1   20   VAL   CG2    C   4.827     0.419     -5.263    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   CG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10273   .   1   1   20   VAL   H      H   2.905     1.562     -3.119    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10274   .   1   1   20   VAL   HA     H   2.218     -0.587    -4.980    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10275   .   1   1   20   VAL   HB     H   4.697     -0.240    -3.250    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10276   .   1   1   20   VAL   HG11   H   4.203     -2.575    -3.715    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG11   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10277   .   1   1   20   VAL   HG12   H   5.641     -2.061    -4.599    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG12   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10278   .   1   1   20   VAL   HG13   H   4.102     -2.224    -5.440    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG13   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10279   .   1   1   20   VAL   HG21   H   5.888     0.235     -5.352    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10280   .   1   1   20   VAL   HG22   H   4.665     1.448     -4.980    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10281   .   1   1   20   VAL   HG23   H   4.345     0.223     -6.208    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   HG23   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10282   .   1   1   20   VAL   N      N   2.381     1.086     -3.809    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10283   .   1   1   20   VAL   O      O   2.463     -0.729    -1.737    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   20   VAL   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10284   .   1   1   21   CYS   C      C   1.961     -3.945    -1.834    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10285   .   1   1   21   CYS   CA     C   0.897     -2.927    -2.174    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10286   .   1   1   21   CYS   CB     C   -0.407    -3.598    -2.617    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10287   .   1   1   21   CYS   H      H   1.225     -2.297    -4.135    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10288   .   1   1   21   CYS   HA     H   0.716     -2.312    -1.304    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10289   .   1   1   21   CYS   HB2    H   -1.068    -2.849    -3.023    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10290   .   1   1   21   CYS   HB3    H   -0.186    -4.330    -3.380    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10291   .   1   1   21   CYS   N      N   1.424     -2.087    -3.197    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10292   .   1   1   21   CYS   O      O   2.276     -4.842    -2.634    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10293   .   1   1   21   CYS   SG     S   -1.304    -4.449    -1.268    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   21   CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10294   .   1   1   22   ARG   C      C   3.422     -4.848    1.236     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10295   .   1   1   22   ARG   CA     C   3.643     -4.546    -0.260    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10296   .   1   1   22   ARG   CB     C   4.924     -3.675    -0.509    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10297   .   1   1   22   ARG   CD     C   6.428     -5.494    -1.416    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10298   .   1   1   22   ARG   CG     C   6.286     -4.371    -0.405    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10299   .   1   1   22   ARG   CZ     C   5.836     -5.696    -3.827    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   CZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10300   .   1   1   22   ARG   H      H   2.203     -3.078    -0.078    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10301   .   1   1   22   ARG   HA     H   3.706     -5.458    -0.831    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10302   .   1   1   22   ARG   HB2    H   4.858     -3.258    -1.503    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10303   .   1   1   22   ARG   HB3    H   4.909     -2.856    0.196     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10304   .   1   1   22   ARG   HD2    H   7.372     -5.989    -1.254    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10305   .   1   1   22   ARG   HD3    H   5.624     -6.196    -1.260    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10306   .   1   1   22   ARG   HE     H   6.815     -4.144    -2.955    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10307   .   1   1   22   ARG   HG2    H   7.049     -3.634    -0.613    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10308   .   1   1   22   ARG   HG3    H   6.441     -4.754    0.591     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10309   .   1   1   22   ARG   HH11   H   5.167     -7.286    -2.702    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HH11   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10310   .   1   1   22   ARG   HH12   H   4.841     -7.401    -4.364    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HH12   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10311   .   1   1   22   ARG   HH21   H   6.309     -4.321    -5.293    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HH21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10312   .   1   1   22   ARG   HH22   H   5.456     -5.679    -5.834    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   HH22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10313   .   1   1   22   ARG   N      N   2.541     -3.768    -0.693    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10314   .   1   1   22   ARG   NE     N   6.381     -5.017    -2.804    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   NE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10315   .   1   1   22   ARG   NH1    N   5.238     -6.868    -3.612    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   NH1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10316   .   1   1   22   ARG   NH2    N   5.880     -5.196    -5.061    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   NH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10317   .   1   1   22   ARG   O      O   2.299     -4.600    1.781     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   22   ARG   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10318   .   1   1   23   LEU   C      C   3.983     -4.459    4.127     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10319   .   1   1   23   LEU   CA     C   4.505     -5.647    3.335     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10320   .   1   1   23   LEU   CB     C   5.944     -5.925    3.750     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10321   .   1   1   23   LEU   CD1    C   8.107     -7.092    3.411     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10322   .   1   1   23   LEU   CD2    C   5.991     -8.402    3.372     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10323   .   1   1   23   LEU   CG     C   6.646     -7.070    3.031     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10324   .   1   1   23   LEU   H      H   5.269     -5.593    1.380     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10325   .   1   1   23   LEU   HA     H   3.907     -6.524    3.527     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10326   .   1   1   23   LEU   HB2    H   6.515     -5.028    3.567     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10327   .   1   1   23   LEU   HB3    H   5.960     -6.133    4.810     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10328   .   1   1   23   LEU   HD11   H   8.203     -7.265    4.473     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD11   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10329   .   1   1   23   LEU   HD12   H   8.556     -6.142    3.161     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD12   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10330   .   1   1   23   LEU   HD13   H   8.612     -7.877    2.868     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD13   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10331   .   1   1   23   LEU   HD21   H   4.949     -8.373    3.097     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10332   .   1   1   23   LEU   HD22   H   6.083     -8.585    4.433     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10333   .   1   1   23   LEU   HD23   H   6.482     -9.195    2.831     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HD23   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10334   .   1   1   23   LEU   HG     H   6.578     -6.920    1.962     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   HG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10335   .   1   1   23   LEU   N      N   4.471     -5.360    1.894     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10336   .   1   1   23   LEU   O      O   3.448     -4.607    5.215     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   23   LEU   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10337   .   1   1   24   TRP   C      C   3.204     -1.285    2.834     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10338   .   1   1   24   TRP   CA     C   3.634     -2.082    4.066     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10339   .   1   1   24   TRP   CB     C   4.684     -1.312    4.891     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10340   .   1   1   24   TRP   CD1    C   5.827     0.498     3.550     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10341   .   1   1   24   TRP   CD2    C   7.037     -1.361    3.714     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10342   .   1   1   24   TRP   CE2    C   7.757     -0.428    2.944     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10343   .   1   1   24   TRP   CE3    C   7.602     -2.612    3.955     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10344   .   1   1   24   TRP   CG     C   5.802     -0.736    4.082     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10345   .   1   1   24   TRP   CH2    C   9.536     -1.945    2.669     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10346   .   1   1   24   TRP   CZ2    C   9.008     -0.710    2.416     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10347   .   1   1   24   TRP   CZ3    C   8.846     -2.891    3.431     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   CZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10348   .   1   1   24   TRP   H      H   4.658     -3.227    2.720     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10349   .   1   1   24   TRP   HA     H   2.787     -2.347    4.675     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10350   .   1   1   24   TRP   HB2    H   4.198     -0.495    5.401     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10351   .   1   1   24   TRP   HB3    H   5.110     -1.981    5.624     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10352   .   1   1   24   TRP   HD1    H   5.001     1.184     3.678     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10353   .   1   1   24   TRP   HE1    H   7.228     1.527     2.380     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10354   .   1   1   24   TRP   HE3    H   7.084     -3.350    4.547     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10355   .   1   1   24   TRP   HH2    H   10.507    -2.206    2.274     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10356   .   1   1   24   TRP   HZ2    H   9.561     0.005     1.824     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10357   .   1   1   24   TRP   HZ3    H   9.301     -3.856    3.605     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10358   .   1   1   24   TRP   N      N   4.165     -3.294    3.564     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10359   .   1   1   24   TRP   NE1    N   6.993     0.700     2.858     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   NE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10360   .   1   1   24   TRP   O      O   3.615     -1.640    1.720     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   24   TRP   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10361   .   1   1   25   CYS   C      C   3.117     1.548     1.563     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10362   .   1   1   25   CYS   CA     C   2.039     0.552     1.855     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10363   .   1   1   25   CYS   CB     C   0.706     1.232     2.030     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10364   .   1   1   25   CYS   H      H   2.027     -0.030    3.871     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10365   .   1   1   25   CYS   HA     H   1.982     -0.115    1.008     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10366   .   1   1   25   CYS   HB2    H   0.644     1.640     3.028     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10367   .   1   1   25   CYS   HB3    H   0.624     2.034     1.311     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10368   .   1   1   25   CYS   N      N   2.398     -0.273    2.992     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10369   .   1   1   25   CYS   O      O   3.579     2.271     2.447     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10370   .   1   1   25   CYS   SG     S   -0.710    0.134     1.795     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   25   CYS   SG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10371   .   1   1   26   LYS   C      C   4.220     3.186     -1.275    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10372   .   1   1   26   LYS   CA     C   4.616     2.400     -0.058    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10373   .   1   1   26   LYS   CB     C   5.794     1.486     -0.367    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10374   .   1   1   26   LYS   CD     C   8.139     1.159     -1.062    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10375   .   1   1   26   LYS   CE     C   9.422     1.792     -1.555    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10376   .   1   1   26   LYS   CG     C   7.050     2.178     -0.823    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10377   .   1   1   26   LYS   H      H   3.073     1.033     -0.338    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10378   .   1   1   26   LYS   HA     H   4.889     3.057     0.753     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10379   .   1   1   26   LYS   HB2    H   6.033     0.923     0.523     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10380   .   1   1   26   LYS   HB3    H   5.491     0.791     -1.137    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10381   .   1   1   26   LYS   HD2    H   8.342     0.649     -0.132    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10382   .   1   1   26   LYS   HD3    H   7.793     0.443     -1.790    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10383   .   1   1   26   LYS   HE2    H   9.218     2.379     -2.436    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10384   .   1   1   26   LYS   HE3    H   9.820     2.429     -0.780    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10385   .   1   1   26   LYS   HG2    H   6.838     2.711     -1.739    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10386   .   1   1   26   LYS   HG3    H   7.355     2.874     -0.060    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10387   .   1   1   26   LYS   HZ1    H   11.328    1.160     -2.175    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10388   .   1   1   26   LYS   HZ2    H   10.078    0.147     -2.648    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10389   .   1   1   26   LYS   HZ3    H   10.585    0.151     -1.055    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10390   .   1   1   26   LYS   N      N   3.526     1.581     0.341     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10391   .   1   1   26   LYS   NZ     N   10.418    0.761     -1.879    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10392   .   1   1   26   LYS   O      O   3.839     2.607     -2.267    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   26   LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10393   .   1   1   27   LYS   C      C   4.888     5.108     -3.465    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10394   .   1   1   27   LYS   CA     C   3.936     5.340     -2.321    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10395   .   1   1   27   LYS   CB     C   3.926     6.813     -1.940    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10396   .   1   1   27   LYS   CD     C   2.869     8.686     -0.603    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10397   .   1   1   27   LYS   CE     C   2.777     9.618     -1.817    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10398   .   1   1   27   LYS   CG     C   2.806     7.207     -0.984    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10399   .   1   1   27   LYS   H      H   4.608     4.894     -0.360    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10400   .   1   1   27   LYS   HA     H   2.946     5.055     -2.643    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10401   .   1   1   27   LYS   HB2    H   4.880     7.047     -1.499    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10402   .   1   1   27   LYS   HB3    H   3.824     7.393     -2.845    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10403   .   1   1   27   LYS   HD2    H   2.054     8.911     0.067     .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10404   .   1   1   27   LYS   HD3    H   3.805     8.869     -0.093    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10405   .   1   1   27   LYS   HE2    H   2.806     10.640    -1.466    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10406   .   1   1   27   LYS   HE3    H   3.627     9.447     -2.459    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10407   .   1   1   27   LYS   HG2    H   1.858     7.016     -1.464    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10408   .   1   1   27   LYS   HG3    H   2.882     6.605     -0.091    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10409   .   1   1   27   LYS   HZ1    H   1.473     8.483     -3.030    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10410   .   1   1   27   LYS   HZ2    H   1.471     10.127    -3.357    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10411   .   1   1   27   LYS   HZ3    H   0.694     9.560     -1.992    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10412   .   1   1   27   LYS   N      N   4.285     4.494     -1.195    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10413   .   1   1   27   LYS   NZ     N   1.532     9.425     -2.593    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10414   .   1   1   27   LYS   O      O   6.093     4.892     -3.261    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   27   LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10415   .   1   1   28   LYS   C      C   5.424     6.182     -6.481    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10416   .   1   1   28   LYS   CA     C   5.158     4.872     -5.793    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10417   .   1   1   28   LYS   CB     C   4.449     3.894     -6.731    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10418   .   1   1   28   LYS   CD     C   4.621     2.282     -8.667    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   CD     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10419   .   1   1   28   LYS   CE     C   3.735     3.005     -9.666    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   CE     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10420   .   1   1   28   LYS   CG     C   5.371     3.248     -7.757    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10421   .   1   1   28   LYS   H      H   3.417     5.357     -4.747    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10422   .   1   1   28   LYS   HA     H   6.095     4.444     -5.471    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10423   .   1   1   28   LYS   HB2    H   3.988     3.116     -6.142    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10424   .   1   1   28   LYS   HB3    H   3.678     4.435     -7.259    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10425   .   1   1   28   LYS   HD2    H   5.340     1.690     -9.212    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10426   .   1   1   28   LYS   HD3    H   4.010     1.634     -8.055    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HD3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10427   .   1   1   28   LYS   HE2    H   3.082     2.277     -10.126   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10428   .   1   1   28   LYS   HE3    H   3.137     3.740     -9.149    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10429   .   1   1   28   LYS   HG2    H   5.819     4.022     -8.364    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HG2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10430   .   1   1   28   LYS   HG3    H   6.148     2.710     -7.234    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HG3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10431   .   1   1   28   LYS   HZ1    H   5.354     4.181     -10.370   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HZ1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10432   .   1   1   28   LYS   HZ2    H   3.926     4.383     -11.208   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10433   .   1   1   28   LYS   HZ3    H   4.842     3.000     -11.454   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10434   .   1   1   28   LYS   N      N   4.365     5.127     -4.643    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10435   .   1   1   28   LYS   NZ     N   4.517     3.674     -10.731   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   NZ     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10436   .   1   1   28   LYS   O      O   4.527     6.774     -7.088    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   28   LYS   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10437   .   1   1   29   LEU   C      C   7.541     7.668     -8.334    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10438   .   1   1   29   LEU   CA     C   7.000     7.920     -6.945    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10439   .   1   1   29   LEU   CB     C   8.012     8.703     -6.085    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10440   .   1   1   29   LEU   CD1    C   6.268     10.118    -4.881    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10441   .   1   1   29   LEU   CD2    C   7.319     8.178     -3.673    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10442   .   1   1   29   LEU   CG     C   7.519     9.267     -4.723    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10443   .   1   1   29   LEU   H      H   7.276     6.163     -5.809    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10444   .   1   1   29   LEU   HA     H   6.098     8.503     -7.048    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10445   .   1   1   29   LEU   HB2    H   8.842     8.043     -5.885    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10446   .   1   1   29   LEU   HB3    H   8.378     9.530     -6.677    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10447   .   1   1   29   LEU   HD11   H   6.472     10.939    -5.552    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD11   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10448   .   1   1   29   LEU   HD12   H   5.979     10.509    -3.917    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD12   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10449   .   1   1   29   LEU   HD13   H   5.463     9.516     -5.277    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD13   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10450   .   1   1   29   LEU   HD21   H   6.967     8.623     -2.755    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD21   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10451   .   1   1   29   LEU   HD22   H   8.260     7.678     -3.492    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD22   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10452   .   1   1   29   LEU   HD23   H   6.593     7.462     -4.030    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HD23   .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10453   .   1   1   29   LEU   HG     H   8.289     9.938     -4.370    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   HG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10454   .   1   1   29   LEU   N      N   6.620     6.668     -6.337    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10455   .   1   1   29   LEU   O      O   7.528     8.553     -9.199    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   29   LEU   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10456   .   1   1   30   TRP   C      C   7.322     5.241     -10.423   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   C      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10457   .   1   1   30   TRP   CA     C   8.453     6.052     -9.840    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10458   .   1   1   30   TRP   CB     C   9.732     5.203     -9.732    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CB     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10459   .   1   1   30   TRP   CD1    C   11.498    5.657     -11.531   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10460   .   1   1   30   TRP   CD2    C   10.153    3.940     -12.038   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CD2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10461   .   1   1   30   TRP   CE2    C   11.082    4.107     -13.080   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CE2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10462   .   1   1   30   TRP   CE3    C   9.208     2.917     -12.144   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10463   .   1   1   30   TRP   CG     C   10.439    4.955     -11.046   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CG     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10464   .   1   1   30   TRP   CH2    C   10.159    2.298     -14.280   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10465   .   1   1   30   TRP   CZ2    C   11.096    3.291     -14.206   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10466   .   1   1   30   TRP   CZ3    C   9.220     2.109     -13.262   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   CZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10467   .   1   1   30   TRP   H      H   8.044     5.819     -7.810    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   H      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10468   .   1   1   30   TRP   HA     H   8.629     6.928     -10.448   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HA     .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10469   .   1   1   30   TRP   HB2    H   10.429    5.701     -9.075    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HB2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10470   .   1   1   30   TRP   HB3    H   9.474     4.247     -9.306    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HB3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10471   .   1   1   30   TRP   HD1    H   11.957    6.490     -11.015   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HD1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10472   .   1   1   30   TRP   HE1    H   12.630    5.496     -13.293   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10473   .   1   1   30   TRP   HE3    H   8.472     2.763     -11.370   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HE3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10474   .   1   1   30   TRP   HH2    H   10.132    1.642     -15.137   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HH2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10475   .   1   1   30   TRP   HZ2    H   11.816    3.424     -15.001   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HZ2    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10476   .   1   1   30   TRP   HZ3    H   8.494     1.313     -13.357   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   HZ3    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10477   .   1   1   30   TRP   N      N   8.006     6.467     -8.547    .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   N      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10478   .   1   1   30   TRP   NE1    N   11.890    5.151     -12.744   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   NE1    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10479   .   1   1   30   TRP   O      O   7.202     4.060     -10.098   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   O      .   .   .   .   .   .   .   .   .   c30521_6mk4   1    
     .   20   .   10480   .   1   1   30   TRP   OXT    O   6.478     5.805     -11.142   .   .   .   1.0   .   .   .   .   .   .   .   .   .   .   .   .   A   .   30   TRP   OXT    .   .   .   .   .   .   .   .   .   c30521_6mk4   1    

   stop_

save_

###########################
#  Constraint Statistics  #
###########################

save_constraint_statistics
   _Constraint_stat_list.Sf_framecode  constraint_statistics
   _Constraint_stat_list.Sf_category   constraint_statistics
   _Constraint_stat_list.Entry_ID      c30521_6mk4
   _Constraint_stat_list.ID            1

   loop_
      _Constraint_file.ID
      _Constraint_file.Constraint_filename
      _Constraint_file.Software_ID
      _Constraint_file.Software_label
      _Constraint_file.Software_name
      _Constraint_file.Block_ID
      _Constraint_file.Constraint_type
      _Constraint_file.Constraint_subtype
      _Constraint_file.Constraint_subsubtype
      _Constraint_file.Constraint_number
      _Constraint_file.Entry_ID
      _Constraint_file.Constraint_stat_list_ID

     1   6mk4.mr   .   .   'MR format'   1   comment                  'Not applicable'   'Not applicable'   0     c30521_6mk4   1    
     1   6mk4.mr   .   .   XPLOR/CNS     2   distance                 NOE                simple             366   c30521_6mk4   1    
     1   6mk4.mr   .   .   XPLOR/CNS     3   'dihedral angle'         'Not applicable'   'Not applicable'   38    c30521_6mk4   1    
     1   6mk4.mr   .   .   XPLOR/CNS     4   distance                 'hydrogen bond'    simple             10    c30521_6mk4   1    
     1   6mk4.mr   .   .   'MR format'   5   'nomenclature mapping'   'Not applicable'   'Not applicable'   0     c30521_6mk4   1    

   stop_

save_

save_CNS/XPLOR_distance_constraints_2
   _Gen_dist_constraint_list.Sf_category         general_distance_constraints
   _Gen_dist_constraint_list.Sf_framecode        CNS/XPLOR_distance_constraints_2
   _Gen_dist_constraint_list.Entry_ID            c30521_6mk4
   _Gen_dist_constraint_list.ID                  1
   _Gen_dist_constraint_list.Constraint_type     NOE
   _Gen_dist_constraint_list.Details             'Generated by Wattos'
   _Gen_dist_constraint_list.Constraint_file_ID  1
   _Gen_dist_constraint_list.Block_ID            2

   loop_
      _Gen_dist_constraint_software.Software_ID
      _Gen_dist_constraint_software.Software_label
      _Gen_dist_constraint_software.Method_ID
      _Gen_dist_constraint_software.Method_label
      _Gen_dist_constraint_software.Entry_ID
      _Gen_dist_constraint_software.Gen_dist_constraint_list_ID

     .   .   .   .   c30521_6mk4   1    

   stop_

   loop_
      _Gen_dist_constraint.ID
      _Gen_dist_constraint.Member_ID
      _Gen_dist_constraint.Member_logic_code
      _Gen_dist_constraint.Assembly_atom_ID_1
      _Gen_dist_constraint.Entity_assembly_ID_1
      _Gen_dist_constraint.Entity_ID_1
      _Gen_dist_constraint.Comp_index_ID_1
      _Gen_dist_constraint.Seq_ID_1
      _Gen_dist_constraint.Comp_ID_1
      _Gen_dist_constraint.Atom_ID_1
      _Gen_dist_constraint.Atom_type_1
      _Gen_dist_constraint.Atom_isotope_number_1
      _Gen_dist_constraint.Resonance_ID_1
      _Gen_dist_constraint.Assembly_atom_ID_2
      _Gen_dist_constraint.Entity_assembly_ID_2
      _Gen_dist_constraint.Entity_ID_2
      _Gen_dist_constraint.Comp_index_ID_2
      _Gen_dist_constraint.Seq_ID_2
      _Gen_dist_constraint.Comp_ID_2
      _Gen_dist_constraint.Atom_ID_2
      _Gen_dist_constraint.Atom_type_2
      _Gen_dist_constraint.Atom_isotope_number_2
      _Gen_dist_constraint.Resonance_ID_2
      _Gen_dist_constraint.Intensity_val
      _Gen_dist_constraint.Intensity_lower_val_err
      _Gen_dist_constraint.Intensity_upper_val_err
      _Gen_dist_constraint.Distance_val
      _Gen_dist_constraint.Distance_lower_bound_val
      _Gen_dist_constraint.Distance_upper_bound_val
      _Gen_dist_constraint.Contribution_fractional_val
      _Gen_dist_constraint.Spectral_peak_ID
      _Gen_dist_constraint.Spectral_peak_list_ID
      _Gen_dist_constraint.PDB_record_ID_1
      _Gen_dist_constraint.PDB_model_num_1
      _Gen_dist_constraint.PDB_strand_ID_1
      _Gen_dist_constraint.PDB_ins_code_1
      _Gen_dist_constraint.PDB_residue_no_1
      _Gen_dist_constraint.PDB_residue_name_1
      _Gen_dist_constraint.PDB_atom_name_1
      _Gen_dist_constraint.PDB_record_ID_2
      _Gen_dist_constraint.PDB_model_num_2
      _Gen_dist_constraint.PDB_strand_ID_2
      _Gen_dist_constraint.PDB_ins_code_2
      _Gen_dist_constraint.PDB_residue_no_2
      _Gen_dist_constraint.PDB_residue_name_2
      _Gen_dist_constraint.PDB_atom_name_2
      _Gen_dist_constraint.Auth_entity_assembly_ID_1
      _Gen_dist_constraint.Auth_asym_ID_1
      _Gen_dist_constraint.Auth_chain_ID_1
      _Gen_dist_constraint.Auth_seq_ID_1
      _Gen_dist_constraint.Auth_comp_ID_1
      _Gen_dist_constraint.Auth_atom_ID_1
      _Gen_dist_constraint.Auth_alt_ID_1
      _Gen_dist_constraint.Auth_atom_name_1
      _Gen_dist_constraint.Auth_entity_assembly_ID_2
      _Gen_dist_constraint.Auth_asym_ID_2
      _Gen_dist_constraint.Auth_chain_ID_2
      _Gen_dist_constraint.Auth_seq_ID_2
      _Gen_dist_constraint.Auth_comp_ID_2
      _Gen_dist_constraint.Auth_atom_ID_2
      _Gen_dist_constraint.Auth_alt_ID_2
      _Gen_dist_constraint.Auth_atom_name_2
      _Gen_dist_constraint.Entry_ID
      _Gen_dist_constraint.Gen_dist_constraint_list_ID

     1     1   .    .   1   1   4    4    LYS   H      H   .   .   .   1   1   7    7    TRP   HZ3    H   .   .   .   .   .   4.71   0.0   4.71   .   .   .   .   .   A   .   4    LYS   H      .   .   A   .   7    TRP   HZ3    .   .   .   4    .   HN     .   .   .   .   .   7    .   HZ3    .   .   c30521_6mk4   1    
     2     1   .    .   1   1   3    3    GLN   HA     H   .   .   .   1   1   7    7    TRP   HE3    H   .   .   .   .   .   3.32   0.0   3.32   .   .   .   .   .   A   .   3    GLN   HA     .   .   A   .   7    TRP   HE3    .   .   .   3    .   HA     .   .   .   .   .   7    .   HE3    .   .   c30521_6mk4   1    
     3     1   .    .   1   1   7    7    TRP   HZ3    H   .   .   .   1   1   3    3    GLN   HA     H   .   .   .   .   .   4.20   0.0   4.20   .   .   .   .   .   A   .   7    TRP   HZ3    .   .   A   .   3    GLN   HA     .   .   .   7    .   HZ3    .   .   .   .   .   3    .   HA     .   .   c30521_6mk4   1    
     4     1   .    .   1   1   2    2    CYS   HA     H   .   .   .   1   1   3    3    GLN   H      H   .   .   .   .   .   3.12   0.0   3.12   .   .   .   .   .   A   .   2    CYS   HA     .   .   A   .   3    GLN   H      .   .   .   2    .   HA     .   .   .   .   .   3    .   HN     .   .   c30521_6mk4   1    
     5     1   .    .   1   1   4    4    LYS   H      H   .   .   .   1   1   7    7    TRP   HE3    H   .   .   .   .   .   3.77   0.0   3.77   .   .   .   .   .   A   .   4    LYS   H      .   .   A   .   7    TRP   HE3    .   .   .   4    .   HN     .   .   .   .   .   7    .   HE3    .   .   c30521_6mk4   1    
     6     1   .    .   1   1   4    4    LYS   H      H   .   .   .   1   1   5    5    TRP   H      H   .   .   .   .   .   5.17   0.0   5.17   .   .   .   .   .   A   .   4    LYS   H      .   .   A   .   5    TRP   H      .   .   .   4    .   HN     .   .   .   .   .   5    .   HN     .   .   c30521_6mk4   1    
     7     1   .    .   1   1   5    5    TRP   HA     H   .   .   .   1   1   6    6    MET   H      H   .   .   .   .   .   3.57   0.0   3.57   .   .   .   .   .   A   .   5    TRP   HA     .   .   A   .   6    MET   H      .   .   .   5    .   HA     .   .   .   .   .   6    .   HN     .   .   c30521_6mk4   1    
     8     1   .    .   1   1   7    7    TRP   HA     H   .   .   .   1   1   8    8    THR   H      H   .   .   .   .   .   3.05   0.0   3.05   .   .   .   .   .   A   .   7    TRP   HA     .   .   A   .   8    THR   H      .   .   .   7    .   HA     .   .   .   .   .   8    .   HN     .   .   c30521_6mk4   1    
     9     1   .    .   1   1   8    8    THR   HA     H   .   .   .   1   1   9    9    CYS   H      H   .   .   .   .   .   3.02   0.0   3.02   .   .   .   .   .   A   .   8    THR   HA     .   .   A   .   9    CYS   H      .   .   .   8    .   HA     .   .   .   .   .   9    .   HN     .   .   c30521_6mk4   1    
     10    1   .    .   1   1   9    9    CYS   HA     H   .   .   .   1   1   10   10   ASP   H      H   .   .   .   .   .   3.11   0.0   3.11   .   .   .   .   .   A   .   9    CYS   HA     .   .   A   .   10   ASP   H      .   .   .   9    .   HA     .   .   .   .   .   10   .   HN     .   .   c30521_6mk4   1    
     11    1   .    .   1   1   10   10   ASP   HA     H   .   .   .   1   1   11   11   SER   H      H   .   .   .   .   .   3.51   0.0   3.51   .   .   .   .   .   A   .   10   ASP   HA     .   .   A   .   11   SER   H      .   .   .   10   .   HA     .   .   .   .   .   11   .   HN     .   .   c30521_6mk4   1    
     12    1   .    .   1   1   13   13   ARG   HA     H   .   .   .   1   1   14   14   LYS   H      H   .   .   .   .   .   2.94   0.0   2.94   .   .   .   .   .   A   .   13   ARG   HA     .   .   A   .   14   LYS   H      .   .   .   13   .   HA     .   .   .   .   .   14   .   HN     .   .   c30521_6mk4   1    
     13    1   .    .   1   1   14   14   LYS   HA     H   .   .   .   1   1   15   15   CYS   H      H   .   .   .   .   .   2.98   0.0   2.98   .   .   .   .   .   A   .   14   LYS   HA     .   .   A   .   15   CYS   H      .   .   .   14   .   HA     .   .   .   .   .   15   .   HN     .   .   c30521_6mk4   1    
     14    1   .    .   1   1   15   15   CYS   HA     H   .   .   .   1   1   16   16   CYS   H      H   .   .   .   .   .   2.99   0.0   2.99   .   .   .   .   .   A   .   15   CYS   HA     .   .   A   .   16   CYS   H      .   .   .   15   .   HA     .   .   .   .   .   16   .   HN     .   .   c30521_6mk4   1    
     15    1   .    .   1   1   17   17   LYS   HA     H   .   .   .   1   1   18   18   GLY   H      H   .   .   .   .   .   2.85   0.0   2.85   .   .   .   .   .   A   .   17   LYS   HA     .   .   A   .   18   GLY   H      .   .   .   17   .   HA     .   .   .   .   .   18   .   HN     .   .   c30521_6mk4   1    
     16    1   .    .   1   1   19   19   MET   HA     H   .   .   .   1   1   20   20   VAL   H      H   .   .   .   .   .   3.08   0.0   3.08   .   .   .   .   .   A   .   19   MET   HA     .   .   A   .   20   VAL   H      .   .   .   19   .   HA     .   .   .   .   .   20   .   HN     .   .   c30521_6mk4   1    
     17    1   .    .   1   1   23   23   LEU   H      H   .   .   .   1   1   23   23   LEU   HA     H   .   .   .   .   .   2.88   0.0   2.88   .   .   .   .   .   A   .   23   LEU   H      .   .   A   .   23   LEU   HA     .   .   .   23   .   HN     .   .   .   .   .   23   .   HA     .   .   c30521_6mk4   1    
     18    1   .    .   1   1   16   16   CYS   HA     H   .   .   .   1   1   17   17   LYS   H      H   .   .   .   .   .   2.78   0.0   2.78   .   .   .   .   .   A   .   16   CYS   HA     .   .   A   .   17   LYS   H      .   .   .   16   .   HA     .   .   .   .   .   17   .   HN     .   .   c30521_6mk4   1    
     19    1   .    .   1   1   23   23   LEU   H      H   .   .   .   1   1   22   22   ARG   HA     H   .   .   .   .   .   2.86   0.0   2.86   .   .   .   .   .   A   .   23   LEU   H      .   .   A   .   22   ARG   HA     .   .   .   23   .   HN     .   .   .   .   .   22   .   HA     .   .   c30521_6mk4   1    
     20    1   .    .   1   1   20   20   VAL   HA     H   .   .   .   1   1   21   21   CYS   H      H   .   .   .   .   .   2.90   0.0   2.90   .   .   .   .   .   A   .   20   VAL   HA     .   .   A   .   21   CYS   H      .   .   .   20   .   HA     .   .   .   .   .   21   .   HN     .   .   c30521_6mk4   1    
     21    1   .    .   1   1   24   24   TRP   HA     H   .   .   .   1   1   25   25   CYS   H      H   .   .   .   .   .   3.19   0.0   3.19   .   .   .   .   .   A   .   24   TRP   HA     .   .   A   .   25   CYS   H      .   .   .   24   .   HA     .   .   .   .   .   25   .   HN     .   .   c30521_6mk4   1    
     22    1   .    .   1   1   25   25   CYS   HA     H   .   .   .   1   1   26   26   LYS   H      H   .   .   .   .   .   2.94   0.0   2.94   .   .   .   .   .   A   .   25   CYS   HA     .   .   A   .   26   LYS   H      .   .   .   25   .   HA     .   .   .   .   .   26   .   HN     .   .   c30521_6mk4   1    
     23    1   .    .   1   1   26   26   LYS   HA     H   .   .   .   1   1   27   27   LYS   H      H   .   .   .   .   .   3.07   0.0   3.07   .   .   .   .   .   A   .   26   LYS   HA     .   .   A   .   27   LYS   H      .   .   .   26   .   HA     .   .   .   .   .   27   .   HN     .   .   c30521_6mk4   1    
     24    1   .    .   1   1   27   27   LYS   HA     H   .   .   .   1   1   28   28   LYS   H      H   .   .   .   .   .   3.02   0.0   3.02   .   .   .   .   .   A   .   27   LYS   HA     .   .   A   .   28   LYS   H      .   .   .   27   .   HA     .   .   .   .   .   28   .   HN     .   .   c30521_6mk4   1    
     25    1   .    .   1   1   28   28   LYS   HA     H   .   .   .   1   1   29   29   LEU   H      H   .   .   .   .   .   3.01   0.0   3.01   .   .   .   .   .   A   .   28   LYS   HA     .   .   A   .   29   LEU   H      .   .   .   28   .   HA     .   .   .   .   .   29   .   HN     .   .   c30521_6mk4   1    
     26    1   .    .   1   1   2    2    CYS   H      H   .   .   .   1   1   1    1    TYR   HB2    H   .   .   .   .   .   3.84   0.0   3.84   .   .   .   .   .   A   .   2    CYS   H      .   .   A   .   1    TYR   HB2    .   .   .   2    .   HN     .   .   .   .   .   1    .   HB2    .   .   c30521_6mk4   1    
     27    1   .    .   1   1   3    3    GLN   H      H   .   .   .   1   1   2    2    CYS   HB3    H   .   .   .   .   .   4.14   0.0   4.14   .   .   .   .   .   A   .   3    GLN   H      .   .   A   .   2    CYS   HB3    .   .   .   3    .   HN     .   .   .   .   .   2    .   HB1    .   .   c30521_6mk4   1    
     28    1   .    .   1   1   3    3    GLN   H      H   .   .   .   1   1   2    2    CYS   HB2    H   .   .   .   .   .   4.14   0.0   4.14   .   .   .   .   .   A   .   3    GLN   H      .   .   A   .   2    CYS   HB2    .   .   .   3    .   HN     .   .   .   .   .   2    .   HB2    .   .   c30521_6mk4   1    
     29    1   .    .   1   1   3    3    GLN   H      H   .   .   .   1   1   3    3    GLN   HG3    H   .   .   .   .   .   4.59   0.0   4.59   .   .   .   .   .   A   .   3    GLN   H      .   .   A   .   3    GLN   HG3    .   .   .   3    .   HN     .   .   .   .   .   3    .   HG1    .   .   c30521_6mk4   1    
     30    1   .    .   1   1   15   15   CYS   H      H   .   .   .   1   1   3    3    GLN   HG3    H   .   .   .   .   .   4.92   0.0   4.92   .   .   .   .   .   A   .   15   CYS   H      .   .   A   .   3    GLN   HG3    .   .   .   15   .   HN     .   .   .   .   .   3    .   HG1    .   .   c30521_6mk4   1    
     31    1   .    .   1   1   3    3    GLN   H      H   .   .   .   1   1   3    3    GLN   HB2    H   .   .   .   .   .   4.06   0.0   4.06   .   .   .   .   .   A   .   3    GLN   H      .   .   A   .   3    GLN   HB2    .   .   .   3    .   HN     .   .   .   .   .   3    .   HB2    .   .   c30521_6mk4   1    
     32    1   .    .   1   1   3    3    GLN   H      H   .   .   .   1   1   3    3    GLN   HB3    H   .   .   .   .   .   4.06   0.0   4.06   .   .   .   .   .   A   .   3    GLN   H      .   .   A   .   3    GLN   HB3    .   .   .   3    .   HN     .   .   .   .   .   3    .   HB1    .   .   c30521_6mk4   1    
     33    1   .    .   1   1   3    3    GLN   H      H   .   .   .   1   1   3    3    GLN   HG2    H   .   .   .   .   .   3.42   0.0   3.42   .   .   .   .   .   A   .   3    GLN   H      .   .   A   .   3    GLN   HG2    .   .   .   3    .   HN     .   .   .   .   .   3    .   HG2    .   .   c30521_6mk4   1    
     34    1   .    .   1   1   3    3    GLN   HA     H   .   .   .   1   1   3    3    GLN   HG2    H   .   .   .   .   .   4.03   0.0   4.03   .   .   .   .   .   A   .   3    GLN   HA     .   .   A   .   3    GLN   HG2    .   .   .   3    .   HA     .   .   .   .   .   3    .   HG2    .   .   c30521_6mk4   1    
     35    1   .    .   1   1   7    7    TRP   HE3    H   .   .   .   1   1   3    3    GLN   HG3    H   .   .   .   .   .   5.43   0.0   5.43   .   .   .   .   .   A   .   7    TRP   HE3    .   .   A   .   3    GLN   HG3    .   .   .   7    .   HE3    .   .   .   .   .   3    .   HG1    .   .   c30521_6mk4   1    
     36    1   .    .   1   1   7    7    TRP   HE3    H   .   .   .   1   1   3    3    GLN   HG2    H   .   .   .   .   .   5.23   0.0   5.23   .   .   .   .   .   A   .   7    TRP   HE3    .   .   A   .   3    GLN   HG2    .   .   .   7    .   HE3    .   .   .   .   .   3    .   HG2    .   .   c30521_6mk4   1    
     37    1   .    .   1   1   3    3    GLN   HE22   H   .   .   .   1   1   3    3    GLN   HB3    H   .   .   .   .   .   5.21   0.0   5.21   .   .   .   .   .   A   .   3    GLN   HE22   .   .   A   .   3    GLN   HB3    .   .   .   3    .   HE22   .   .   .   .   .   3    .   HB1    .   .   c30521_6mk4   1    
     38    1   .    .   1   1   3    3    GLN   HE22   H   .   .   .   1   1   3    3    GLN   HB2    H   .   .   .   .   .   5.21   0.0   5.21   .   .   .   .   .   A   .   3    GLN   HE22   .   .   A   .   3    GLN   HB2    .   .   .   3    .   HE22   .   .   .   .   .   3    .   HB2    .   .   c30521_6mk4   1    
     39    1   .    .   1   1   3    3    GLN   HG3    H   .   .   .   1   1   3    3    GLN   HE22   H   .   .   .   .   .   4.09   0.0   4.09   .   .   .   .   .   A   .   3    GLN   HG3    .   .   A   .   3    GLN   HE22   .   .   .   3    .   HG1    .   .   .   .   .   3    .   HE22   .   .   c30521_6mk4   1    
     40    1   .    .   1   1   3    3    GLN   HA     H   .   .   .   1   1   3    3    GLN   HE22   H   .   .   .   .   .   5.04   0.0   5.04   .   .   .   .   .   A   .   3    GLN   HA     .   .   A   .   3    GLN   HE22   .   .   .   3    .   HA     .   .   .   .   .   3    .   HE22   .   .   c30521_6mk4   1    
     41    1   OR   .   1   1   5    5    TRP   H      H   .   .   .   1   1   5    5    TRP   HB2    H   .   .   .   .   .   2.85   0.0   2.85   .   .   .   .   .   A   .   5    TRP   H      .   .   A   .   5    TRP   HB2    .   .   .   5    .   HN     .   .   .   .   .   5    .   HB#    .   .   c30521_6mk4   1    
     41    2   OR   .   1   1   5    5    TRP   H      H   .   .   .   1   1   5    5    TRP   HB3    H   .   .   .   .   .   2.85   0.0   2.85   .   .   .   .   .   A   .   5    TRP   H      .   .   A   .   5    TRP   HB3    .   .   .   5    .   HN     .   .   .   .   .   5    .   HB#    .   .   c30521_6mk4   1    
     42    1   OR   .   1   1   5    5    TRP   HD1    H   .   .   .   1   1   5    5    TRP   HB2    H   .   .   .   .   .   3.65   0.0   3.65   .   .   .   .   .   A   .   5    TRP   HD1    .   .   A   .   5    TRP   HB2    .   .   .   5    .   HD1    .   .   .   .   .   5    .   HB#    .   .   c30521_6mk4   1    
     42    2   OR   .   1   1   5    5    TRP   HB3    H   .   .   .   1   1   5    5    TRP   HD1    H   .   .   .   .   .   3.65   0.0   3.65   .   .   .   .   .   A   .   5    TRP   HB3    .   .   A   .   5    TRP   HD1    .   .   .   5    .   HB#    .   .   .   .   .   5    .   HD1    .   .   c30521_6mk4   1    
     43    1   OR   .   1   1   5    5    TRP   HE3    H   .   .   .   1   1   5    5    TRP   HB2    H   .   .   .   .   .   3.28   0.0   3.28   .   .   .   .   .   A   .   5    TRP   HE3    .   .   A   .   5    TRP   HB2    .   .   .   5    .   HE3    .   .   .   .   .   5    .   HB#    .   .   c30521_6mk4   1    
     43    2   OR   .   1   1   5    5    TRP   HB3    H   .   .   .   1   1   5    5    TRP   HE3    H   .   .   .   .   .   3.28   0.0   3.28   .   .   .   .   .   A   .   5    TRP   HB3    .   .   A   .   5    TRP   HE3    .   .   .   5    .   HB#    .   .   .   .   .   5    .   HE3    .   .   c30521_6mk4   1    
     44    1   .    .   1   1   2    2    CYS   H      H   .   .   .   1   1   1    1    TYR   HB3    H   .   .   .   .   .   3.84   0.0   3.84   .   .   .   .   .   A   .   2    CYS   H      .   .   A   .   1    TYR   HB3    .   .   .   2    .   HN     .   .   .   .   .   1    .   HB1    .   .   c30521_6mk4   1    
     45    1   .    .   1   1   6    6    MET   H      H   .   .   .   1   1   6    6    MET   HG3    H   .   .   .   .   .   4.61   0.0   4.61   .   .   .   .   .   A   .   6    MET   H      .   .   A   .   6    MET   HG3    .   .   .   6    .   HN     .   .   .   .   .   6    .   HG1    .   .   c30521_6mk4   1    
     46    1   .    .   1   1   6    6    MET   H      H   .   .   .   1   1   6    6    MET   HG2    H   .   .   .   .   .   4.61   0.0   4.61   .   .   .   .   .   A   .   6    MET   H      .   .   A   .   6    MET   HG2    .   .   .   6    .   HN     .   .   .   .   .   6    .   HG2    .   .   c30521_6mk4   1    
     47    1   .    .   1   1   6    6    MET   HA     H   .   .   .   1   1   6    6    MET   HG2    H   .   .   .   .   .   4.07   0.0   4.07   .   .   .   .   .   A   .   6    MET   HA     .   .   A   .   6    MET   HG2    .   .   .   6    .   HA     .   .   .   .   .   6    .   HG2    .   .   c30521_6mk4   1    
     48    1   .    .   1   1   6    6    MET   HA     H   .   .   .   1   1   6    6    MET   HG3    H   .   .   .   .   .   4.07   0.0   4.07   .   .   .   .   .   A   .   6    MET   HA     .   .   A   .   6    MET   HG3    .   .   .   6    .   HA     .   .   .   .   .   6    .   HG1    .   .   c30521_6mk4   1    
     49    1   .    .   1   1   7    7    TRP   H      H   .   .   .   1   1   7    7    TRP   HB2    H   .   .   .   .   .   3.32   0.0   3.32   .   .   .   .   .   A   .   7    TRP   H      .   .   A   .   7    TRP   HB2    .   .   .   7    .   HN     .   .   .   .   .   7    .   HB2    .   .   c30521_6mk4   1    
     50    1   .    .   1   1   7    7    TRP   H      H   .   .   .   1   1   7    7    TRP   HB3    H   .   .   .   .   .   3.86   0.0   3.86   .   .   .   .   .   A   .   7    TRP   H      .   .   A   .   7    TRP   HB3    .   .   .   7    .   HN     .   .   .   .   .   7    .   HB1    .   .   c30521_6mk4   1    
     51    1   .    .   1   1   3    3    GLN   HE22   H   .   .   .   1   1   7    7    TRP   HB3    H   .   .   .   .   .   4.15   0.0   4.15   .   .   .   .   .   A   .   3    GLN   HE22   .   .   A   .   7    TRP   HB3    .   .   .   3    .   HE22   .   .   .   .   .   7    .   HB1    .   .   c30521_6mk4   1    
     52    1   .    .   1   1   3    3    GLN   HE22   H   .   .   .   1   1   7    7    TRP   HB2    H   .   .   .   .   .   4.83   0.0   4.83   .   .   .   .   .   A   .   3    GLN   HE22   .   .   A   .   7    TRP   HB2    .   .   .   3    .   HE22   .   .   .   .   .   7    .   HB2    .   .   c30521_6mk4   1    
     53    1   .    .   1   1   7    7    TRP   HA     H   .   .   .   1   1   7    7    TRP   HD1    H   .   .   .   .   .   3.48   0.0   3.48   .   .   .   .   .   A   .   7    TRP   HA     .   .   A   .   7    TRP   HD1    .   .   .   7    .   HA     .   .   .   .   .   7    .   HD1    .   .   c30521_6mk4   1    
     54    1   .    .   1   1   7    7    TRP   H      H   .   .   .   1   1   7    7    TRP   HD1    H   .   .   .   .   .   3.84   0.0   3.84   .   .   .   .   .   A   .   7    TRP   H      .   .   A   .   7    TRP   HD1    .   .   .   7    .   HN     .   .   .   .   .   7    .   HD1    .   .   c30521_6mk4   1    
     55    1   .    .   1   1   9    9    CYS   H      H   .   .   .   1   1   8    8    THR   HB     H   .   .   .   .   .   3.58   0.0   3.58   .   .   .   .   .   A   .   9    CYS   H      .   .   A   .   8    THR   HB     .   .   .   9    .   HN     .   .   .   .   .   8    .   HB     .   .   c30521_6mk4   1    
     56    1   .    .   1   1   8    8    THR   H      H   .   .   .   1   1   8    8    THR   MG     H   .   .   .   .   .   3.37   0.0   3.37   .   .   .   .   .   A   .   8    THR   H      .   .   A   .   8    THR   MG     .   .   .   8    .   HN     .   .   .   .   .   8    .   HG2#   .   .   c30521_6mk4   1    
     57    1   .    .   1   1   8    8    THR   HA     H   .   .   .   1   1   8    8    THR   MG     H   .   .   .   .   .   3.52   0.0   3.52   .   .   .   .   .   A   .   8    THR   HA     .   .   A   .   8    THR   MG     .   .   .   8    .   HA     .   .   .   .   .   8    .   HG2#   .   .   c30521_6mk4   1    
     58    1   OR   .   1   1   10   10   ASP   H      H   .   .   .   1   1   10   10   ASP   HB2    H   .   .   .   .   .   4.00   0.0   4.00   .   .   .   .   .   A   .   10   ASP   H      .   .   A   .   10   ASP   HB2    .   .   .   10   .   HN     .   .   .   .   .   10   .   HB#    .   .   c30521_6mk4   1    
     58    2   OR   .   1   1   10   10   ASP   H      H   .   .   .   1   1   10   10   ASP   HB3    H   .   .   .   .   .   4.00   0.0   4.00   .   .   .   .   .   A   .   10   ASP   H      .   .   A   .   10   ASP   HB3    .   .   .   10   .   HN     .   .   .   .   .   10   .   HB#    .   .   c30521_6mk4   1    
     59    1   OR   .   1   1   10   10   ASP   HA     H   .   .   .   1   1   10   10   ASP   HB2    H   .   .   .   .   .   2.76   0.0   2.76   .   .   .   .   .   A   .   10   ASP   HA     .   .   A   .   10   ASP   HB2    .   .   .   10   .   HA     .   .   .   .   .   10   .   HB#    .   .   c30521_6mk4   1    
     59    2   OR   .   1   1   10   10   ASP   HA     H   .   .   .   1   1   10   10   ASP   HB3    H   .   .   .   .   .   2.76   0.0   2.76   .   .   .   .   .   A   .   10   ASP   HA     .   .   A   .   10   ASP   HB3    .   .   .   10   .   HA     .   .   .   .   .   10   .   HB#    .   .   c30521_6mk4   1    
     60    1   OR   .   1   1   11   11   SER   HA     H   .   .   .   1   1   11   11   SER   HB2    H   .   .   .   .   .   2.94   0.0   2.94   .   .   .   .   .   A   .   11   SER   HA     .   .   A   .   11   SER   HB2    .   .   .   11   .   HA     .   .   .   .   .   11   .   HB#    .   .   c30521_6mk4   1    
     60    2   OR   .   1   1   11   11   SER   HA     H   .   .   .   1   1   11   11   SER   HB3    H   .   .   .   .   .   2.94   0.0   2.94   .   .   .   .   .   A   .   11   SER   HA     .   .   A   .   11   SER   HB3    .   .   .   11   .   HA     .   .   .   .   .   11   .   HB#    .   .   c30521_6mk4   1    
     61    1   OR   .   1   1   11   11   SER   H      H   .   .   .   1   1   11   11   SER   HB2    H   .   .   .   .   .   3.31   0.0   3.31   .   .   .   .   .   A   .   11   SER   H      .   .   A   .   11   SER   HB2    .   .   .   11   .   HN     .   .   .   .   .   11   .   HB#    .   .   c30521_6mk4   1    
     61    2   OR   .   1   1   11   11   SER   H      H   .   .   .   1   1   11   11   SER   HB3    H   .   .   .   .   .   3.31   0.0   3.31   .   .   .   .   .   A   .   11   SER   H      .   .   A   .   11   SER   HB3    .   .   .   11   .   HN     .   .   .   .   .   11   .   HB#    .   .   c30521_6mk4   1    
     62    1   OR   .   1   1   12   12   GLU   H      H   .   .   .   1   1   11   11   SER   HB2    H   .   .   .   .   .   4.14   0.0   4.14   .   .   .   .   .   A   .   12   GLU   H      .   .   A   .   11   SER   HB2    .   .   .   12   .   HN     .   .   .   .   .   11   .   HB#    .   .   c30521_6mk4   1    
     62    2   OR   .   1   1   11   11   SER   HB3    H   .   .   .   1   1   12   12   GLU   H      H   .   .   .   .   .   4.14   0.0   4.14   .   .   .   .   .   A   .   11   SER   HB3    .   .   A   .   12   GLU   H      .   .   .   11   .   HB#    .   .   .   .   .   12   .   HN     .   .   c30521_6mk4   1    
     63    1   OR   .   1   1   12   12   GLU   HA     H   .   .   .   1   1   12   12   GLU   HG2    H   .   .   .   .   .   3.76   0.0   3.76   .   .   .   .   .   A   .   12   GLU   HA     .   .   A   .   12   GLU   HG2    .   .   .   12   .   HA     .   .   .   .   .   12   .   HG#    .   .   c30521_6mk4   1    
     63    2   OR   .   1   1   12   12   GLU   HA     H   .   .   .   1   1   12   12   GLU   HG3    H   .   .   .   .   .   3.76   0.0   3.76   .   .   .   .   .   A   .   12   GLU   HA     .   .   A   .   12   GLU   HG3    .   .   .   12   .   HA     .   .   .   .   .   12   .   HG#    .   .   c30521_6mk4   1    
     64    1   OR   .   1   1   12   12   GLU   H      H   .   .   .   1   1   12   12   GLU   HG2    H   .   .   .   .   .   3.92   0.0   3.92   .   .   .   .   .   A   .   12   GLU   H      .   .   A   .   12   GLU   HG2    .   .   .   12   .   HN     .   .   .   .   .   12   .   HG#    .   .   c30521_6mk4   1    
     64    2   OR   .   1   1   12   12   GLU   H      H   .   .   .   1   1   12   12   GLU   HG3    H   .   .   .   .   .   3.92   0.0   3.92   .   .   .   .   .   A   .   12   GLU   H      .   .   A   .   12   GLU   HG3    .   .   .   12   .   HN     .   .   .   .   .   12   .   HG#    .   .   c30521_6mk4   1    
     65    1   .    .   1   1   12   12   GLU   H      H   .   .   .   1   1   12   12   GLU   HB2    H   .   .   .   .   .   4.09   0.0   4.09   .   .   .   .   .   A   .   12   GLU   H      .   .   A   .   12   GLU   HB2    .   .   .   12   .   HN     .   .   .   .   .   12   .   HB2    .   .   c30521_6mk4   1    
     66    1   .    .   1   1   12   12   GLU   HB2    H   .   .   .   1   1   13   13   ARG   H      H   .   .   .   .   .   4.31   0.0   4.31   .   .   .   .   .   A   .   12   GLU   HB2    .   .   A   .   13   ARG   H      .   .   .   12   .   HB2    .   .   .   .   .   13   .   HN     .   .   c30521_6mk4   1    
     67    1   .    .   1   1   12   12   GLU   H      H   .   .   .   1   1   12   12   GLU   HB3    H   .   .   .   .   .   4.09   0.0   4.09   .   .   .   .   .   A   .   12   GLU   H      .   .   A   .   12   GLU   HB3    .   .   .   12   .   HN     .   .   .   .   .   12   .   HB1    .   .   c30521_6mk4   1    
     68    1   .    .   1   1   13   13   ARG   H      H   .   .   .   1   1   12   12   GLU   HB3    H   .   .   .   .   .   4.31   0.0   4.31   .   .   .   .   .   A   .   13   ARG   H      .   .   A   .   12   GLU   HB3    .   .   .   13   .   HN     .   .   .   .   .   12   .   HB1    .   .   c30521_6mk4   1    
     69    1   OR   .   1   1   13   13   ARG   HA     H   .   .   .   1   1   13   13   ARG   HG2    H   .   .   .   .   .   3.49   0.0   3.49   .   .   .   .   .   A   .   13   ARG   HA     .   .   A   .   13   ARG   HG2    .   .   .   13   .   HA     .   .   .   .   .   13   .   HG#    .   .   c30521_6mk4   1    
     69    2   OR   .   1   1   13   13   ARG   HA     H   .   .   .   1   1   13   13   ARG   HG3    H   .   .   .   .   .   3.49   0.0   3.49   .   .   .   .   .   A   .   13   ARG   HA     .   .   A   .   13   ARG   HG3    .   .   .   13   .   HA     .   .   .   .   .   13   .   HG#    .   .   c30521_6mk4   1    
     70    1   .    .   1   1   13   13   ARG   HB2    H   .   .   .   1   1   13   13   ARG   HE     H   .   .   .   .   .   3.89   0.0   3.89   .   .   .   .   .   A   .   13   ARG   HB2    .   .   A   .   13   ARG   HE     .   .   .   13   .   HB2    .   .   .   .   .   13   .   HE     .   .   c30521_6mk4   1    
     71    1   OR   .   1   1   13   13   ARG   HE     H   .   .   .   1   1   13   13   ARG   HG2    H   .   .   .   .   .   3.63   0.0   3.63   .   .   .   .   .   A   .   13   ARG   HE     .   .   A   .   13   ARG   HG2    .   .   .   13   .   HE     .   .   .   .   .   13   .   HG#    .   .   c30521_6mk4   1    
     71    2   OR   .   1   1   13   13   ARG   HG3    H   .   .   .   1   1   13   13   ARG   HE     H   .   .   .   .   .   3.63   0.0   3.63   .   .   .   .   .   A   .   13   ARG   HG3    .   .   A   .   13   ARG   HE     .   .   .   13   .   HG#    .   .   .   .   .   13   .   HE     .   .   c30521_6mk4   1    
     72    1   .    .   1   1   13   13   ARG   HE     H   .   .   .   1   1   13   13   ARG   HB3    H   .   .   .   .   .   4.14   0.0   4.14   .   .   .   .   .   A   .   13   ARG   HE     .   .   A   .   13   ARG   HB3    .   .   .   13   .   HE     .   .   .   .   .   13   .   HB1    .   .   c30521_6mk4   1    
     73    1   .    .   1   1   13   13   ARG   H      H   .   .   .   1   1   13   13   ARG   HB2    H   .   .   .   .   .   3.49   0.0   3.49   .   .   .   .   .   A   .   13   ARG   H      .   .   A   .   13   ARG   HB2    .   .   .   13   .   HN     .   .   .   .   .   13   .   HB2    .   .   c30521_6mk4   1    
     74    1   OR   .   1   1   13   13   ARG   H      H   .   .   .   1   1   13   13   ARG   HG2    H   .   .   .   .   .   3.52   0.0   3.52   .   .   .   .   .   A   .   13   ARG   H      .   .   A   .   13   ARG   HG2    .   .   .   13   .   HN     .   .   .   .   .   13   .   HG#    .   .   c30521_6mk4   1    
     74    2   OR   .   1   1   13   13   ARG   H      H   .   .   .   1   1   13   13   ARG   HG3    H   .   .   .   .   .   3.52   0.0   3.52   .   .   .   .   .   A   .   13   ARG   H      .   .   A   .   13   ARG   HG3    .   .   .   13   .   HN     .   .   .   .   .   13   .   HG#    .   .   c30521_6mk4   1    
     75    1   .    .   1   1   13   13   ARG   H      H   .   .   .   1   1   13   13   ARG   HB3    H   .   .   .   .   .   3.89   0.0   3.89   .   .   .   .   .   A   .   13   ARG   H      .   .   A   .   13   ARG   HB3    .   .   .   13   .   HN     .   .   .   .   .   13   .   HB1    .   .   c30521_6mk4   1    
     76    1   OR   .   1   1   13   13   ARG   H      H   .   .   .   1   1   12   12   GLU   HG2    H   .   .   .   .   .   4.43   0.0   4.43   .   .   .   .   .   A   .   13   ARG   H      .   .   A   .   12   GLU   HG2    .   .   .   13   .   HN     .   .   .   .   .   12   .   HG#    .   .   c30521_6mk4   1    
     76    2   OR   .   1   1   12   12   GLU   HG3    H   .   .   .   1   1   13   13   ARG   H      H   .   .   .   .   .   4.43   0.0   4.43   .   .   .   .   .   A   .   12   GLU   HG3    .   .   A   .   13   ARG   H      .   .   .   12   .   HG#    .   .   .   .   .   13   .   HN     .   .   c30521_6mk4   1    
     77    1   OR   .   1   1   14   14   LYS   HA     H   .   .   .   1   1   14   14   LYS   HG2    H   .   .   .   .   .   3.68   0.0   3.68   .   .   .   .   .   A   .   14   LYS   HA     .   .   A   .   14   LYS   HG2    .   .   .   14   .   HA     .   .   .   .   .   14   .   HG#    .   .   c30521_6mk4   1    
     77    2   OR   .   1   1   14   14   LYS   HA     H   .   .   .   1   1   14   14   LYS   HG3    H   .   .   .   .   .   3.68   0.0   3.68   .   .   .   .   .   A   .   14   LYS   HA     .   .   A   .   14   LYS   HG3    .   .   .   14   .   HA     .   .   .   .   .   14   .   HG#    .   .   c30521_6mk4   1    
     78    1   .    .   1   1   14   14   LYS   H      H   .   .   .   1   1   14   14   LYS   HB2    H   .   .   .   .   .   3.89   0.0   3.89   .   .   .   .   .   A   .   14   LYS   H      .   .   A   .   14   LYS   HB2    .   .   .   14   .   HN     .   .   .   .   .   14   .   HB2    .   .   c30521_6mk4   1    
     79    1   .    .   1   1   14   14   LYS   H      H   .   .   .   1   1   14   14   LYS   HB3    H   .   .   .   .   .   3.89   0.0   3.89   .   .   .   .   .   A   .   14   LYS   H      .   .   A   .   14   LYS   HB3    .   .   .   14   .   HN     .   .   .   .   .   14   .   HB1    .   .   c30521_6mk4   1    
     80    1   OR   .   1   1   14   14   LYS   H      H   .   .   .   1   1   14   14   LYS   HG2    H   .   .   .   .   .   3.37   0.0   3.37   .   .   .   .   .   A   .   14   LYS   H      .   .   A   .   14   LYS   HG2    .   .   .   14   .   HN     .   .   .   .   .   14   .   HG#    .   .   c30521_6mk4   1    
     80    2   OR   .   1   1   14   14   LYS   H      H   .   .   .   1   1   14   14   LYS   HG3    H   .   .   .   .   .   3.37   0.0   3.37   .   .   .   .   .   A   .   14   LYS   H      .   .   A   .   14   LYS   HG3    .   .   .   14   .   HN     .   .   .   .   .   14   .   HG#    .   .   c30521_6mk4   1    
     81    1   OR   .   1   1   14   14   LYS   HA     H   .   .   .   1   1   14   14   LYS   HE2    H   .   .   .   .   .   5.46   0.0   5.46   .   .   .   .   .   A   .   14   LYS   HA     .   .   A   .   14   LYS   HE2    .   .   .   14   .   HA     .   .   .   .   .   14   .   HE#    .   .   c30521_6mk4   1    
     81    2   OR   .   1   1   14   14   LYS   HA     H   .   .   .   1   1   14   14   LYS   HE3    H   .   .   .   .   .   5.46   0.0   5.46   .   .   .   .   .   A   .   14   LYS   HA     .   .   A   .   14   LYS   HE3    .   .   .   14   .   HA     .   .   .   .   .   14   .   HE#    .   .   c30521_6mk4   1    
     82    1   .    .   1   1   15   15   CYS   H      H   .   .   .   1   1   15   15   CYS   HB3    H   .   .   .   .   .   3.67   0.0   3.67   .   .   .   .   .   A   .   15   CYS   H      .   .   A   .   15   CYS   HB3    .   .   .   15   .   HN     .   .   .   .   .   15   .   HB1    .   .   c30521_6mk4   1    
     83    1   .    .   1   1   15   15   CYS   H      H   .   .   .   1   1   15   15   CYS   HB2    H   .   .   .   .   .   3.67   0.0   3.67   .   .   .   .   .   A   .   15   CYS   H      .   .   A   .   15   CYS   HB2    .   .   .   15   .   HN     .   .   .   .   .   15   .   HB2    .   .   c30521_6mk4   1    
     84    1   .    .   1   1   16   16   CYS   H      H   .   .   .   1   1   16   16   CYS   HB3    H   .   .   .   .   .   3.90   0.0   3.90   .   .   .   .   .   A   .   16   CYS   H      .   .   A   .   16   CYS   HB3    .   .   .   16   .   HN     .   .   .   .   .   16   .   HB1    .   .   c30521_6mk4   1    
     85    1   .    .   1   1   16   16   CYS   H      H   .   .   .   1   1   16   16   CYS   HB2    H   .   .   .   .   .   3.90   0.0   3.90   .   .   .   .   .   A   .   16   CYS   H      .   .   A   .   16   CYS   HB2    .   .   .   16   .   HN     .   .   .   .   .   16   .   HB2    .   .   c30521_6mk4   1    
     86    1   .    .   1   1   17   17   LYS   H      H   .   .   .   1   1   16   16   CYS   HB3    H   .   .   .   .   .   3.98   0.0   3.98   .   .   .   .   .   A   .   17   LYS   H      .   .   A   .   16   CYS   HB3    .   .   .   17   .   HN     .   .   .   .   .   16   .   HB1    .   .   c30521_6mk4   1    
     87    1   .    .   1   1   17   17   LYS   H      H   .   .   .   1   1   16   16   CYS   HB2    H   .   .   .   .   .   3.98   0.0   3.98   .   .   .   .   .   A   .   17   LYS   H      .   .   A   .   16   CYS   HB2    .   .   .   17   .   HN     .   .   .   .   .   16   .   HB2    .   .   c30521_6mk4   1    
     88    1   .    .   1   1   23   23   LEU   H      H   .   .   .   1   1   23   23   LEU   HB3    H   .   .   .   .   .   4.18   0.0   4.18   .   .   .   .   .   A   .   23   LEU   H      .   .   A   .   23   LEU   HB3    .   .   .   23   .   HN     .   .   .   .   .   23   .   HB1    .   .   c30521_6mk4   1    
     89    1   .    .   1   1   29   29   LEU   H      H   .   .   .   1   1   29   29   LEU   MD1    H   .   .   .   .   .   4.60   0.0   4.60   .   .   .   .   .   A   .   29   LEU   H      .   .   A   .   29   LEU   MD1    .   .   .   29   .   HN     .   .   .   .   .   29   .   HD1#   .   .   c30521_6mk4   1    
     90    1   .    .   1   1   23   23   LEU   H      H   .   .   .   1   1   23   23   LEU   MD2    H   .   .   .   .   .   4.53   0.0   4.53   .   .   .   .   .   A   .   23   LEU   H      .   .   A   .   23   LEU   MD2    .   .   .   23   .   HN     .   .   .   .   .   23   .   HD2#   .   .   c30521_6mk4   1    
     91    1   .    .   1   1   29   29   LEU   H      H   .   .   .   1   1   29   29   LEU   MD2    H   .   .   .   .   .   4.60   0.0   4.60   .   .   .   .   .   A   .   29   LEU   H      .   .   A   .   29   LEU   MD2    .   .   .   29   .   HN     .   .   .   .   .   29   .   HD2#   .   .   c30521_6mk4   1    
     92    1   .    .   1   1   23   23   LEU   H      H   .   .   .   1   1   23   23   LEU   HG     H   .   .   .   .   .   5.50   0.0   5.50   .   .   .   .   .   A   .   23   LEU   H      .   .   A   .   23   LEU   HG     .   .   .   23   .   HN     .   .   .   .   .   23   .   HG     .   .   c30521_6mk4   1    
     93    1   .    .   1   1   17   17   LYS   QZ     H   .   .   .   1   1   17   17   LYS   HB2    H   .   .   .   .   .   5.50   0.0   5.50   .   .   .   .   .   A   .   17   LYS   QZ     .   .   A   .   17   LYS   HB2    .   .   .   17   .   QZ     .   .   .   .   .   17   .   HB2    .   .   c30521_6mk4   1    
     94    1   .    .   1   1   17   17   LYS   QZ     H   .   .   .   1   1   17   17   LYS   HB3    H   .   .   .   .   .   5.50   0.0   5.50   .   .   .   .   .   A   .   17   LYS   QZ     .   .   A   .   17   LYS   HB3    .   .   .   17   .   QZ     .   .   .   .   .   17   .   HB1    .   .   c30521_6mk4   1    
     95    1   .    .   1   1   17   17   LYS   QZ     H   .   .   .   1   1   17   17   LYS   HG2    H   .   .   .   .   .   4.96   0.0   4.96   .   .   .   .   .   A   .   17   LYS   QZ     .   .   A   .   17   LYS   HG2    .   .   .   17   .   QZ     .   .   .   .   .   17   .   HG2    .   .   c30521_6mk4   1    
     96    1   .    .   1   1   17   17   LYS   QZ     H   .   .   .   1   1   17   17   LYS   HG3    H   .   .   .   .   .   4.96   0.0   4.96   .   .   .   .   .   A   .   17   LYS   QZ     .   .   A   .   17   LYS   HG3    .   .   .   17   .   QZ     .   .   .   .   .   17   .   HG1    .   .   c30521_6mk4   1    
     97    1   OR   .   1   1   17   17   LYS   HA     H   .   .   .   1   1   17   17   LYS   HE2    H   .   .   .   .   .   5.38   0.0   5.38   .   .   .   .   .   A   .   17   LYS   HA     .   .   A   .   17   LYS   HE2    .   .   .   17   .   HA     .   .   .   .   .   17   .   HE#    .   .   c30521_6mk4   1    
     97    2   OR   .   1   1   17   17   LYS   HA     H   .   .   .   1   1   17   17   LYS   HE3    H   .   .   .   .   .   5.38   0.0   5.38   .   .   .   .   .   A   .   17   LYS   HA     .   .   A   .   17   LYS   HE3    .   .   .   17   .   HA     .   .   .   .   .   17   .   HE#    .   .   c30521_6mk4   1    
     98    1   .    .   1   1   19   19   MET   HA     H   .   .   .   1   1   19   19   MET   HG3    H   .   .   .   .   .   3.94   0.0   3.94   .   .   .   .   .   A   .   19   MET   HA     .   .   A   .   19   MET   HG3    .   .   .   19   .   HA     .   .   .   .   .   19   .   HG1    .   .   c30521_6mk4   1    
     99    1   .    .   1   1   19   19   MET   HA     H   .   .   .   1   1   19   19   MET   HG2    H   .   .   .   .   .   3.83   0.0   3.83   .   .   .   .   .   A   .   19   MET   HA     .   .   A   .   19   MET   HG2    .   .   .   19   .   HA     .   .   .   .   .   19   .   HG2    .   .   c30521_6mk4   1    
     100   1   .    .   1   1   19   19   MET   HG3    H   .   .   .   1   1   19   19   MET   H      H   .   .   .   .   .   3.99   0.0   3.99   .   .   .   .   .   A   .   19   MET   HG3    .   .   A   .   19   MET   H      .   .   .   19   .   HG1    .   .   .   .   .   19   .   HN     .   .   c30521_6mk4   1    
     101   1   .    .   1   1   19   19   MET   H      H   .   .   .   1   1   19   19   MET   HB2    H   .   .   .   .   .   3.17   0.0   3.17   .   .   .   .   .   A   .   19   MET   H      .   .   A   .   19   MET   HB2    .   .   .   19   .   HN     .   .   .   .   .   19   .   HB2    .   .   c30521_6mk4   1    
     102   1   .    .   1   1   20   20   VAL   H      H   .   .   .   1   1   19   19   MET   HB3    H   .   .   .   .   .   3.33   0.0   3.33   .   .   .   .   .   A   .   20   VAL   H      .   .   A   .   19   MET   HB3    .   .   .   20   .   HN     .   .   .   .   .   19   .   HB1    .   .   c30521_6mk4   1    
     103   1   .    .   1   1   21   21   CYS   H      H   .   .   .   1   1   21   21   CYS   HB2    H   .   .   .   .   .   3.43   0.0   3.43   .   .   .   .   .   A   .   21   CYS   H      .   .   A   .   21   CYS   HB2    .   .   .   21   .   HN     .   .   .   .   .   21   .   HB2    .   .   c30521_6mk4   1    
     104   1   .    .   1   1   21   21   CYS   H      H   .   .   .   1   1   21   21   CYS   HB3    H   .   .   .   .   .   3.43   0.0   3.43   .   .   .   .   .   A   .   21   CYS   H      .   .   A   .   21   CYS   HB3    .   .   .   21   .   HN     .   .   .   .   .   21   .   HB1    .   .   c30521_6mk4   1    
     105   1   .    .   1   1   22   22   ARG   HE     H   .   .   .   1   1   22   22   ARG   HB2    H   .   .   .   .   .   4.71   0.0   4.71   .   .   .   .   .   A   .   22   ARG   HE     .   .   A   .   22   ARG   HB2    .   .   .   22   .   HE     .   .   .   .   .   22   .   HB2    .   .   c30521_6mk4   1    
     106   1   .    .   1   1   22   22   ARG   HE     H   .   .   .   1   1   22   22   ARG   HB3    H   .   .   .   .   .   4.71   0.0   4.71   .   .   .   .   .   A   .   22   ARG   HE     .   .   A   .   22   ARG   HB3    .   .   .   22   .   HE     .   .   .   .   .   22   .   HB1    .   .   c30521_6mk4   1    
     107   1   OR   .   1   1   22   22   ARG   H      H   .   .   .   1   1   22   22   ARG   HG2    H   .   .   .   .   .   4.44   0.0   4.44   .   .   .   .   .   A   .   22   ARG   H      .   .   A   .   22   ARG   HG2    .   .   .   22   .   HN     .   .   .   .   .   22   .   HG#    .   .   c30521_6mk4   1    
     107   2   OR   .   1   1   22   22   ARG   H      H   .   .   .   1   1   22   22   ARG   HG3    H   .   .   .   .   .   4.44   0.0   4.44   .   .   .   .   .   A   .   22   ARG   H      .   .   A   .   22   ARG   HG3    .   .   .   22   .   HN     .   .   .   .   .   22   .   HG#    .   .   c30521_6mk4   1    
     108   1   .    .   1   1   22   22   ARG   H      H   .   .   .   1   1   22   22   ARG   HB3    H   .   .   .   .   .   3.89   0.0   3.89   .   .   .   .   .   A   .   22   ARG   H      .   .   A   .   22   ARG   HB3    .   .   .   22   .   HN     .   .   .   .   .   22   .   HB1    .   .   c30521_6mk4   1    
     109   1   .    .   1   1   22   22   ARG   H      H   .   .   .   1   1   22   22   ARG   HB2    H   .   .   .   .   .   3.89   0.0   3.89   .   .   .   .   .   A   .   22   ARG   H      .   .   A   .   22   ARG   HB2    .   .   .   22   .   HN     .   .   .   .   .   22   .   HB2    .   .   c30521_6mk4   1    
     110   1   .    .   1   1   22   22   ARG   HA     H   .   .   .   1   1   22   22   ARG   HD2    H   .   .   .   .   .   4.57   0.0   4.57   .   .   .   .   .   A   .   22   ARG   HA     .   .   A   .   22   ARG   HD2    .   .   .   22   .   HA     .   .   .   .   .   22   .   HD2    .   .   c30521_6mk4   1    
     111   1   .    .   1   1   22   22   ARG   HA     H   .   .   .   1   1   22   22   ARG   HD3    H   .   .   .   .   .   4.57   0.0   4.57   .   .   .   .   .   A   .   22   ARG   HA     .   .   A   .   22   ARG   HD3    .   .   .   22   .   HA     .   .   .   .   .   22   .   HD1    .   .   c30521_6mk4   1    
     112   1   OR   .   1   1   22   22   ARG   HA     H   .   .   .   1   1   22   22   ARG   HG2    H   .   .   .   .   .   3.76   0.0   3.76   .   .   .   .   .   A   .   22   ARG   HA     .   .   A   .   22   ARG   HG2    .   .   .   22   .   HA     .   .   .   .   .   22   .   HG#    .   .   c30521_6mk4   1    
     112   2   OR   .   1   1   22   22   ARG   HA     H   .   .   .   1   1   22   22   ARG   HG3    H   .   .   .   .   .   3.76   0.0   3.76   .   .   .   .   .   A   .   22   ARG   HA     .   .   A   .   22   ARG   HG3    .   .   .   22   .   HA     .   .   .   .   .   22   .   HG#    .   .   c30521_6mk4   1    
     113   1   .    .   1   1   23   23   LEU   HA     H   .   .   .   1   1   23   23   LEU   HG     H   .   .   .   .   .   3.99   0.0   3.99   .   .   .   .   .   A   .   23   LEU   HA     .   .   A   .   23   LEU   HG     .   .   .   23   .   HA     .   .   .   .   .   23   .   HG     .   .   c30521_6mk4   1    
     114   1   .    .   1   1   23   23   LEU   HA     H   .   .   .   1   1   23   23   LEU   MD2    H   .   .   .   .   .   4.91   0.0   4.91   .   .   .   .   .   A   .   23   LEU   HA     .   .   A   .   23   LEU   MD2    .   .   .   23   .   HA     .   .   .   .   .   23   .   HD2#   .   .   c30521_6mk4   1    
     115   1   .    .   1   1   23   23   LEU   HA     H   .   .   .   1   1   23   23   LEU   MD1    H   .   .   .   .   .   4.91   0.0   4.91   .   .   .   .   .   A   .   23   LEU   HA     .   .   A   .   23   LEU   MD1    .   .   .   23   .   HA     .   .   .   .   .   23   .   HD1#   .   .   c30521_6mk4   1    
     116   1   .    .   1   1   24   24   TRP   H      H   .   .   .   1   1   24   24   TRP   HB2    H   .   .   .   .   .   4.06   0.0   4.06   .   .   .   .   .   A   .   24   TRP   H      .   .   A   .   24   TRP   HB2    .   .   .   24   .   HN     .   .   .   .   .   24   .   HB2    .   .   c30521_6mk4   1    
     117   1   .    .   1   1   24   24   TRP   H      H   .   .   .   1   1   24   24   TRP   HB3    H   .   .   .   .   .   4.20   0.0   4.20   .   .   .   .   .   A   .   24   TRP   H      .   .   A   .   24   TRP   HB3    .   .   .   24   .   HN     .   .   .   .   .   24   .   HB1    .   .   c30521_6mk4   1    
     118   1   .    .   1   1   24   24   TRP   HB3    H   .   .   .   1   1   24   24   TRP   HE3    H   .   .   .   .   .   3.71   0.0   3.71   .   .   .   .   .   A   .   24   TRP   HB3    .   .   A   .   24   TRP   HE3    .   .   .   24   .   HB1    .   .   .   .   .   24   .   HE3    .   .   c30521_6mk4   1    
     119   1   .    .   1   1   24   24   TRP   HB2    H   .   .   .   1   1   24   24   TRP   HD1    H   .   .   .   .   .   3.88   0.0   3.88   .   .   .   .   .   A   .   24   TRP   HB2    .   .   A   .   24   TRP   HD1    .   .   .   24   .   HB2    .   .   .   .   .   24   .   HD1    .   .   c30521_6mk4   1    
     120   1   .    .   1   1   24   24   TRP   HB3    H   .   .   .   1   1   24   24   TRP   HD1    H   .   .   .   .   .   3.88   0.0   3.88   .   .   .   .   .   A   .   24   TRP   HB3    .   .   A   .   24   TRP   HD1    .   .   .   24   .   HB1    .   .   .   .   .   24   .   HD1    .   .   c30521_6mk4   1    
     121   1   .    .   1   1   24   24   TRP   HA     H   .   .   .   1   1   24   24   TRP   HD1    H   .   .   .   .   .   4.46   0.0   4.46   .   .   .   .   .   A   .   24   TRP   HA     .   .   A   .   24   TRP   HD1    .   .   .   24   .   HA     .   .   .   .   .   24   .   HD1    .   .   c30521_6mk4   1    
     122   1   .    .   1   1   24   24   TRP   HA     H   .   .   .   1   1   24   24   TRP   HE3    H   .   .   .   .   .   5.13   0.0   5.13   .   .   .   .   .   A   .   24   TRP   HA     .   .   A   .   24   TRP   HE3    .   .   .   24   .   HA     .   .   .   .   .   24   .   HE3    .   .   c30521_6mk4   1    
     123   1   .    .   1   1   25   25   CYS   H      H   .   .   .   1   1   25   25   CYS   HB2    H   .   .   .   .   .   3.81   0.0   3.81   .   .   .   .   .   A   .   25   CYS   H      .   .   A   .   25   CYS   HB2    .   .   .   25   .   HN     .   .   .   .   .   25   .   HB2    .   .   c30521_6mk4   1    
     124   1   .    .   1   1   25   25   CYS   H      H   .   .   .   1   1   25   25   CYS   HB3    H   .   .   .   .   .   3.81   0.0   3.81   .   .   .   .   .   A   .   25   CYS   H      .   .   A   .   25   CYS   HB3    .   .   .   25   .   HN     .   .   .   .   .   25   .   HB1    .   .   c30521_6mk4   1    
     125   1   .    .   1   1   26   26   LYS   HG3    H   .   .   .   1   1   26   26   LYS   QZ     H   .   .   .   .   .   4.75   0.0   4.75   .   .   .   .   .   A   .   26   LYS   HG3    .   .   A   .   26   LYS   QZ     .   .   .   26   .   HG1    .   .   .   .   .   26   .   QZ     .   .   c30521_6mk4   1    
     126   1   .    .   1   1   26   26   LYS   QZ     H   .   .   .   1   1   26   26   LYS   HG2    H   .   .   .   .   .   5.14   0.0   5.14   .   .   .   .   .   A   .   26   LYS   QZ     .   .   A   .   26   LYS   HG2    .   .   .   26   .   QZ     .   .   .   .   .   26   .   HG2    .   .   c30521_6mk4   1    
     127   1   .    .   1   1   26   26   LYS   H      H   .   .   .   1   1   26   26   LYS   HG2    H   .   .   .   .   .   4.50   0.0   4.50   .   .   .   .   .   A   .   26   LYS   H      .   .   A   .   26   LYS   HG2    .   .   .   26   .   HN     .   .   .   .   .   26   .   HG2    .   .   c30521_6mk4   1    
     128   1   .    .   1   1   26   26   LYS   H      H   .   .   .   1   1   26   26   LYS   HG3    H   .   .   .   .   .   4.75   0.0   4.75   .   .   .   .   .   A   .   26   LYS   H      .   .   A   .   26   LYS   HG3    .   .   .   26   .   HN     .   .   .   .   .   26   .   HG1    .   .   c30521_6mk4   1    
     129   1   .    .   1   1   26   26   LYS   H      H   .   .   .   1   1   26   26   LYS   HB2    H   .   .   .   .   .   4.10   0.0   4.10   .   .   .   .   .   A   .   26   LYS   H      .   .   A   .   26   LYS   HB2    .   .   .   26   .   HN     .   .   .   .   .   26   .   HB2    .   .   c30521_6mk4   1    
     130   1   .    .   1   1   26   26   LYS   H      H   .   .   .   1   1   26   26   LYS   HB3    H   .   .   .   .   .   4.10   0.0   4.10   .   .   .   .   .   A   .   26   LYS   H      .   .   A   .   26   LYS   HB3    .   .   .   26   .   HN     .   .   .   .   .   26   .   HB1    .   .   c30521_6mk4   1    
     131   1   OR   .   1   1   26   26   LYS   HA     H   .   .   .   1   1   26   26   LYS   HE2    H   .   .   .   .   .   5.50   0.0   5.50   .   .   .   .   .   A   .   26   LYS   HA     .   .   A   .   26   LYS   HE2    .   .   .   26   .   HA     .   .   .   .   .   26   .   HE#    .   .   c30521_6mk4   1    
     131   2   OR   .   1   1   26   26   LYS   HA     H   .   .   .   1   1   26   26   LYS   HE3    H   .   .   .   .   .   5.50   0.0   5.50   .   .   .   .   .   A   .   26   LYS   HA     .   .   A   .   26   LYS   HE3    .   .   .   26   .   HA     .   .   .   .   .   26   .   HE#    .   .   c30521_6mk4   1    
     132   1   .    .   1   1   26   26   LYS   HA     H   .   .   .   1   1   26   26   LYS   HG3    H   .   .   .   .   .   4.11   0.0   4.11   .   .   .   .   .   A   .   26   LYS   HA     .   .   A   .   26   LYS   HG3    .   .   .   26   .   HA     .   .   .   .   .   26   .   HG1    .   .   c30521_6mk4   1    
     133   1   .    .   1   1   26   26   LYS   HA     H   .   .   .   1   1   26   26   LYS   HG2    H   .   .   .   .   .   4.15   0.0   4.15   .   .   .   .   .   A   .   26   LYS   HA     .   .   A   .   26   LYS   HG2    .   .   .   26   .   HA     .   .   .   .   .   26   .   HG2    .   .   c30521_6mk4   1    
     134   1   .    .   1   1   27   27   LYS   H      H   .   .   .   1   1   27   27   LYS   HB2    H   .   .   .   .   .   3.65   0.0   3.65   .   .   .   .   .   A   .   27   LYS   H      .   .   A   .   27   LYS   HB2    .   .   .   27   .   HN     .   .   .   .   .   27   .   HB2    .   .   c30521_6mk4   1    
     135   1   .    .   1   1   27   27   LYS   H      H   .   .   .   1   1   27   27   LYS   HB3    H   .   .   .   .   .   3.65   0.0   3.65   .   .   .   .   .   A   .   27   LYS   H      .   .   A   .   27   LYS   HB3    .   .   .   27   .   HN     .   .   .   .   .   27   .   HB1    .   .   c30521_6mk4   1    
     136   1   .    .   1   1   27   27   LYS   QZ     H   .   .   .   1   1   27   27   LYS   HG3    H   .   .   .   .   .   5.27   0.0   5.27   .   .   .   .   .   A   .   27   LYS   QZ     .   .   A   .   27   LYS   HG3    .   .   .   27   .   QZ     .   .   .   .   .   27   .   HG1    .   .   c30521_6mk4   1    
     137   1   .    .   1   1   27   27   LYS   QZ     H   .   .   .   1   1   27   27   LYS   HG2    H   .   .   .   .   .   5.27   0.0   5.27   .   .   .   .   .   A   .   27   LYS   QZ     .   .   A   .   27   LYS   HG2    .   .   .   27   .   QZ     .   .   .   .   .   27   .   HG2    .   .   c30521_6mk4   1    
     138   1   .    .   1   1   27   27   LYS   QZ     H   .   .   .   1   1   27   27   LYS   HB2    H   .   .   .   .   .   4.44   0.0   4.44   .   .   .   .   .   A   .   27   LYS   QZ     .   .   A   .   27   LYS   HB2    .   .   .   27   .   QZ     .   .   .   .   .   27   .   HB2    .   .   c30521_6mk4   1    
     139   1   .    .   1   1   27   27   LYS   QZ     H   .   .   .   1   1   27   27   LYS   HB3    H   .   .   .   .   .   4.44   0.0   4.44   .   .   .   .   .   A   .   27   LYS   QZ     .   .   A   .   27   LYS   HB3    .   .   .   27   .   QZ     .   .   .   .   .   27   .   HB1    .   .   c30521_6mk4   1    
     140   1   .    .   1   1   28   28   LYS   H      H   .   .   .   1   1   28   28   LYS   HB2    H   .   .   .   .   .   3.66   0.0   3.66   .   .   .   .   .   A   .   28   LYS   H      .   .   A   .   28   LYS   HB2    .   .   .   28   .   HN     .   .   .   .   .   28   .   HB2    .   .   c30521_6mk4   1    
     141   1   .    .   1   1   28   28   LYS   H      H   .   .   .   1   1   28   28   LYS   HB3    H   .   .   .   .   .   3.66   0.0   3.66   .   .   .   .   .   A   .   28   LYS   H      .   .   A   .   28   LYS   HB3    .   .   .   28   .   HN     .   .   .   .   .   28   .   HB1    .   .   c30521_6mk4   1    
     142   1   OR   .   1   1   28   28   LYS   H      H   .   .   .   1   1   28   28   LYS   HG2    H   .   .   .   .   .   4.21   0.0   4.21   .   .   .   .   .   A   .   28   LYS   H      .   .   A   .   28   LYS   HG2    .   .   .   28   .   HN     .   .   .   .   .   28   .   HG#    .   .   c30521_6mk4   1    
     142   2   OR   .   1   1   28   28   LYS   H      H   .   .   .   1   1   28   28   LYS   HG3    H   .   .   .   .   .   4.21   0.0   4.21   .   .   .   .   .   A   .   28   LYS   H      .   .   A   .   28   LYS   HG3    .   .   .   28   .   HN     .   .   .   .   .   28   .   HG#    .   .   c30521_6mk4   1    
     143   1   .    .   1   1   28   28   LYS   HB2    H   .   .   .   1   1   28   28   LYS   QZ     H   .   .   .   .   .   5.25   0.0   5.25   .   .   .   .   .   A   .   28   LYS   HB2    .   .   A   .   28   LYS   QZ     .   .   .   28   .   HB2    .   .   .   .   .   28   .   QZ     .   .   c30521_6mk4   1    
     144   1   .    .   1   1   28   28   LYS   HB3    H   .   .   .   1   1   28   28   LYS   QZ     H   .   .   .   .   .   5.25   0.0   5.25   .   .   .   .   .   A   .   28   LYS   HB3    .   .   A   .   28   LYS   QZ     .   .   .   28   .   HB1    .   .   .   .   .   28   .   QZ     .   .   c30521_6mk4   1    
     145   1   OR   .   1   1   28   28   LYS   QZ     H   .   .   .   1   1   28   28   LYS   HG2    H   .   .   .   .   .   5.50   0.0   5.50   .   .   .   .   .   A   .   28   LYS   QZ     .   .   A   .   28   LYS   HG2    .   .   .   28   .   QZ     .   .   .   .   .   28   .   HG#    .   .   c30521_6mk4   1    
     145   2   OR   .   1   1   28   28   LYS   HG3    H   .   .   .   1   1   28   28   LYS   QZ     H   .   .   .   .   .   5.50   0.0   5.50   .   .   .   .   .   A   .   28   LYS   HG3    .   .   A   .   28   LYS   QZ     .   .   .   28   .   HG#    .   .   .   .   .   28   .   QZ     .   .   c30521_6mk4   1    
     146   1   OR   .   1   1   28   28   LYS   HA     H   .   .   .   1   1   28   28   LYS   HE2    H   .   .   .   .   .   5.50   0.0   5.50   .   .   .   .   .   A   .   28   LYS   HA     .   .   A   .   28   LYS   HE2    .   .   .   28   .   HA     .   .   .   .   .   28   .   HE#    .   .   c30521_6mk4   1    
     146   2   OR   .   1   1   28   28   LYS   HA     H   .   .   .   1   1   28   28   LYS   HE3    H   .   .   .   .   .   5.50   0.0   5.50   .   .   .   .   .   A   .   28   LYS   HA     .   .   A   .   28   LYS   HE3    .   .   .   28   .   HA     .   .   .   .   .   28   .   HE#    .   .   c30521_6mk4   1    
     147   1   .    .   1   1   29   29   LEU   HA     H   .   .   .   1   1   29   29   LEU   MD1    H   .   .   .   .   .   4.98   0.0   4.98   .   .   .   .   .   A   .   29   LEU   HA     .   .   A   .   29   LEU   MD1    .   .   .   29   .   HA     .   .   .   .   .   29   .   HD1#   .   .   c30521_6mk4   1    
     148   1   .    .   1   1   29   29   LEU   HA     H   .   .   .   1   1   29   29   LEU   MD2    H   .   .   .   .   .   4.98   0.0   4.98   .   .   .   .   .   A   .   29   LEU   HA     .   .   A   .   29   LEU   MD2    .   .   .   29   .   HA     .   .   .   .   .   29   .   HD2#   .   .   c30521_6mk4   1    
     149   1   OR   .   1   1   23   23   LEU   H      H   .   .   .   1   1   22   22   ARG   HG2    H   .   .   .   .   .   3.34   0.0   3.34   .   .   .   .   .   A   .   23   LEU   H      .   .   A   .   22   ARG   HG2    .   .   .   23   .   HN     .   .   .   .   .   22   .   HG#    .   .   c30521_6mk4   1    
     149   2   OR   .   1   1   23   23   LEU   H      H   .   .   .   1   1   22   22   ARG   HG3    H   .   .   .   .   .   3.34   0.0   3.34   .   .   .   .   .   A   .   23   LEU   H      .   .   A   .   22   ARG   HG3    .   .   .   23   .   HN     .   .   .   .   .   22   .   HG#    .   .   c30521_6mk4   1    
     150   1   OR   .   1   1   29   29   LEU   H      H   .   .   .   1   1   29   29   LEU   HB2    H   .   .   .   .   .   3.60   0.0   3.60   .   .   .   .   .   A   .   29   LEU   H      .   .   A   .   29   LEU   HB2    .   .   .   29   .   HN     .   .   .   .   .   29   .   HB#    .   .   c30521_6mk4   1    
     150   2   OR   .   1   1   29   29   LEU   H      H   .   .   .   1   1   29   29   LEU   HB3    H   .   .   .   .   .   3.60   0.0   3.60   .   .   .   .   .   A   .   29   LEU   H      .   .   A   .   29   LEU   HB3    .   .   .   29   .   HN     .   .   .   .   .   29   .   HB#    .   .   c30521_6mk4   1    
     151   1   .    .   1   1   4    4    LYS   HA     H   .   .   .   1   1   4    4    LYS   HG2    H   .   .   .   .   .   4.06   0.0   4.06   .   .   .   .   .   A   .   4    LYS   HA     .   .   A   .   4    LYS   HG2    .   .   .   4    .   HA     .   .   .   .   .   4    .   HG2    .   .   c30521_6mk4   1    
     152   1   OR   .   1   1   4    4    LYS   HA     H   .   .   .   1   1   4    4    LYS   HE2    H   .   .   .   .   .   5.50   0.0   5.50   .   .   .   .   .   A   .   4    LYS   HA     .   .   A   .   4    LYS   HE2    .   .   .   4    .   HA     .   .   .   .   .   4    .   HE#    .   .   c30521_6mk4   1    
     152   2   OR   .   1   1   4    4    LYS   HA     H   .   .   .   1   1   4    4    LYS   HE3    H   .   .   .   .   .   5.50   0.0   5.50   .   .   .   .   .   A   .   4    LYS   HA     .   .   A   .   4    LYS   HE3    .   .   .   4    .   HA     .   .   .   .   .   4    .   HE#    .   .   c30521_6mk4   1    
     153   1   .    .   1   1   5    5    TRP   H      H   .   .   .   1   1   4    4    LYS   HA     H   .   .   .   .   .   3.29   0.0   3.29   .   .   .   .   .   A   .   5    TRP   H      .   .   A   .   4    LYS   HA     .   .   .   5    .   HN     .   .   .   .   .   4    .   HA     .   .   c30521_6mk4   1    
     154   1   .    .   1   1   19   19   MET   HA     H   .   .   .   1   1   28   28   LYS   H      H   .   .   .   .   .   3.96   0.0   3.96   .   .   .   .   .   A   .   19   MET   HA     .   .   A   .   28   LYS   H      .   .   .   19   .   HA     .   .   .   .   .   28   .   HN     .   .   c30521_6mk4   1    
     155   1   .    .   1   1   25   25   CYS   HA     H   .   .   .   1   1   22   22   ARG   H      H   .   .   .   .   .   4.34   0.0   4.34   .   .   .   .   .   A   .   25   CYS   HA     .   .   A   .   22   ARG   H      .   .   .   25   .   HA     .   .   .   .   .   22   .   HN     .   .   c30521_6mk4   1    
     156   1   .    .   1   1   8    8    THR   HA     H   .   .   .   1   1   25   25   CYS   H      H   .   .   .   .   .   4.21   0.0   4.21   .   .   .   .   .   A   .   8    THR   HA     .   .   A   .   25   CYS   H      .   .   .   8    .   HA     .   .   .   .   .   25   .   HN     .   .   c30521_6mk4   1    
     157   1   .    .   1   1   5    5    TRP   HA     H   .   .   .   1   1   7    7    TRP   H      H   .   .   .   .   .   4.37   0.0   4.37   .   .   .   .   .   A   .   5    TRP   HA     .   .   A   .   7    TRP   H      .   .   .   5    .   HA     .   .   .   .   .   7    .   HN     .   .   c30521_6mk4   1    
     158   1   .    .   1   1   5    5    TRP   HA     H   .   .   .   1   1   25   25   CYS   H      H   .   .   .   .   .   4.83   0.0   4.83   .   .   .   .   .   A   .   5    TRP   HA     .   .   A   .   25   CYS   H      .   .   .   5    .   HA     .   .   .   .   .   25   .   HN     .   .   c30521_6mk4   1    
     159   1   .    .   1   1   26   26   LYS   H      H   .   .   .   1   1   27   27   LYS   HA     H   .   .   .   .   .   5.16   0.0   5.16   .   .   .   .   .   A   .   26   LYS   H      .   .   A   .   27   LYS   HA     .   .   .   26   .   HN     .   .   .   .   .   27   .   HA     .   .   c30521_6mk4   1    
     160   1   .    .   1   1   20   20   VAL   HA     H   .   .   .   1   1   26   26   LYS   H      H   .   .   .   .   .   5.29   0.0   5.29   .   .   .   .   .   A   .   20   VAL   HA     .   .   A   .   26   LYS   H      .   .   .   20   .   HA     .   .   .   .   .   26   .   HN     .   .   c30521_6mk4   1    
     161   1   .    .   1   1   26   26   LYS   H      H   .   .   .   1   1   25   25   CYS   HB3    H   .   .   .   .   .   4.79   0.0   4.79   .   .   .   .   .   A   .   26   LYS   H      .   .   A   .   25   CYS   HB3    .   .   .   26   .   HN     .   .   .   .   .   25   .   HB1    .   .   c30521_6mk4   1    
     162   1   .    .   1   1   26   26   LYS   H      H   .   .   .   1   1   19   19   MET   HG2    H   .   .   .   .   .   4.65   0.0   4.65   .   .   .   .   .   A   .   26   LYS   H      .   .   A   .   19   MET   HG2    .   .   .   26   .   HN     .   .   .   .   .   19   .   HG2    .   .   c30521_6mk4   1    
     163   1   .    .   1   1   26   26   LYS   H      H   .   .   .   1   1   19   19   MET   HB3    H   .   .   .   .   .   4.21   0.0   4.21   .   .   .   .   .   A   .   26   LYS   H      .   .   A   .   19   MET   HB3    .   .   .   26   .   HN     .   .   .   .   .   19   .   HB1    .   .   c30521_6mk4   1    
     164   1   .    .   1   1   20   20   VAL   H      H   .   .   .   1   1   26   26   LYS   HG3    H   .   .   .   .   .   5.50   0.0   5.50   .   .   .   .   .   A   .   20   VAL   H      .   .   A   .   26   LYS   HG3    .   .   .   20   .   HN     .   .   .   .   .   26   .   HG1    .   .   c30521_6mk4   1    
     165   1   .    .   1   1   20   20   VAL   H      H   .   .   .   1   1   26   26   LYS   HG2    H   .   .   .   .   .   4.75   0.0   4.75   .   .   .   .   .   A   .   20   VAL   H      .   .   A   .   26   LYS   HG2    .   .   .   20   .   HN     .   .   .   .   .   26   .   HG2    .   .   c30521_6mk4   1    
     166   1   .    .   1   1   18   18   GLY   H      H   .   .   .   1   1   17   17   LYS   HB3    H   .   .   .   .   .   4.65   0.0   4.65   .   .   .   .   .   A   .   18   GLY   H      .   .   A   .   17   LYS   HB3    .   .   .   18   .   HN     .   .   .   .   .   17   .   HB1    .   .   c30521_6mk4   1    
     167   1   .    .   1   1   18   18   GLY   H      H   .   .   .   1   1   17   17   LYS   HB2    H   .   .   .   .   .   4.65   0.0   4.65   .   .   .   .   .   A   .   18   GLY   H      .   .   A   .   17   LYS   HB2    .   .   .   18   .   HN     .   .   .   .   .   17   .   HB2    .   .   c30521_6mk4   1    
     168   1   .    .   1   1   21   21   CYS   H      H   .   .   .   1   1   20   20   VAL   HB     H   .   .   .   .   .   4.35   0.0   4.35   .   .   .   .   .   A   .   21   CYS   H      .   .   A   .   20   VAL   HB     .   .   .   21   .   HN     .   .   .   .   .   20   .   HB     .   .   c30521_6mk4   1    
     169   1   .    .   1   1   25   25   CYS   H      H   .   .   .   1   1   24   24   TRP   HB2    H   .   .   .   .   .   3.52   0.0   3.52   .   .   .   .   .   A   .   25   CYS   H      .   .   A   .   24   TRP   HB2    .   .   .   25   .   HN     .   .   .   .   .   24   .   HB2    .   .   c30521_6mk4   1    
     170   1   .    .   1   1   25   25   CYS   H      H   .   .   .   1   1   24   24   TRP   HB3    H   .   .   .   .   .   4.51   0.0   4.51   .   .   .   .   .   A   .   25   CYS   H      .   .   A   .   24   TRP   HB3    .   .   .   25   .   HN     .   .   .   .   .   24   .   HB1    .   .   c30521_6mk4   1    
     171   1   .    .   1   1   10   10   ASP   H      H   .   .   .   1   1   9    9    CYS   HB3    H   .   .   .   .   .   4.43   0.0   4.43   .   .   .   .   .   A   .   10   ASP   H      .   .   A   .   9    CYS   HB3    .   .   .   10   .   HN     .   .   .   .   .   9    .   HB1    .   .   c30521_6mk4   1    
     172   1   .    .   1   1   10   10   ASP   H      H   .   .   .   1   1   9    9    CYS   HB2    H   .   .   .   .   .   3.84   0.0   3.84   .   .   .   .   .   A   .   10   ASP   H      .   .   A   .   9    CYS   HB2    .   .   .   10   .   HN     .   .   .   .   .   9    .   HB2    .   .   c30521_6mk4   1    
     173   1   .    .   1   1   8    8    THR   H      H   .   .   .   1   1   7    7    TRP   HB3    H   .   .   .   .   .   3.52   0.0   3.52   .   .   .   .   .   A   .   8    THR   H      .   .   A   .   7    TRP   HB3    .   .   .   8    .   HN     .   .   .   .   .   7    .   HB1    .   .   c30521_6mk4   1    
     174   1   .    .   1   1   8    8    THR   H      H   .   .   .   1   1   7    7    TRP   HB2    H   .   .   .   .   .   4.21   0.0   4.21   .   .   .   .   .   A   .   8    THR   H      .   .   A   .   7    TRP   HB2    .   .   .   8    .   HN     .   .   .   .   .   7    .   HB2    .   .   c30521_6mk4   1    
     175   1   .    .   1   1   15   15   CYS   H      H   .   .   .   1   1   9    9    CYS   HB3    H   .   .   .   .   .   4.27   0.0   4.27   .   .   .   .   .   A   .   15   CYS   H      .   .   A   .   9    CYS   HB3    .   .   .   15   .   HN     .   .   .   .   .   9    .   HB1    .   .   c30521_6mk4   1    
     176   1   .    .   1   1   15   15   CYS   H      H   .   .   .   1   1   9    9    CYS   HB2    H   .   .   .   .   .   4.71   0.0   4.71   .   .   .   .   .   A   .   15   CYS   H      .   .   A   .   9    CYS   HB2    .   .   .   15   .   HN     .   .   .   .   .   9    .   HB2    .   .   c30521_6mk4   1    
     177   1   OR   .   1   1   6    6    MET   H      H   .   .   .   1   1   5    5    TRP   HB2    H   .   .   .   .   .   4.06   0.0   4.06   .   .   .   .   .   A   .   6    MET   H      .   .   A   .   5    TRP   HB2    .   .   .   6    .   HN     .   .   .   .   .   5    .   HB#    .   .   c30521_6mk4   1    
     177   2   OR   .   1   1   6    6    MET   H      H   .   .   .   1   1   5    5    TRP   HB3    H   .   .   .   .   .   4.06   0.0   4.06   .   .   .   .   .   A   .   6    MET   H      .   .   A   .   5    TRP   HB3    .   .   .   6    .   HN     .   .   .   .   .   5    .   HB#    .   .   c30521_6mk4   1    
     178   1   .    .   1   1   20   20   VAL   H      H   .   .   .   1   1   19   19   MET   HB2    H   .   .   .   .   .   4.19   0.0   4.19   .   .   .   .   .   A   .   20   VAL   H      .   .   A   .   19   MET   HB2    .   .   .   20   .   HN     .   .   .   .   .   19   .   HB2    .   .   c30521_6mk4   1    
     179   1   .    .   1   1   20   20   VAL   H      H   .   .   .   1   1   19   19   MET   HG2    H   .   .   .   .   .   4.49   0.0   4.49   .   .   .   .   .   A   .   20   VAL   H      .   .   A   .   19   MET   HG2    .   .   .   20   .   HN     .   .   .   .   .   19   .   HG2    .   .   c30521_6mk4   1    
     180   1   .    .   1   1   26   26   LYS   HG3    H   .   .   .   1   1   24   24   TRP   HE1    H   .   .   .   .   .   4.78   0.0   4.78   .   .   .   .   .   A   .   26   LYS   HG3    .   .   A   .   24   TRP   HE1    .   .   .   26   .   HG1    .   .   .   .   .   24   .   HE1    .   .   c30521_6mk4   1    
     181   1   OR   .   1   1   24   24   TRP   HE1    H   .   .   .   1   1   26   26   LYS   HE2    H   .   .   .   .   .   5.16   0.0   5.16   .   .   .   .   .   A   .   24   TRP   HE1    .   .   A   .   26   LYS   HE2    .   .   .   24   .   HE1    .   .   .   .   .   26   .   HE#    .   .   c30521_6mk4   1    
     181   2   OR   .   1   1   26   26   LYS   HE3    H   .   .   .   1   1   24   24   TRP   HE1    H   .   .   .   .   .   5.16   0.0   5.16   .   .   .   .   .   A   .   26   LYS   HE3    .   .   A   .   24   TRP   HE1    .   .   .   26   .   HE#    .   .   .   .   .   24   .   HE1    .   .   c30521_6mk4   1    
     182   1   .    .   1   1   7    7    TRP   HA     H   .   .   .   1   1   7    7    TRP   HE1    H   .   .   .   .   .   5.35   0.0   5.35   .   .   .   .   .   A   .   7    TRP   HA     .   .   A   .   7    TRP   HE1    .   .   .   7    .   HA     .   .   .   .   .   7    .   HE1    .   .   c30521_6mk4   1    
     183   1   .    .   1   1   20   20   VAL   H      H   .   .   .   1   1   26   26   LYS   H      H   .   .   .   .   .   3.84   0.0   3.84   .   .   .   .   .   A   .   20   VAL   H      .   .   A   .   26   LYS   H      .   .   .   20   .   HN     .   .   .   .   .   26   .   HN     .   .   c30521_6mk4   1    
     184   1   .    .   1   1   25   25   CYS   H      H   .   .   .   1   1   26   26   LYS   H      H   .   .   .   .   .   4.93   0.0   4.93   .   .   .   .   .   A   .   25   CYS   H      .   .   A   .   26   LYS   H      .   .   .   25   .   HN     .   .   .   .   .   26   .   HN     .   .   c30521_6mk4   1    
     185   1   .    .   1   1   26   26   LYS   H      H   .   .   .   1   1   27   27   LYS   H      H   .   .   .   .   .   4.87   0.0   4.87   .   .   .   .   .   A   .   26   LYS   H      .   .   A   .   27   LYS   H      .   .   .   26   .   HN     .   .   .   .   .   27   .   HN     .   .   c30521_6mk4   1    
     186   1   .    .   1   1   26   26   LYS   H      H   .   .   .   1   1   22   22   ARG   H      H   .   .   .   .   .   5.31   0.0   5.31   .   .   .   .   .   A   .   26   LYS   H      .   .   A   .   22   ARG   H      .   .   .   26   .   HN     .   .   .   .   .   22   .   HN     .   .   c30521_6mk4   1    
     187   1   .    .   1   1   6    6    MET   H      H   .   .   .   1   1   5    5    TRP   HD1    H   .   .   .   .   .   3.69   0.0   3.69   .   .   .   .   .   A   .   6    MET   H      .   .   A   .   5    TRP   HD1    .   .   .   6    .   HN     .   .   .   .   .   5    .   HD1    .   .   c30521_6mk4   1    
     188   1   .    .   1   1   14   14   LYS   H      H   .   .   .   1   1   15   15   CYS   H      H   .   .   .   .   .   4.62   0.0   4.62   .   .   .   .   .   A   .   14   LYS   H      .   .   A   .   15   CYS   H      .   .   .   14   .   HN     .   .   .   .   .   15   .   HN     .   .   c30521_6mk4   1    
     189   1   .    .   1   1   6    6    MET   H      H   .   .   .   1   1   7    7    TRP   H      H   .   .   .   .   .   3.69   0.0   3.69   .   .   .   .   .   A   .   6    MET   H      .   .   A   .   7    TRP   H      .   .   .   6    .   HN     .   .   .   .   .   7    .   HN     .   .   c30521_6mk4   1    
     190   1   .    .   1   1   7    7    TRP   HE3    H   .   .   .   1   1   3    3    GLN   HE21   H   .   .   .   .   .   4.48   0.0   4.48   .   .   .   .   .   A   .   7    TRP   HE3    .   .   A   .   3    GLN   HE21   .   .   .   7    .   HE3    .   .   .   .   .   3    .   HE21   .   .   c30521_6mk4   1    
     191   1   .    .   1   1   18   18   GLY   H      H   .   .   .   1   1   19   19   MET   H      H   .   .   .   .   .   3.47   0.0   3.47   .   .   .   .   .   A   .   18   GLY   H      .   .   A   .   19   MET   H      .   .   .   18   .   HN     .   .   .   .   .   19   .   HN     .   .   c30521_6mk4   1    
     192   1   .    .   1   1   25   25   CYS   H      H   .   .   .   1   1   24   24   TRP   HD1    H   .   .   .   .   .   4.58   0.0   4.58   .   .   .   .   .   A   .   25   CYS   H      .   .   A   .   24   TRP   HD1    .   .   .   25   .   HN     .   .   .   .   .   24   .   HD1    .   .   c30521_6mk4   1    
     193   1   .    .   1   1   13   13   ARG   H      H   .   .   .   1   1   13   13   ARG   HE     H   .   .   .   .   .   4.57   0.0   4.57   .   .   .   .   .   A   .   13   ARG   H      .   .   A   .   13   ARG   HE     .   .   .   13   .   HN     .   .   .   .   .   13   .   HE     .   .   c30521_6mk4   1    
     194   1   .    .   1   1   2    2    CYS   H      H   .   .   .   1   1   1    1    TYR   QD     H   .   .   .   .   .   4.34   0.0   4.34   .   .   .   .   .   A   .   2    CYS   H      .   .   A   .   1    TYR   QD     .   .   .   2    .   HN     .   .   .   .   .   1    .   HD#    .   .   c30521_6mk4   1    
     195   1   .    .   1   1   29   29   LEU   H      H   .   .   .   1   1   30   30   TRP   H      H   .   .   .   .   .   3.86   0.0   3.86   .   .   .   .   .   A   .   29   LEU   H      .   .   A   .   30   TRP   H      .   .   .   29   .   HN     .   .   .   .   .   30   .   HN     .   .   c30521_6mk4   1    
     196   1   .    .   1   1   24   24   TRP   H      H   .   .   .   1   1   24   24   TRP   HE3    H   .   .   .   .   .   3.93   0.0   3.93   .   .   .   .   .   A   .   24   TRP   H      .   .   A   .   24   TRP   HE3    .   .   .   24   .   HN     .   .   .   .   .   24   .   HE3    .   .   c30521_6mk4   1    
     197   1   .    .   1   1   10   10   ASP   H      H   .   .   .   1   1   13   13   ARG   H      H   .   .   .   .   .   3.64   0.0   3.64   .   .   .   .   .   A   .   10   ASP   H      .   .   A   .   13   ARG   H      .   .   .   10   .   HN     .   .   .   .   .   13   .   HN     .   .   c30521_6mk4   1    
     198   1   .    .   1   1   27   27   LYS   H      H   .   .   .   1   1   28   28   LYS   H      H   .   .   .   .   .   4.71   0.0   4.71   .   .   .   .   .   A   .   27   LYS   H      .   .   A   .   28   LYS   H      .   .   .   27   .   HN     .   .   .   .   .   28   .   HN     .   .   c30521_6mk4   1    
     199   1   .    .   1   1   11   11   SER   H      H   .   .   .   1   1   12   12   GLU   H      H   .   .   .   .   .   3.54   0.0   3.54   .   .   .   .   .   A   .   11   SER   H      .   .   A   .   12   GLU   H      .   .   .   11   .   HN     .   .   .   .   .   12   .   HN     .   .   c30521_6mk4   1    
     200   1   .    .   1   1   5    5    TRP   H      H   .   .   .   1   1   6    6    MET   H      H   .   .   .   .   .   5.02   0.0   5.02   .   .   .   .   .   A   .   5    TRP   H      .   .   A   .   6    MET   H      .   .   .   5    .   HN     .   .   .   .   .   6    .   HN     .   .   c30521_6mk4   1    
     201   1   .    .   1   1   20   20   VAL   H      H   .   .   .   1   1   19   19   MET   H      H   .   .   .   .   .   4.74   0.0   4.74   .   .   .   .   .   A   .   20   VAL   H      .   .   A   .   19   MET   H      .   .   .   20   .   HN     .   .   .   .   .   19   .   HN     .   .   c30521_6mk4   1    
     202   1   .    .   1   1   18   18   GLY   H      H   .   .   .   1   1   17   17   LYS   H      H   .   .   .   .   .   4.82   0.0   4.82   .   .   .   .   .   A   .   18   GLY   H      .   .   A   .   17   LYS   H      .   .   .   18   .   HN     .   .   .   .   .   17   .   HN     .   .   c30521_6mk4   1    
     203   1   .    .   1   1   3    3    GLN   H      H   .   .   .   1   1   2    2    CYS   H      H   .   .   .   .   .   4.58   0.0   4.58   .   .   .   .   .   A   .   3    GLN   H      .   .   A   .   2    CYS   H      .   .   .   3    .   HN     .   .   .   .   .   2    .   HN     .   .   c30521_6mk4   1    
     204   1   .    .   1   1   7    7    TRP   HZ3    H   .   .   .   1   1   4    4    LYS   HG3    H   .   .   .   .   .   5.50   0.0   5.50   .   .   .   .   .   A   .   7    TRP   HZ3    .   .   A   .   4    LYS   HG3    .   .   .   7    .   HZ3    .   .   .   .   .   4    .   HG1    .   .   c30521_6mk4   1    
     205   1   .    .   1   1   4    4    LYS   HG3    H   .   .   .   1   1   7    7    TRP   HH2    H   .   .   .   .   .   5.50   0.0   5.50   .   .   .   .   .   A   .   4    LYS   HG3    .   .   A   .   7    TRP   HH2    .   .   .   4    .   HG1    .   .   .   .   .   7    .   HH2    .   .   c30521_6mk4   1    
     206   1   .    .   1   1   4    4    LYS   HG3    H   .   .   .   1   1   7    7    TRP   HZ2    H   .   .   .   .   .   5.50   0.0   5.50   .   .   .   .   .   A   .   4    LYS   HG3    .   .   A   .   7    TRP   HZ2    .   .   .   4    .   HG1    .   .   .   .   .   7    .   HZ2    .   .   c30521_6mk4   1    
     207   1   .    .   1   1   7    7    TRP   HE3    H   .   .   .   1   1   4    4    LYS   HG3    H   .   .   .   .   .   5.50   0.0   5.50   .   .   .   .   .   A   .   7    TRP   HE3    .   .   A   .   4    LYS   HG3    .   .   .   7    .   HE3    .   .   .   .   .   4    .   HG1    .   .   c30521_6mk4   1    
     208   1   .    .   1   1   5    5    TRP   H      H   .   .   .   1   1   4    4    LYS   HG3    H   .   .   .   .   .   5.37   0.0   5.37   .   .   .   .   .   A   .   5    TRP   H      .   .   A   .   4    LYS   HG3    .   .   .   5    .   HN     .   .   .   .   .   4    .   HG1    .   .   c30521_6mk4   1    
     209   1   .    .   1   1   5    5    TRP   H      H   .   .   .   1   1   4    4    LYS   HG2    H   .   .   .   .   .   4.65   0.0   4.65   .   .   .   .   .   A   .   5    TRP   H      .   .   A   .   4    LYS   HG2    .   .   .   5    .   HN     .   .   .   .   .   4    .   HG2    .   .   c30521_6mk4   1    
     210   1   .    .   1   1   9    9    CYS   H      H   .   .   .   1   1   8    8    THR   MG     H   .   .   .   .   .   3.97   0.0   3.97   .   .   .   .   .   A   .   9    CYS   H      .   .   A   .   8    THR   MG     .   .   .   9    .   HN     .   .   .   .   .   8    .   HG2#   .   .   c30521_6mk4   1    
     211   1   .    .   1   1   5    5    TRP   H      H   .   .   .   1   1   4    4    LYS   HB3    H   .   .   .   .   .   3.11   0.0   3.11   .   .   .   .   .   A   .   5    TRP   H      .   .   A   .   4    LYS   HB3    .   .   .   5    .   HN     .   .   .   .   .   4    .   HB1    .   .   c30521_6mk4   1    
     212   1   .    .   1   1   5    5    TRP   H      H   .   .   .   1   1   4    4    LYS   HB2    H   .   .   .   .   .   3.73   0.0   3.73   .   .   .   .   .   A   .   5    TRP   H      .   .   A   .   4    LYS   HB2    .   .   .   5    .   HN     .   .   .   .   .   4    .   HB2    .   .   c30521_6mk4   1    
     213   1   .    .   1   1   7    7    TRP   HE3    H   .   .   .   1   1   4    4    LYS   HB2    H   .   .   .   .   .   5.22   0.0   5.22   .   .   .   .   .   A   .   7    TRP   HE3    .   .   A   .   4    LYS   HB2    .   .   .   7    .   HE3    .   .   .   .   .   4    .   HB2    .   .   c30521_6mk4   1    
     214   1   .    .   1   1   7    7    TRP   HZ2    H   .   .   .   1   1   4    4    LYS   HB2    H   .   .   .   .   .   5.50   0.0   5.50   .   .   .   .   .   A   .   7    TRP   HZ2    .   .   A   .   4    LYS   HB2    .   .   .   7    .   HZ2    .   .   .   .   .   4    .   HB2    .   .   c30521_6mk4   1    
     215   1   .    .   1   1   7    7    TRP   HD1    H   .   .   .   1   1   4    4    LYS   HB2    H   .   .   .   .   .   5.29   0.0   5.29   .   .   .   .   .   A   .   7    TRP   HD1    .   .   A   .   4    LYS   HB2    .   .   .   7    .   HD1    .   .   .   .   .   4    .   HB2    .   .   c30521_6mk4   1    
     216   1   OR   .   1   1   29   29   LEU   H      H   .   .   .   1   1   28   28   LYS   HG2    H   .   .   .   .   .   4.59   0.0   4.59   .   .   .   .   .   A   .   29   LEU   H      .   .   A   .   28   LYS   HG2    .   .   .   29   .   HN     .   .   .   .   .   28   .   HG#    .   .   c30521_6mk4   1    
     216   2   OR   .   1   1   29   29   LEU   H      H   .   .   .   1   1   28   28   LYS   HG3    H   .   .   .   .   .   4.59   0.0   4.59   .   .   .   .   .   A   .   29   LEU   H      .   .   A   .   28   LYS   HG3    .   .   .   29   .   HN     .   .   .   .   .   28   .   HG#    .   .   c30521_6mk4   1    
     217   1   OR   .   1   1   30   30   TRP   H      H   .   .   .   1   1   28   28   LYS   HG2    H   .   .   .   .   .   4.50   0.0   4.50   .   .   .   .   .   A   .   30   TRP   H      .   .   A   .   28   LYS   HG2    .   .   .   30   .   HN     .   .   .   .   .   28   .   HG#    .   .   c30521_6mk4   1    
     217   2   OR   .   1   1   28   28   LYS   HG3    H   .   .   .   1   1   30   30   TRP   H      H   .   .   .   .   .   4.50   0.0   4.50   .   .   .   .   .   A   .   28   LYS   HG3    .   .   A   .   30   TRP   H      .   .   .   28   .   HG#    .   .   .   .   .   30   .   HN     .   .   c30521_6mk4   1    
     218   1   .    .   1   1   7    7    TRP   HE3    H   .   .   .   1   1   7    7    TRP   HB3    H   .   .   .   .   .   3.65   0.0   3.65   .   .   .   .   .   A   .   7    TRP   HE3    .   .   A   .   7    TRP   HB3    .   .   .   7    .   HE3    .   .   .   .   .   7    .   HB1    .   .   c30521_6mk4   1    
     219   1   .    .   1   1   7    7    TRP   HE3    H   .   .   .   1   1   7    7    TRP   HB2    H   .   .   .   .   .   3.94   0.0   3.94   .   .   .   .   .   A   .   7    TRP   HE3    .   .   A   .   7    TRP   HB2    .   .   .   7    .   HE3    .   .   .   .   .   7    .   HB2    .   .   c30521_6mk4   1    
     220   1   .    .   1   1   17   17   LYS   HA     H   .   .   .   1   1   19   19   MET   H      H   .   .   .   .   .   4.04   0.0   4.04   .   .   .   .   .   A   .   17   LYS   HA     .   .   A   .   19   MET   H      .   .   .   17   .   HA     .   .   .   .   .   19   .   HN     .   .   c30521_6mk4   1    
     221   1   .    .   1   1   5    5    TRP   HD1    H   .   .   .   1   1   6    6    MET   HA     H   .   .   .   .   .   5.22   0.0   5.22   .   .   .   .   .   A   .   5    TRP   HD1    .   .   A   .   6    MET   HA     .   .   .   5    .   HD1    .   .   .   .   .   6    .   HA     .   .   c30521_6mk4   1    
     222   1   .    .   1   1   1    1    TYR   QD     H   .   .   .   1   1   1    1    TYR   HA     H   .   .   .   .   .   4.03   0.0   4.03   .   .   .   .   .   A   .   1    TYR   QD     .   .   A   .   1    TYR   HA     .   .   .   1    .   HD#    .   .   .   .   .   1    .   HA     .   .   c30521_6mk4   1    
     223   1   .    .   1   1   8    8    THR   HA     H   .   .   .   1   1   24   24   TRP   HD1    H   .   .   .   .   .   4.99   0.0   4.99   .   .   .   .   .   A   .   8    THR   HA     .   .   A   .   24   TRP   HD1    .   .   .   8    .   HA     .   .   .   .   .   24   .   HD1    .   .   c30521_6mk4   1    
     224   1   .    .   1   1   27   27   LYS   HA     H   .   .   .   1   1   27   27   LYS   QZ     H   .   .   .   .   .   5.10   0.0   5.10   .   .   .   .   .   A   .   27   LYS   HA     .   .   A   .   27   LYS   QZ     .   .   .   27   .   HA     .   .   .   .   .   27   .   QZ     .   .   c30521_6mk4   1    
     225   1   .    .   1   1   9    9    CYS   H      H   .   .   .   1   1   24   24   TRP   HA     H   .   .   .   .   .   3.72   0.0   3.72   .   .   .   .   .   A   .   9    CYS   H      .   .   A   .   24   TRP   HA     .   .   .   9    .   HN     .   .   .   .   .   24   .   HA     .   .   c30521_6mk4   1    
     226   1   .    .   1   1   8    8    THR   HA     H   .   .   .   1   1   24   24   TRP   HA     H   .   .   .   .   .   3.61   0.0   3.61   .   .   .   .   .   A   .   8    THR   HA     .   .   A   .   24   TRP   HA     .   .   .   8    .   HA     .   .   .   .   .   24   .   HA     .   .   c30521_6mk4   1    
     227   1   .    .   1   1   8    8    THR   MG     H   .   .   .   1   1   24   24   TRP   HD1    H   .   .   .   .   .   4.50   0.0   4.50   .   .   .   .   .   A   .   8    THR   MG     .   .   A   .   24   TRP   HD1    .   .   .   8    .   HG2#   .   .   .   .   .   24   .   HD1    .   .   c30521_6mk4   1    
     228   1   .    .   1   1   7    7    TRP   H      H   .   .   .   1   1   6    6    MET   HG2    H   .   .   .   .   .   4.84   0.0   4.84   .   .   .   .   .   A   .   7    TRP   H      .   .   A   .   6    MET   HG2    .   .   .   7    .   HN     .   .   .   .   .   6    .   HG2    .   .   c30521_6mk4   1    
     229   1   .    .   1   1   7    7    TRP   H      H   .   .   .   1   1   6    6    MET   HG3    H   .   .   .   .   .   4.84   0.0   4.84   .   .   .   .   .   A   .   7    TRP   H      .   .   A   .   6    MET   HG3    .   .   .   7    .   HN     .   .   .   .   .   6    .   HG1    .   .   c30521_6mk4   1    
     230   1   .    .   1   1   7    7    TRP   H      H   .   .   .   1   1   6    6    MET   HB2    H   .   .   .   .   .   5.50   0.0   5.50   .   .   .   .   .   A   .   7    TRP   H      .   .   A   .   6    MET   HB2    .   .   .   7    .   HN     .   .   .   .   .   6    .   HB2    .   .   c30521_6mk4   1    
     231   1   .    .   1   1   7    7    TRP   H      H   .   .   .   1   1   6    6    MET   HB3    H   .   .   .   .   .   5.50   0.0   5.50   .   .   .   .   .   A   .   7    TRP   H      .   .   A   .   6    MET   HB3    .   .   .   7    .   HN     .   .   .   .   .   6    .   HB1    .   .   c30521_6mk4   1    
     232   1   .    .   1   1   10   10   ASP   H      H   .   .   .   1   1   13   13   ARG   HB2    H   .   .   .   .   .   3.62   0.0   3.62   .   .   .   .   .   A   .   10   ASP   H      .   .   A   .   13   ARG   HB2    .   .   .   10   .   HN     .   .   .   .   .   13   .   HB2    .   .   c30521_6mk4   1    
     233   1   OR   .   1   1   10   10   ASP   H      H   .   .   .   1   1   13   13   ARG   HG2    H   .   .   .   .   .   4.67   0.0   4.67   .   .   .   .   .   A   .   10   ASP   H      .   .   A   .   13   ARG   HG2    .   .   .   10   .   HN     .   .   .   .   .   13   .   HG#    .   .   c30521_6mk4   1    
     233   2   OR   .   1   1   10   10   ASP   H      H   .   .   .   1   1   13   13   ARG   HG3    H   .   .   .   .   .   4.67   0.0   4.67   .   .   .   .   .   A   .   10   ASP   H      .   .   A   .   13   ARG   HG3    .   .   .   10   .   HN     .   .   .   .   .   13   .   HG#    .   .   c30521_6mk4   1    
     234   1   .    .   1   1   10   10   ASP   H      H   .   .   .   1   1   13   13   ARG   HB3    H   .   .   .   .   .   4.15   0.0   4.15   .   .   .   .   .   A   .   10   ASP   H      .   .   A   .   13   ARG   HB3    .   .   .   10   .   HN     .   .   .   .   .   13   .   HB1    .   .   c30521_6mk4   1    
     235   1   .    .   1   1   25   25   CYS   H      H   .   .   .   1   1   8    8    THR   MG     H   .   .   .   .   .   4.81   0.0   4.81   .   .   .   .   .   A   .   25   CYS   H      .   .   A   .   8    THR   MG     .   .   .   25   .   HN     .   .   .   .   .   8    .   HG2#   .   .   c30521_6mk4   1    
     236   1   .    .   1   1   9    9    CYS   HA     H   .   .   .   1   1   13   13   ARG   H      H   .   .   .   .   .   5.46   0.0   5.46   .   .   .   .   .   A   .   9    CYS   HA     .   .   A   .   13   ARG   H      .   .   .   9    .   HA     .   .   .   .   .   13   .   HN     .   .   c30521_6mk4   1    
     237   1   OR   .   1   1   11   11   SER   H      H   .   .   .   1   1   10   10   ASP   HB2    H   .   .   .   .   .   2.81   0.0   2.81   .   .   .   .   .   A   .   11   SER   H      .   .   A   .   10   ASP   HB2    .   .   .   11   .   HN     .   .   .   .   .   10   .   HB#    .   .   c30521_6mk4   1    
     237   2   OR   .   1   1   11   11   SER   H      H   .   .   .   1   1   10   10   ASP   HB3    H   .   .   .   .   .   2.81   0.0   2.81   .   .   .   .   .   A   .   11   SER   H      .   .   A   .   10   ASP   HB3    .   .   .   11   .   HN     .   .   .   .   .   10   .   HB#    .   .   c30521_6mk4   1    
     238   1   .    .   1   1   22   22   ARG   H      H   .   .   .   1   1   21   21   CYS   HB2    H   .   .   .   .   .   4.45   0.0   4.45   .   .   .   .   .   A   .   22   ARG   H      .   .   A   .   21   CYS   HB2    .   .   .   22   .   HN     .   .   .   .   .   21   .   HB2    .   .   c30521_6mk4   1    
     239   1   .    .   1   1   22   22   ARG   H      H   .   .   .   1   1   21   21   CYS   HB3    H   .   .   .   .   .   4.45   0.0   4.45   .   .   .   .   .   A   .   22   ARG   H      .   .   A   .   21   CYS   HB3    .   .   .   22   .   HN     .   .   .   .   .   21   .   HB1    .   .   c30521_6mk4   1    
     240   1   OR   .   1   1   12   12   GLU   H      H   .   .   .   1   1   10   10   ASP   HB2    H   .   .   .   .   .   3.71   0.0   3.71   .   .   .   .   .   A   .   12   GLU   H      .   .   A   .   10   ASP   HB2    .   .   .   12   .   HN     .   .   .   .   .   10   .   HB#    .   .   c30521_6mk4   1    
     240   2   OR   .   1   1   10   10   ASP   HB3    H   .   .   .   1   1   12   12   GLU   H      H   .   .   .   .   .   3.71   0.0   3.71   .   .   .   .   .   A   .   10   ASP   HB3    .   .   A   .   12   GLU   H      .   .   .   10   .   HB#    .   .   .   .   .   12   .   HN     .   .   c30521_6mk4   1    
     241   1   OR   .   1   1   13   13   ARG   H      H   .   .   .   1   1   10   10   ASP   HB2    H   .   .   .   .   .   4.16   0.0   4.16   .   .   .   .   .   A   .   13   ARG   H      .   .   A   .   10   ASP   HB2    .   .   .   13   .   HN     .   .   .   .   .   10   .   HB#    .   .   c30521_6mk4   1    
     241   2   OR   .   1   1   10   10   ASP   HB3    H   .   .   .   1   1   13   13   ARG   H      H   .   .   .   .   .   4.16   0.0   4.16   .   .   .   .   .   A   .   10   ASP   HB3    .   .   A   .   13   ARG   H      .   .   .   10   .   HB#    .   .   .   .   .   13   .   HN     .   .   c30521_6mk4   1    
     242   1   .    .   1   1   14   14   LYS   H      H   .   .   .   1   1   13   13   ARG   HB2    H   .   .   .   .   .   4.59   0.0   4.59   .   .   .   .   .   A   .   14   LYS   H      .   .   A   .   13   ARG   HB2    .   .   .   14   .   HN     .   .   .   .   .   13   .   HB2    .   .   c30521_6mk4   1    
     243   1   OR   .   1   1   14   14   LYS   H      H   .   .   .   1   1   13   13   ARG   HG2    H   .   .   .   .   .   4.52   0.0   4.52   .   .   .   .   .   A   .   14   LYS   H      .   .   A   .   13   ARG   HG2    .   .   .   14   .   HN     .   .   .   .   .   13   .   HG#    .   .   c30521_6mk4   1    
     243   2   OR   .   1   1   14   14   LYS   H      H   .   .   .   1   1   13   13   ARG   HG3    H   .   .   .   .   .   4.52   0.0   4.52   .   .   .   .   .   A   .   14   LYS   H      .   .   A   .   13   ARG   HG3    .   .   .   14   .   HN     .   .   .   .   .   13   .   HG#    .   .   c30521_6mk4   1    
     244   1   .    .   1   1   14   14   LYS   H      H   .   .   .   1   1   13   13   ARG   HB3    H   .   .   .   .   .   3.84   0.0   3.84   .   .   .   .   .   A   .   14   LYS   H      .   .   A   .   13   ARG   HB3    .   .   .   14   .   HN     .   .   .   .   .   13   .   HB1    .   .   c30521_6mk4   1    
     245   1   OR   .   1   1   15   15   CYS   H      H   .   .   .   1   1   14   14   LYS   HG2    H   .   .   .   .   .   4.23   0.0   4.23   .   .   .   .   .   A   .   15   CYS   H      .   .   A   .   14   LYS   HG2    .   .   .   15   .   HN     .   .   .   .   .   14   .   HG#    .   .   c30521_6mk4   1    
     245   2   OR   .   1   1   15   15   CYS   H      H   .   .   .   1   1   14   14   LYS   HG3    H   .   .   .   .   .   4.23   0.0   4.23   .   .   .   .   .   A   .   15   CYS   H      .   .   A   .   14   LYS   HG3    .   .   .   15   .   HN     .   .   .   .   .   14   .   HG#    .   .   c30521_6mk4   1    
     246   1   .    .   1   1   15   15   CYS   H      H   .   .   .   1   1   14   14   LYS   HB3    H   .   .   .   .   .   4.30   0.0   4.30   .   .   .   .   .   A   .   15   CYS   H      .   .   A   .   14   LYS   HB3    .   .   .   15   .   HN     .   .   .   .   .   14   .   HB1    .   .   c30521_6mk4   1    
     247   1   .    .   1   1   15   15   CYS   H      H   .   .   .   1   1   14   14   LYS   HB2    H   .   .   .   .   .   4.30   0.0   4.30   .   .   .   .   .   A   .   15   CYS   H      .   .   A   .   14   LYS   HB2    .   .   .   15   .   HN     .   .   .   .   .   14   .   HB2    .   .   c30521_6mk4   1    
     248   1   .    .   1   1   7    7    TRP   HE1    H   .   .   .   1   1   4    4    LYS   HB2    H   .   .   .   .   .   5.36   0.0   5.36   .   .   .   .   .   A   .   7    TRP   HE1    .   .   A   .   4    LYS   HB2    .   .   .   7    .   HE1    .   .   .   .   .   4    .   HB2    .   .   c30521_6mk4   1    
     249   1   .    .   1   1   7    7    TRP   H      H   .   .   .   1   1   4    4    LYS   HB2    H   .   .   .   .   .   5.50   0.0   5.50   .   .   .   .   .   A   .   7    TRP   H      .   .   A   .   4    LYS   HB2    .   .   .   7    .   HN     .   .   .   .   .   4    .   HB2    .   .   c30521_6mk4   1    
     250   1   .    .   1   1   23   23   LEU   H      H   .   .   .   1   1   23   23   LEU   HB2    H   .   .   .   .   .   4.18   0.0   4.18   .   .   .   .   .   A   .   23   LEU   H      .   .   A   .   23   LEU   HB2    .   .   .   23   .   HN     .   .   .   .   .   23   .   HB2    .   .   c30521_6mk4   1    
     251   1   .    .   1   1   23   23   LEU   H      H   .   .   .   1   1   23   23   LEU   MD1    H   .   .   .   .   .   4.53   0.0   4.53   .   .   .   .   .   A   .   23   LEU   H      .   .   A   .   23   LEU   MD1    .   .   .   23   .   HN     .   .   .   .   .   23   .   HD1#   .   .   c30521_6mk4   1    
     252   1   .    .   1   1   27   27   LYS   H      H   .   .   .   1   1   26   26   LYS   HG2    H   .   .   .   .   .   4.56   0.0   4.56   .   .   .   .   .   A   .   27   LYS   H      .   .   A   .   26   LYS   HG2    .   .   .   27   .   HN     .   .   .   .   .   26   .   HG2    .   .   c30521_6mk4   1    
     253   1   .    .   1   1   26   26   LYS   H      H   .   .   .   1   1   25   25   CYS   HB2    H   .   .   .   .   .   4.79   0.0   4.79   .   .   .   .   .   A   .   26   LYS   H      .   .   A   .   25   CYS   HB2    .   .   .   26   .   HN     .   .   .   .   .   25   .   HB2    .   .   c30521_6mk4   1    
     254   1   .    .   1   1   27   27   LYS   H      H   .   .   .   1   1   26   26   LYS   HG3    H   .   .   .   .   .   3.44   0.0   3.44   .   .   .   .   .   A   .   27   LYS   H      .   .   A   .   26   LYS   HG3    .   .   .   27   .   HN     .   .   .   .   .   26   .   HG1    .   .   c30521_6mk4   1    
     255   1   .    .   1   1   27   27   LYS   H      H   .   .   .   1   1   26   26   LYS   HB2    H   .   .   .   .   .   4.50   0.0   4.50   .   .   .   .   .   A   .   27   LYS   H      .   .   A   .   26   LYS   HB2    .   .   .   27   .   HN     .   .   .   .   .   26   .   HB2    .   .   c30521_6mk4   1    
     256   1   .    .   1   1   27   27   LYS   H      H   .   .   .   1   1   26   26   LYS   HB3    H   .   .   .   .   .   4.50   0.0   4.50   .   .   .   .   .   A   .   27   LYS   H      .   .   A   .   26   LYS   HB3    .   .   .   27   .   HN     .   .   .   .   .   26   .   HB1    .   .   c30521_6mk4   1    
     257   1   .    .   1   1   27   27   LYS   H      H   .   .   .   1   1   19   19   MET   HG2    H   .   .   .   .   .   4.79   0.0   4.79   .   .   .   .   .   A   .   27   LYS   H      .   .   A   .   19   MET   HG2    .   .   .   27   .   HN     .   .   .   .   .   19   .   HG2    .   .   c30521_6mk4   1    
     258   1   .    .   1   1   28   28   LYS   H      H   .   .   .   1   1   27   27   LYS   HB3    H   .   .   .   .   .   3.88   0.0   3.88   .   .   .   .   .   A   .   28   LYS   H      .   .   A   .   27   LYS   HB3    .   .   .   28   .   HN     .   .   .   .   .   27   .   HB1    .   .   c30521_6mk4   1    
     259   1   .    .   1   1   28   28   LYS   H      H   .   .   .   1   1   27   27   LYS   HB2    H   .   .   .   .   .   3.88   0.0   3.88   .   .   .   .   .   A   .   28   LYS   H      .   .   A   .   27   LYS   HB2    .   .   .   28   .   HN     .   .   .   .   .   27   .   HB2    .   .   c30521_6mk4   1    
     260   1   OR   .   1   1   30   30   TRP   H      H   .   .   .   1   1   29   29   LEU   HB2    H   .   .   .   .   .   4.06   0.0   4.06   .   .   .   .   .   A   .   30   TRP   H      .   .   A   .   29   LEU   HB2    .   .   .   30   .   HN     .   .   .   .   .   29   .   HB#    .   .   c30521_6mk4   1    
     260   2   OR   .   1   1   29   29   LEU   HB3    H   .   .   .   1   1   30   30   TRP   H      H   .   .   .   .   .   4.06   0.0   4.06   .   .   .   .   .   A   .   29   LEU   HB3    .   .   A   .   30   TRP   H      .   .   .   29   .   HB#    .   .   .   .   .   30   .   HN     .   .   c30521_6mk4   1    
     261   1   .    .   1   1   30   30   TRP   H      H   .   .   .   1   1   29   29   LEU   MD2    H   .   .   .   .   .   5.11   0.0   5.11   .   .   .   .   .   A   .   30   TRP   H      .   .   A   .   29   LEU   MD2    .   .   .   30   .   HN     .   .   .   .   .   29   .   HD2#   .   .   c30521_6mk4   1    
     262   1   .    .   1   1   30   30   TRP   H      H   .   .   .   1   1   29   29   LEU   MD1    H   .   .   .   .   .   5.11   0.0   5.11   .   .   .   .   .   A   .   30   TRP   H      .   .   A   .   29   LEU   MD1    .   .   .   30   .   HN     .   .   .   .   .   29   .   HD1#   .   .   c30521_6mk4   1    
     263   1   .    .   1   1   3    3    GLN   HE21   H   .   .   .   1   1   3    3    GLN   HB3    H   .   .   .   .   .   4.54   0.0   4.54   .   .   .   .   .   A   .   3    GLN   HE21   .   .   A   .   3    GLN   HB3    .   .   .   3    .   HE21   .   .   .   .   .   3    .   HB1    .   .   c30521_6mk4   1    
     264   1   .    .   1   1   3    3    GLN   HE21   H   .   .   .   1   1   3    3    GLN   HB2    H   .   .   .   .   .   4.54   0.0   4.54   .   .   .   .   .   A   .   3    GLN   HE21   .   .   A   .   3    GLN   HB2    .   .   .   3    .   HE21   .   .   .   .   .   3    .   HB2    .   .   c30521_6mk4   1    
     265   1   .    .   1   1   3    3    GLN   HG3    H   .   .   .   1   1   3    3    GLN   HE21   H   .   .   .   .   .   3.50   0.0   3.50   .   .   .   .   .   A   .   3    GLN   HG3    .   .   A   .   3    GLN   HE21   .   .   .   3    .   HG1    .   .   .   .   .   3    .   HE21   .   .   c30521_6mk4   1    
     266   1   .    .   1   1   9    9    CYS   HA     H   .   .   .   1   1   3    3    GLN   HE21   H   .   .   .   .   .   4.93   0.0   4.93   .   .   .   .   .   A   .   9    CYS   HA     .   .   A   .   3    GLN   HE21   .   .   .   9    .   HA     .   .   .   .   .   3    .   HE21   .   .   c30521_6mk4   1    
     267   1   .    .   1   1   3    3    GLN   HA     H   .   .   .   1   1   3    3    GLN   HE21   H   .   .   .   .   .   4.90   0.0   4.90   .   .   .   .   .   A   .   3    GLN   HA     .   .   A   .   3    GLN   HE21   .   .   .   3    .   HA     .   .   .   .   .   3    .   HE21   .   .   c30521_6mk4   1    
     268   1   .    .   1   1   7    7    TRP   HB2    H   .   .   .   1   1   3    3    GLN   HE21   H   .   .   .   .   .   4.54   0.0   4.54   .   .   .   .   .   A   .   7    TRP   HB2    .   .   A   .   3    GLN   HE21   .   .   .   7    .   HB2    .   .   .   .   .   3    .   HE21   .   .   c30521_6mk4   1    
     269   1   .    .   1   1   7    7    TRP   HB3    H   .   .   .   1   1   3    3    GLN   HE21   H   .   .   .   .   .   3.98   0.0   3.98   .   .   .   .   .   A   .   7    TRP   HB3    .   .   A   .   3    GLN   HE21   .   .   .   7    .   HB1    .   .   .   .   .   3    .   HE21   .   .   c30521_6mk4   1    
     270   1   .    .   1   1   3    3    GLN   HE21   H   .   .   .   1   1   13   13   ARG   HD2    H   .   .   .   .   .   5.30   0.0   5.30   .   .   .   .   .   A   .   3    GLN   HE21   .   .   A   .   13   ARG   HD2    .   .   .   3    .   HE21   .   .   .   .   .   13   .   HD2    .   .   c30521_6mk4   1    
     271   1   .    .   1   1   9    9    CYS   HB3    H   .   .   .   1   1   3    3    GLN   HE21   H   .   .   .   .   .   5.50   0.0   5.50   .   .   .   .   .   A   .   9    CYS   HB3    .   .   A   .   3    GLN   HE21   .   .   .   9    .   HB1    .   .   .   .   .   3    .   HE21   .   .   c30521_6mk4   1    
     272   1   .    .   1   1   3    3    GLN   HE21   H   .   .   .   1   1   13   13   ARG   HD3    H   .   .   .   .   .   5.30   0.0   5.30   .   .   .   .   .   A   .   3    GLN   HE21   .   .   A   .   13   ARG   HD3    .   .   .   3    .   HE21   .   .   .   .   .   13   .   HD1    .   .   c30521_6mk4   1    
     273   1   .    .   1   1   13   13   ARG   HB2    H   .   .   .   1   1   3    3    GLN   HE21   H   .   .   .   .   .   5.21   0.0   5.21   .   .   .   .   .   A   .   13   ARG   HB2    .   .   A   .   3    GLN   HE21   .   .   .   13   .   HB2    .   .   .   .   .   3    .   HE21   .   .   c30521_6mk4   1    
     274   1   OR   .   1   1   3    3    GLN   HE21   H   .   .   .   1   1   13   13   ARG   HG2    H   .   .   .   .   .   5.12   0.0   5.12   .   .   .   .   .   A   .   3    GLN   HE21   .   .   A   .   13   ARG   HG2    .   .   .   3    .   HE21   .   .   .   .   .   13   .   HG#    .   .   c30521_6mk4   1    
     274   2   OR   .   1   1   13   13   ARG   HG3    H   .   .   .   1   1   3    3    GLN   HE21   H   .   .   .   .   .   5.12   0.0   5.12   .   .   .   .   .   A   .   13   ARG   HG3    .   .   A   .   3    GLN   HE21   .   .   .   13   .   HG#    .   .   .   .   .   3    .   HE21   .   .   c30521_6mk4   1    
     275   1   .    .   1   1   13   13   ARG   HB3    H   .   .   .   1   1   3    3    GLN   HE21   H   .   .   .   .   .   4.49   0.0   4.49   .   .   .   .   .   A   .   13   ARG   HB3    .   .   A   .   3    GLN   HE21   .   .   .   13   .   HB1    .   .   .   .   .   3    .   HE21   .   .   c30521_6mk4   1    
     276   1   .    .   1   1   10   10   ASP   H      H   .   .   .   1   1   11   11   SER   H      H   .   .   .   .   .   5.17   0.0   5.17   .   .   .   .   .   A   .   10   ASP   H      .   .   A   .   11   SER   H      .   .   .   10   .   HN     .   .   .   .   .   11   .   HN     .   .   c30521_6mk4   1    
     277   1   .    .   1   1   8    8    THR   H      H   .   .   .   1   1   3    3    GLN   HE21   H   .   .   .   .   .   5.23   0.0   5.23   .   .   .   .   .   A   .   8    THR   H      .   .   A   .   3    GLN   HE21   .   .   .   8    .   HN     .   .   .   .   .   3    .   HE21   .   .   c30521_6mk4   1    
     278   1   .    .   1   1   5    5    TRP   HA     H   .   .   .   1   1   5    5    TRP   HE3    H   .   .   .   .   .   4.87   0.0   4.87   .   .   .   .   .   A   .   5    TRP   HA     .   .   A   .   5    TRP   HE3    .   .   .   5    .   HA     .   .   .   .   .   5    .   HE3    .   .   c30521_6mk4   1    
     279   1   .    .   1   1   1    1    TYR   HA     H   .   .   .   1   1   1    1    TYR   QE     H   .   .   .   .   .   5.50   0.0   5.50   .   .   .   .   .   A   .   1    TYR   HA     .   .   A   .   1    TYR   QE     .   .   .   1    .   HA     .   .   .   .   .   1    .   HE#    .   .   c30521_6mk4   1    
     280   1   .    .   1   1   7    7    TRP   HE3    H   .   .   .   1   1   7    7    TRP   HA     H   .   .   .   .   .   5.30   0.0   5.30   .   .   .   .   .   A   .   7    TRP   HE3    .   .   A   .   7    TRP   HA     .   .   .   7    .   HE3    .   .   .   .   .   7    .   HA     .   .   c30521_6mk4   1    
     281   1   .    .   1   1   4    4    LYS   H      H   .   .   .   1   1   7    7    TRP   HB2    H   .   .   .   .   .   4.44   0.0   4.44   .   .   .   .   .   A   .   4    LYS   H      .   .   A   .   7    TRP   HB2    .   .   .   4    .   HN     .   .   .   .   .   7    .   HB2    .   .   c30521_6mk4   1    
     282   1   .    .   1   1   23   23   LEU   HA     H   .   .   .   1   1   22   22   ARG   HA     H   .   .   .   .   .   4.48   0.0   4.48   .   .   .   .   .   A   .   23   LEU   HA     .   .   A   .   22   ARG   HA     .   .   .   23   .   HA     .   .   .   .   .   22   .   HA     .   .   c30521_6mk4   1    
     283   1   .    .   1   1   3    3    GLN   HA     H   .   .   .   1   1   7    7    TRP   HB2    H   .   .   .   .   .   4.85   0.0   4.85   .   .   .   .   .   A   .   3    GLN   HA     .   .   A   .   7    TRP   HB2    .   .   .   3    .   HA     .   .   .   .   .   7    .   HB2    .   .   c30521_6mk4   1    
     284   1   .    .   1   1   3    3    GLN   HA     H   .   .   .   1   1   7    7    TRP   HB3    H   .   .   .   .   .   4.78   0.0   4.78   .   .   .   .   .   A   .   3    GLN   HA     .   .   A   .   7    TRP   HB3    .   .   .   3    .   HA     .   .   .   .   .   7    .   HB1    .   .   c30521_6mk4   1    
     285   1   .    .   1   1   14   14   LYS   HA     H   .   .   .   1   1   9    9    CYS   HB2    H   .   .   .   .   .   4.61   0.0   4.61   .   .   .   .   .   A   .   14   LYS   HA     .   .   A   .   9    CYS   HB2    .   .   .   14   .   HA     .   .   .   .   .   9    .   HB2    .   .   c30521_6mk4   1    
     286   1   .    .   1   1   14   14   LYS   HA     H   .   .   .   1   1   9    9    CYS   HB3    H   .   .   .   .   .   4.92   0.0   4.92   .   .   .   .   .   A   .   14   LYS   HA     .   .   A   .   9    CYS   HB3    .   .   .   14   .   HA     .   .   .   .   .   9    .   HB1    .   .   c30521_6mk4   1    
     287   1   .    .   1   1   15   15   CYS   HA     H   .   .   .   1   1   3    3    GLN   HB2    H   .   .   .   .   .   3.80   0.0   3.80   .   .   .   .   .   A   .   15   CYS   HA     .   .   A   .   3    GLN   HB2    .   .   .   15   .   HA     .   .   .   .   .   3    .   HB2    .   .   c30521_6mk4   1    
     288   1   .    .   1   1   15   15   CYS   HA     H   .   .   .   1   1   3    3    GLN   HB3    H   .   .   .   .   .   3.80   0.0   3.80   .   .   .   .   .   A   .   15   CYS   HA     .   .   A   .   3    GLN   HB3    .   .   .   15   .   HA     .   .   .   .   .   3    .   HB1    .   .   c30521_6mk4   1    
     289   1   .    .   1   1   9    9    CYS   HA     H   .   .   .   1   1   3    3    GLN   HG3    H   .   .   .   .   .   4.32   0.0   4.32   .   .   .   .   .   A   .   9    CYS   HA     .   .   A   .   3    GLN   HG3    .   .   .   9    .   HA     .   .   .   .   .   3    .   HG1    .   .   c30521_6mk4   1    
     290   1   .    .   1   1   4    4    LYS   H      H   .   .   .   1   1   3    3    GLN   HB2    H   .   .   .   .   .   4.73   0.0   4.73   .   .   .   .   .   A   .   4    LYS   H      .   .   A   .   3    GLN   HB2    .   .   .   4    .   HN     .   .   .   .   .   3    .   HB2    .   .   c30521_6mk4   1    
     291   1   .    .   1   1   4    4    LYS   H      H   .   .   .   1   1   3    3    GLN   HB3    H   .   .   .   .   .   4.73   0.0   4.73   .   .   .   .   .   A   .   4    LYS   H      .   .   A   .   3    GLN   HB3    .   .   .   4    .   HN     .   .   .   .   .   3    .   HB1    .   .   c30521_6mk4   1    
     292   1   .    .   1   1   9    9    CYS   HA     H   .   .   .   1   1   13   13   ARG   HB2    H   .   .   .   .   .   4.11   0.0   4.11   .   .   .   .   .   A   .   9    CYS   HA     .   .   A   .   13   ARG   HB2    .   .   .   9    .   HA     .   .   .   .   .   13   .   HB2    .   .   c30521_6mk4   1    
     293   1   OR   .   1   1   9    9    CYS   HA     H   .   .   .   1   1   13   13   ARG   HG2    H   .   .   .   .   .   5.06   0.0   5.06   .   .   .   .   .   A   .   9    CYS   HA     .   .   A   .   13   ARG   HG2    .   .   .   9    .   HA     .   .   .   .   .   13   .   HG#    .   .   c30521_6mk4   1    
     293   2   OR   .   1   1   9    9    CYS   HA     H   .   .   .   1   1   13   13   ARG   HG3    H   .   .   .   .   .   5.06   0.0   5.06   .   .   .   .   .   A   .   9    CYS   HA     .   .   A   .   13   ARG   HG3    .   .   .   9    .   HA     .   .   .   .   .   13   .   HG#    .   .   c30521_6mk4   1    
     294   1   .    .   1   1   9    9    CYS   HA     H   .   .   .   1   1   13   13   ARG   HB3    H   .   .   .   .   .   4.35   0.0   4.35   .   .   .   .   .   A   .   9    CYS   HA     .   .   A   .   13   ARG   HB3    .   .   .   9    .   HA     .   .   .   .   .   13   .   HB1    .   .   c30521_6mk4   1    
     295   1   .    .   1   1   19   19   MET   HA     H   .   .   .   1   1   27   27   LYS   HA     H   .   .   .   .   .   4.43   0.0   4.43   .   .   .   .   .   A   .   19   MET   HA     .   .   A   .   27   LYS   HA     .   .   .   19   .   HA     .   .   .   .   .   27   .   HA     .   .   c30521_6mk4   1    
     296   1   .    .   1   1   15   15   CYS   HA     H   .   .   .   1   1   3    3    GLN   HG2    H   .   .   .   .   .   4.47   0.0   4.47   .   .   .   .   .   A   .   15   CYS   HA     .   .   A   .   3    GLN   HG2    .   .   .   15   .   HA     .   .   .   .   .   3    .   HG2    .   .   c30521_6mk4   1    
     297   1   .    .   1   1   27   27   LYS   HA     H   .   .   .   1   1   19   19   MET   HG3    H   .   .   .   .   .   4.23   0.0   4.23   .   .   .   .   .   A   .   27   LYS   HA     .   .   A   .   19   MET   HG3    .   .   .   27   .   HA     .   .   .   .   .   19   .   HG1    .   .   c30521_6mk4   1    
     298   1   .    .   1   1   27   27   LYS   HA     H   .   .   .   1   1   19   19   MET   HG2    H   .   .   .   .   .   3.43   0.0   3.43   .   .   .   .   .   A   .   27   LYS   HA     .   .   A   .   19   MET   HG2    .   .   .   27   .   HA     .   .   .   .   .   19   .   HG2    .   .   c30521_6mk4   1    
     299   1   .    .   1   1   27   27   LYS   HA     H   .   .   .   1   1   19   19   MET   HB3    H   .   .   .   .   .   4.31   0.0   4.31   .   .   .   .   .   A   .   27   LYS   HA     .   .   A   .   19   MET   HB3    .   .   .   27   .   HA     .   .   .   .   .   19   .   HB1    .   .   c30521_6mk4   1    
     300   1   .    .   1   1   4    4    LYS   H      H   .   .   .   1   1   4    4    LYS   HB2    H   .   .   .   .   .   4.01   0.0   4.01   .   .   .   .   .   A   .   4    LYS   H      .   .   A   .   4    LYS   HB2    .   .   .   4    .   HN     .   .   .   .   .   4    .   HB2    .   .   c30521_6mk4   1    
     301   1   .    .   1   1   4    4    LYS   H      H   .   .   .   1   1   4    4    LYS   HG3    H   .   .   .   .   .   4.12   0.0   4.12   .   .   .   .   .   A   .   4    LYS   H      .   .   A   .   4    LYS   HG3    .   .   .   4    .   HN     .   .   .   .   .   4    .   HG1    .   .   c30521_6mk4   1    
     302   1   .    .   1   1   4    4    LYS   H      H   .   .   .   1   1   4    4    LYS   HG2    H   .   .   .   .   .   4.64   0.0   4.64   .   .   .   .   .   A   .   4    LYS   H      .   .   A   .   4    LYS   HG2    .   .   .   4    .   HN     .   .   .   .   .   4    .   HG2    .   .   c30521_6mk4   1    
     303   1   OR   .   1   1   11   11   SER   HB2    H   .   .   .   1   1   12   12   GLU   HG2    H   .   .   .   .   .   5.04   0.0   5.04   .   .   .   .   .   A   .   11   SER   HB2    .   .   A   .   12   GLU   HG2    .   .   .   11   .   HB#    .   .   .   .   .   12   .   HG#    .   .   c30521_6mk4   1    
     303   2   OR   .   1   1   12   12   GLU   HG3    H   .   .   .   1   1   11   11   SER   HB2    H   .   .   .   .   .   5.04   0.0   5.04   .   .   .   .   .   A   .   12   GLU   HG3    .   .   A   .   11   SER   HB2    .   .   .   12   .   HG#    .   .   .   .   .   11   .   HB#    .   .   c30521_6mk4   1    
     303   3   OR   .   1   1   11   11   SER   HB3    H   .   .   .   1   1   12   12   GLU   HG3    H   .   .   .   .   .   5.04   0.0   5.04   .   .   .   .   .   A   .   11   SER   HB3    .   .   A   .   12   GLU   HG3    .   .   .   11   .   HB#    .   .   .   .   .   12   .   HG#    .   .   c30521_6mk4   1    
     303   4   OR   .   1   1   11   11   SER   HB3    H   .   .   .   1   1   12   12   GLU   HG2    H   .   .   .   .   .   5.04   0.0   5.04   .   .   .   .   .   A   .   11   SER   HB3    .   .   A   .   12   GLU   HG2    .   .   .   11   .   HB#    .   .   .   .   .   12   .   HG#    .   .   c30521_6mk4   1    
     304   1   .    .   1   1   15   15   CYS   HA     H   .   .   .   1   1   3    3    GLN   HG3    H   .   .   .   .   .   4.82   0.0   4.82   .   .   .   .   .   A   .   15   CYS   HA     .   .   A   .   3    GLN   HG3    .   .   .   15   .   HA     .   .   .   .   .   3    .   HG1    .   .   c30521_6mk4   1    
     305   1   .    .   1   1   3    3    GLN   HA     H   .   .   .   1   1   4    4    LYS   HG3    H   .   .   .   .   .   5.43   0.0   5.43   .   .   .   .   .   A   .   3    GLN   HA     .   .   A   .   4    LYS   HG3    .   .   .   3    .   HA     .   .   .   .   .   4    .   HG1    .   .   c30521_6mk4   1    
     306   1   OR   .   1   1   2    2    CYS   H      H   .   .   .   1   1   1    1    TYR   HB3    H   .   .   .   .   .   3.33   0.0   3.33   .   .   .   .   .   A   .   2    CYS   H      .   .   A   .   1    TYR   HB3    .   .   .   2    .   HN     .   .   .   .   .   1    .   HB#    .   .   c30521_6mk4   1    
     306   2   OR   .   1   1   2    2    CYS   H      H   .   .   .   1   1   1    1    TYR   HB2    H   .   .   .   .   .   3.33   0.0   3.33   .   .   .   .   .   A   .   2    CYS   H      .   .   A   .   1    TYR   HB2    .   .   .   2    .   HN     .   .   .   .   .   1    .   HB#    .   .   c30521_6mk4   1    
     307   1   OR   .   1   1   2    2    CYS   H      H   .   .   .   1   1   2    2    CYS   HB3    H   .   .   .   .   .   3.44   0.0   3.44   .   .   .   .   .   A   .   2    CYS   H      .   .   A   .   2    CYS   HB3    .   .   .   2    .   HN     .   .   .   .   .   2    .   HB#    .   .   c30521_6mk4   1    
     307   2   OR   .   1   1   2    2    CYS   H      H   .   .   .   1   1   2    2    CYS   HB2    H   .   .   .   .   .   3.44   0.0   3.44   .   .   .   .   .   A   .   2    CYS   H      .   .   A   .   2    CYS   HB2    .   .   .   2    .   HN     .   .   .   .   .   2    .   HB#    .   .   c30521_6mk4   1    
     308   1   OR   .   1   1   3    3    GLN   H      H   .   .   .   1   1   2    2    CYS   HB3    H   .   .   .   .   .   3.27   0.0   3.27   .   .   .   .   .   A   .   3    GLN   H      .   .   A   .   2    CYS   HB3    .   .   .   3    .   HN     .   .   .   .   .   2    .   HB#    .   .   c30521_6mk4   1    
     308   2   OR   .   1   1   3    3    GLN   H      H   .   .   .   1   1   2    2    CYS   HB2    H   .   .   .   .   .   3.27   0.0   3.27   .   .   .   .   .   A   .   3    GLN   H      .   .   A   .   2    CYS   HB2    .   .   .   3    .   HN     .   .   .   .   .   2    .   HB#    .   .   c30521_6mk4   1    
     309   1   OR   .   1   1   3    3    GLN   H      H   .   .   .   1   1   3    3    GLN   HB2    H   .   .   .   .   .   3.43   0.0   3.43   .   .   .   .   .   A   .   3    GLN   H      .   .   A   .   3    GLN   HB2    .   .   .   3    .   HN     .   .   .   .   .   3    .   HB#    .   .   c30521_6mk4   1    
     309   2   OR   .   1   1   3    3    GLN   H      H   .   .   .   1   1   3    3    GLN   HB3    H   .   .   .   .   .   3.43   0.0   3.43   .   .   .   .   .   A   .   3    GLN   H      .   .   A   .   3    GLN   HB3    .   .   .   3    .   HN     .   .   .   .   .   3    .   HB#    .   .   c30521_6mk4   1    
     310   1   OR   .   1   1   3    3    GLN   HE21   H   .   .   .   1   1   3    3    GLN   HB2    H   .   .   .   .   .   3.78   0.0   3.78   .   .   .   .   .   A   .   3    GLN   HE21   .   .   A   .   3    GLN   HB2    .   .   .   3    .   HE21   .   .   .   .   .   3    .   HB#    .   .   c30521_6mk4   1    
     310   2   OR   .   1   1   3    3    GLN   HE21   H   .   .   .   1   1   3    3    GLN   HB3    H   .   .   .   .   .   3.78   0.0   3.78   .   .   .   .   .   A   .   3    GLN   HE21   .   .   A   .   3    GLN   HB3    .   .   .   3    .   HE21   .   .   .   .   .   3    .   HB#    .   .   c30521_6mk4   1    
     311   1   OR   .   1   1   3    3    GLN   HE22   H   .   .   .   1   1   3    3    GLN   HB2    H   .   .   .   .   .   4.58   0.0   4.58   .   .   .   .   .   A   .   3    GLN   HE22   .   .   A   .   3    GLN   HB2    .   .   .   3    .   HE22   .   .   .   .   .   3    .   HB#    .   .   c30521_6mk4   1    
     311   2   OR   .   1   1   3    3    GLN   HE22   H   .   .   .   1   1   3    3    GLN   HB3    H   .   .   .   .   .   4.58   0.0   4.58   .   .   .   .   .   A   .   3    GLN   HE22   .   .   A   .   3    GLN   HB3    .   .   .   3    .   HE22   .   .   .   .   .   3    .   HB#    .   .   c30521_6mk4   1    
     312   1   OR   .   1   1   4    4    LYS   H      H   .   .   .   1   1   3    3    GLN   HB2    H   .   .   .   .   .   4.15   0.0   4.15   .   .   .   .   .   A   .   4    LYS   H      .   .   A   .   3    GLN   HB2    .   .   .   4    .   HN     .   .   .   .   .   3    .   HB#    .   .   c30521_6mk4   1    
     312   2   OR   .   1   1   4    4    LYS   H      H   .   .   .   1   1   3    3    GLN   HB3    H   .   .   .   .   .   4.15   0.0   4.15   .   .   .   .   .   A   .   4    LYS   H      .   .   A   .   3    GLN   HB3    .   .   .   4    .   HN     .   .   .   .   .   3    .   HB#    .   .   c30521_6mk4   1    
     313   1   OR   .   1   1   7    7    TRP   HE3    H   .   .   .   1   1   3    3    GLN   HB2    H   .   .   .   .   .   4.75   0.0   4.75   .   .   .   .   .   A   .   7    TRP   HE3    .   .   A   .   3    GLN   HB2    .   .   .   7    .   HE3    .   .   .   .   .   3    .   HB#    .   .   c30521_6mk4   1    
     313   2   OR   .   1   1   7    7    TRP   HE3    H   .   .   .   1   1   3    3    GLN   HB3    H   .   .   .   .   .   4.75   0.0   4.75   .   .   .   .   .   A   .   7    TRP   HE3    .   .   A   .   3    GLN   HB3    .   .   .   7    .   HE3    .   .   .   .   .   3    .   HB#    .   .   c30521_6mk4   1    
     314   1   OR   .   1   1   15   15   CYS   HA     H   .   .   .   1   1   3    3    GLN   HB2    H   .   .   .   .   .   3.22   0.0   3.22   .   .   .   .   .   A   .   15   CYS   HA     .   .   A   .   3    GLN   HB2    .   .   .   15   .   HA     .   .   .   .   .   3    .   HB#    .   .   c30521_6mk4   1    
     314   2   OR   .   1   1   15   15   CYS   HA     H   .   .   .   1   1   3    3    GLN   HB3    H   .   .   .   .   .   3.22   0.0   3.22   .   .   .   .   .   A   .   15   CYS   HA     .   .   A   .   3    GLN   HB3    .   .   .   15   .   HA     .   .   .   .   .   3    .   HB#    .   .   c30521_6mk4   1    
     315   1   OR   .   1   1   16   16   CYS   H      H   .   .   .   1   1   3    3    GLN   HB2    H   .   .   .   .   .   3.54   0.0   3.54   .   .   .   .   .   A   .   16   CYS   H      .   .   A   .   3    GLN   HB2    .   .   .   16   .   HN     .   .   .   .   .   3    .   HB#    .   .   c30521_6mk4   1    
     315   2   OR   .   1   1   16   16   CYS   H      H   .   .   .   1   1   3    3    GLN   HB3    H   .   .   .   .   .   3.54   0.0   3.54   .   .   .   .   .   A   .   16   CYS   H      .   .   A   .   3    GLN   HB3    .   .   .   16   .   HN     .   .   .   .   .   3    .   HB#    .   .   c30521_6mk4   1    
     316   1   OR   .   1   1   3    3    GLN   HE21   H   .   .   .   1   1   13   13   ARG   HD3    H   .   .   .   .   .   4.48   0.0   4.48   .   .   .   .   .   A   .   3    GLN   HE21   .   .   A   .   13   ARG   HD3    .   .   .   3    .   HE21   .   .   .   .   .   13   .   HD#    .   .   c30521_6mk4   1    
     316   2   OR   .   1   1   3    3    GLN   HE21   H   .   .   .   1   1   13   13   ARG   HD2    H   .   .   .   .   .   4.48   0.0   4.48   .   .   .   .   .   A   .   3    GLN   HE21   .   .   A   .   13   ARG   HD2    .   .   .   3    .   HE21   .   .   .   .   .   13   .   HD#    .   .   c30521_6mk4   1    
     317   1   OR   .   1   1   5    5    TRP   HD1    H   .   .   .   1   1   6    6    MET   HB2    H   .   .   .   .   .   4.48   0.0   4.48   .   .   .   .   .   A   .   5    TRP   HD1    .   .   A   .   6    MET   HB2    .   .   .   5    .   HD1    .   .   .   .   .   6    .   HB#    .   .   c30521_6mk4   1    
     317   2   OR   .   1   1   5    5    TRP   HD1    H   .   .   .   1   1   6    6    MET   HB3    H   .   .   .   .   .   4.48   0.0   4.48   .   .   .   .   .   A   .   5    TRP   HD1    .   .   A   .   6    MET   HB3    .   .   .   5    .   HD1    .   .   .   .   .   6    .   HB#    .   .   c30521_6mk4   1    
     318   1   OR   .   1   1   5    5    TRP   HE1    H   .   .   .   1   1   6    6    MET   HB2    H   .   .   .   .   .   4.91   0.0   4.91   .   .   .   .   .   A   .   5    TRP   HE1    .   .   A   .   6    MET   HB2    .   .   .   5    .   HE1    .   .   .   .   .   6    .   HB#    .   .   c30521_6mk4   1    
     318   2   OR   .   1   1   6    6    MET   HB3    H   .   .   .   1   1   5    5    TRP   HE1    H   .   .   .   .   .   4.91   0.0   4.91   .   .   .   .   .   A   .   6    MET   HB3    .   .   A   .   5    TRP   HE1    .   .   .   6    .   HB#    .   .   .   .   .   5    .   HE1    .   .   c30521_6mk4   1    
     319   1   OR   .   1   1   5    5    TRP   HZ2    H   .   .   .   1   1   6    6    MET   HB2    H   .   .   .   .   .   4.85   0.0   4.85   .   .   .   .   .   A   .   5    TRP   HZ2    .   .   A   .   6    MET   HB2    .   .   .   5    .   HZ2    .   .   .   .   .   6    .   HB#    .   .   c30521_6mk4   1    
     319   2   OR   .   1   1   6    6    MET   HB3    H   .   .   .   1   1   5    5    TRP   HZ2    H   .   .   .   .   .   4.85   0.0   4.85   .   .   .   .   .   A   .   6    MET   HB3    .   .   A   .   5    TRP   HZ2    .   .   .   6    .   HB#    .   .   .   .   .   5    .   HZ2    .   .   c30521_6mk4   1    
     320   1   OR   .   1   1   6    6    MET   HA     H   .   .   .   1   1   6    6    MET   HG3    H   .   .   .   .   .   3.51   0.0   3.51   .   .   .   .   .   A   .   6    MET   HA     .   .   A   .   6    MET   HG3    .   .   .   6    .   HA     .   .   .   .   .   6    .   HG#    .   .   c30521_6mk4   1    
     320   2   OR   .   1   1   6    6    MET   HA     H   .   .   .   1   1   6    6    MET   HG2    H   .   .   .   .   .   3.51   0.0   3.51   .   .   .   .   .   A   .   6    MET   HA     .   .   A   .   6    MET   HG2    .   .   .   6    .   HA     .   .   .   .   .   6    .   HG#    .   .   c30521_6mk4   1    
     321   1   OR   .   1   1   13   13   ARG   HA     H   .   .   .   1   1   13   13   ARG   HD3    H   .   .   .   .   .   4.43   0.0   4.43   .   .   .   .   .   A   .   13   ARG   HA     .   .   A   .   13   ARG   HD3    .   .   .   13   .   HA     .   .   .   .   .   13   .   HD#    .   .   c30521_6mk4   1    
     321   2   OR   .   1   1   13   13   ARG   HA     H   .   .   .   1   1   13   13   ARG   HD2    H   .   .   .   .   .   4.43   0.0   4.43   .   .   .   .   .   A   .   13   ARG   HA     .   .   A   .   13   ARG   HD2    .   .   .   13   .   HA     .   .   .   .   .   13   .   HD#    .   .   c30521_6mk4   1    
     322   1   OR   .   1   1   14   14   LYS   H      H   .   .   .   1   1   14   14   LYS   HB3    H   .   .   .   .   .   3.13   0.0   3.13   .   .   .   .   .   A   .   14   LYS   H      .   .   A   .   14   LYS   HB3    .   .   .   14   .   HN     .   .   .   .   .   14   .   HB#    .   .   c30521_6mk4   1    
     322   2   OR   .   1   1   14   14   LYS   H      H   .   .   .   1   1   14   14   LYS   HB2    H   .   .   .   .   .   3.13   0.0   3.13   .   .   .   .   .   A   .   14   LYS   H      .   .   A   .   14   LYS   HB2    .   .   .   14   .   HN     .   .   .   .   .   14   .   HB#    .   .   c30521_6mk4   1    
     323   1   OR   .   1   1   15   15   CYS   H      H   .   .   .   1   1   14   14   LYS   HB3    H   .   .   .   .   .   3.45   0.0   3.45   .   .   .   .   .   A   .   15   CYS   H      .   .   A   .   14   LYS   HB3    .   .   .   15   .   HN     .   .   .   .   .   14   .   HB#    .   .   c30521_6mk4   1    
     323   2   OR   .   1   1   15   15   CYS   H      H   .   .   .   1   1   14   14   LYS   HB2    H   .   .   .   .   .   3.45   0.0   3.45   .   .   .   .   .   A   .   15   CYS   H      .   .   A   .   14   LYS   HB2    .   .   .   15   .   HN     .   .   .   .   .   14   .   HB#    .   .   c30521_6mk4   1    
     324   1   OR   .   1   1   15   15   CYS   H      H   .   .   .   1   1   15   15   CYS   HB3    H   .   .   .   .   .   3.12   0.0   3.12   .   .   .   .   .   A   .   15   CYS   H      .   .   A   .   15   CYS   HB3    .   .   .   15   .   HN     .   .   .   .   .   15   .   HB#    .   .   c30521_6mk4   1    
     324   2   OR   .   1   1   15   15   CYS   H      H   .   .   .   1   1   15   15   CYS   HB2    H   .   .   .   .   .   3.12   0.0   3.12   .   .   .   .   .   A   .   15   CYS   H      .   .   A   .   15   CYS   HB2    .   .   .   15   .   HN     .   .   .   .   .   15   .   HB#    .   .   c30521_6mk4   1    
     325   1   OR   .   1   1   16   16   CYS   H      H   .   .   .   1   1   15   15   CYS   HB3    H   .   .   .   .   .   3.48   0.0   3.48   .   .   .   .   .   A   .   16   CYS   H      .   .   A   .   15   CYS   HB3    .   .   .   16   .   HN     .   .   .   .   .   15   .   HB#    .   .   c30521_6mk4   1    
     325   2   OR   .   1   1   16   16   CYS   H      H   .   .   .   1   1   15   15   CYS   HB2    H   .   .   .   .   .   3.48   0.0   3.48   .   .   .   .   .   A   .   16   CYS   H      .   .   A   .   15   CYS   HB2    .   .   .   16   .   HN     .   .   .   .   .   15   .   HB#    .   .   c30521_6mk4   1    
     326   1   OR   .   1   1   16   16   CYS   H      H   .   .   .   1   1   16   16   CYS   HB3    H   .   .   .   .   .   3.20   0.0   3.20   .   .   .   .   .   A   .   16   CYS   H      .   .   A   .   16   CYS   HB3    .   .   .   16   .   HN     .   .   .   .   .   16   .   HB#    .   .   c30521_6mk4   1    
     326   2   OR   .   1   1   16   16   CYS   H      H   .   .   .   1   1   16   16   CYS   HB2    H   .   .   .   .   .   3.20   0.0   3.20   .   .   .   .   .   A   .   16   CYS   H      .   .   A   .   16   CYS   HB2    .   .   .   16   .   HN     .   .   .   .   .   16   .   HB#    .   .   c30521_6mk4   1    
     327   1   OR   .   1   1   17   17   LYS   H      H   .   .   .   1   1   16   16   CYS   HB3    H   .   .   .   .   .   3.14   0.0   3.14   .   .   .   .   .   A   .   17   LYS   H      .   .   A   .   16   CYS   HB3    .   .   .   17   .   HN     .   .   .   .   .   16   .   HB#    .   .   c30521_6mk4   1    
     327   2   OR   .   1   1   17   17   LYS   H      H   .   .   .   1   1   16   16   CYS   HB2    H   .   .   .   .   .   3.14   0.0   3.14   .   .   .   .   .   A   .   17   LYS   H      .   .   A   .   16   CYS   HB2    .   .   .   17   .   HN     .   .   .   .   .   16   .   HB#    .   .   c30521_6mk4   1    
     328   1   OR   .   1   1   17   17   LYS   H      H   .   .   .   1   1   17   17   LYS   HB3    H   .   .   .   .   .   3.14   0.0   3.14   .   .   .   .   .   A   .   17   LYS   H      .   .   A   .   17   LYS   HB3    .   .   .   17   .   HN     .   .   .   .   .   17   .   HB#    .   .   c30521_6mk4   1    
     328   2   OR   .   1   1   17   17   LYS   H      H   .   .   .   1   1   17   17   LYS   HB2    H   .   .   .   .   .   3.14   0.0   3.14   .   .   .   .   .   A   .   17   LYS   H      .   .   A   .   17   LYS   HB2    .   .   .   17   .   HN     .   .   .   .   .   17   .   HB#    .   .   c30521_6mk4   1    
     329   1   OR   .   1   1   17   17   LYS   H      H   .   .   .   1   1   17   17   LYS   HG3    H   .   .   .   .   .   5.17   0.0   5.17   .   .   .   .   .   A   .   17   LYS   H      .   .   A   .   17   LYS   HG3    .   .   .   17   .   HN     .   .   .   .   .   17   .   HG#    .   .   c30521_6mk4   1    
     329   2   OR   .   1   1   17   17   LYS   H      H   .   .   .   1   1   17   17   LYS   HG2    H   .   .   .   .   .   5.17   0.0   5.17   .   .   .   .   .   A   .   17   LYS   H      .   .   A   .   17   LYS   HG2    .   .   .   17   .   HN     .   .   .   .   .   17   .   HG#    .   .   c30521_6mk4   1    
     330   1   OR   .   1   1   17   17   LYS   QZ     H   .   .   .   1   1   17   17   LYS   HB3    H   .   .   .   .   .   4.74   0.0   4.74   .   .   .   .   .   A   .   17   LYS   QZ     .   .   A   .   17   LYS   HB3    .   .   .   17   .   QZ     .   .   .   .   .   17   .   HB#    .   .   c30521_6mk4   1    
     330   2   OR   .   1   1   17   17   LYS   QZ     H   .   .   .   1   1   17   17   LYS   HB2    H   .   .   .   .   .   4.74   0.0   4.74   .   .   .   .   .   A   .   17   LYS   QZ     .   .   A   .   17   LYS   HB2    .   .   .   17   .   QZ     .   .   .   .   .   17   .   HB#    .   .   c30521_6mk4   1    
     331   1   OR   .   1   1   18   18   GLY   H      H   .   .   .   1   1   17   17   LYS   HB3    H   .   .   .   .   .   3.98   0.0   3.98   .   .   .   .   .   A   .   18   GLY   H      .   .   A   .   17   LYS   HB3    .   .   .   18   .   HN     .   .   .   .   .   17   .   HB#    .   .   c30521_6mk4   1    
     331   2   OR   .   1   1   18   18   GLY   H      H   .   .   .   1   1   17   17   LYS   HB2    H   .   .   .   .   .   3.98   0.0   3.98   .   .   .   .   .   A   .   18   GLY   H      .   .   A   .   17   LYS   HB2    .   .   .   18   .   HN     .   .   .   .   .   17   .   HB#    .   .   c30521_6mk4   1    
     332   1   OR   .   1   1   17   17   LYS   QZ     H   .   .   .   1   1   17   17   LYS   HG3    H   .   .   .   .   .   4.36   0.0   4.36   .   .   .   .   .   A   .   17   LYS   QZ     .   .   A   .   17   LYS   HG3    .   .   .   17   .   QZ     .   .   .   .   .   17   .   HG#    .   .   c30521_6mk4   1    
     332   2   OR   .   1   1   17   17   LYS   QZ     H   .   .   .   1   1   17   17   LYS   HG2    H   .   .   .   .   .   4.36   0.0   4.36   .   .   .   .   .   A   .   17   LYS   QZ     .   .   A   .   17   LYS   HG2    .   .   .   17   .   QZ     .   .   .   .   .   17   .   HG#    .   .   c30521_6mk4   1    
     333   1   OR   .   1   1   18   18   GLY   H      H   .   .   .   1   1   17   17   LYS   HG3    H   .   .   .   .   .   4.04   0.0   4.04   .   .   .   .   .   A   .   18   GLY   H      .   .   A   .   17   LYS   HG3    .   .   .   18   .   HN     .   .   .   .   .   17   .   HG#    .   .   c30521_6mk4   1    
     333   2   OR   .   1   1   18   18   GLY   H      H   .   .   .   1   1   17   17   LYS   HG2    H   .   .   .   .   .   4.04   0.0   4.04   .   .   .   .   .   A   .   18   GLY   H      .   .   A   .   17   LYS   HG2    .   .   .   18   .   HN     .   .   .   .   .   17   .   HG#    .   .   c30521_6mk4   1    
     334   1   OR   .   1   1   19   19   MET   HA     H   .   .   .   1   1   20   20   VAL   MG1    H   .   .   .   .   .   4.78   0.0   4.78   .   .   .   .   .   A   .   19   MET   HA     .   .   A   .   20   VAL   MG1    .   .   .   19   .   HA     .   .   .   .   .   20   .   HG##   .   .   c30521_6mk4   1    
     334   2   OR   .   1   1   19   19   MET   HA     H   .   .   .   1   1   20   20   VAL   MG2    H   .   .   .   .   .   4.78   0.0   4.78   .   .   .   .   .   A   .   19   MET   HA     .   .   A   .   20   VAL   MG2    .   .   .   19   .   HA     .   .   .   .   .   20   .   HG##   .   .   c30521_6mk4   1    
     335   1   OR   .   1   1   20   20   VAL   H      H   .   .   .   1   1   20   20   VAL   MG1    H   .   .   .   .   .   3.42   0.0   3.42   .   .   .   .   .   A   .   20   VAL   H      .   .   A   .   20   VAL   MG1    .   .   .   20   .   HN     .   .   .   .   .   20   .   HG##   .   .   c30521_6mk4   1    
     335   2   OR   .   1   1   20   20   VAL   H      H   .   .   .   1   1   20   20   VAL   MG2    H   .   .   .   .   .   3.42   0.0   3.42   .   .   .   .   .   A   .   20   VAL   H      .   .   A   .   20   VAL   MG2    .   .   .   20   .   HN     .   .   .   .   .   20   .   HG##   .   .   c30521_6mk4   1    
     336   1   OR   .   1   1   20   20   VAL   H      H   .   .   .   1   1   26   26   LYS   HB3    H   .   .   .   .   .   4.48   0.0   4.48   .   .   .   .   .   A   .   20   VAL   H      .   .   A   .   26   LYS   HB3    .   .   .   20   .   HN     .   .   .   .   .   26   .   HB#    .   .   c30521_6mk4   1    
     336   2   OR   .   1   1   20   20   VAL   H      H   .   .   .   1   1   26   26   LYS   HB2    H   .   .   .   .   .   4.48   0.0   4.48   .   .   .   .   .   A   .   20   VAL   H      .   .   A   .   26   LYS   HB2    .   .   .   20   .   HN     .   .   .   .   .   26   .   HB#    .   .   c30521_6mk4   1    
     337   1   OR   .   1   1   21   21   CYS   H      H   .   .   .   1   1   20   20   VAL   MG1    H   .   .   .   .   .   3.78   0.0   3.78   .   .   .   .   .   A   .   21   CYS   H      .   .   A   .   20   VAL   MG1    .   .   .   21   .   HN     .   .   .   .   .   20   .   HG##   .   .   c30521_6mk4   1    
     337   2   OR   .   1   1   21   21   CYS   H      H   .   .   .   1   1   20   20   VAL   MG2    H   .   .   .   .   .   3.78   0.0   3.78   .   .   .   .   .   A   .   21   CYS   H      .   .   A   .   20   VAL   MG2    .   .   .   21   .   HN     .   .   .   .   .   20   .   HG##   .   .   c30521_6mk4   1    
     338   1   OR   .   1   1   21   21   CYS   HA     H   .   .   .   1   1   20   20   VAL   MG1    H   .   .   .   .   .   4.66   0.0   4.66   .   .   .   .   .   A   .   21   CYS   HA     .   .   A   .   20   VAL   MG1    .   .   .   21   .   HA     .   .   .   .   .   20   .   HG##   .   .   c30521_6mk4   1    
     338   2   OR   .   1   1   20   20   VAL   MG2    H   .   .   .   1   1   21   21   CYS   HA     H   .   .   .   .   .   4.66   0.0   4.66   .   .   .   .   .   A   .   20   VAL   MG2    .   .   A   .   21   CYS   HA     .   .   .   20   .   HG##   .   .   .   .   .   21   .   HA     .   .   c30521_6mk4   1    
     339   1   OR   .   1   1   22   22   ARG   H      H   .   .   .   1   1   20   20   VAL   MG1    H   .   .   .   .   .   4.61   0.0   4.61   .   .   .   .   .   A   .   22   ARG   H      .   .   A   .   20   VAL   MG1    .   .   .   22   .   HN     .   .   .   .   .   20   .   HG##   .   .   c30521_6mk4   1    
     339   2   OR   .   1   1   22   22   ARG   H      H   .   .   .   1   1   20   20   VAL   MG2    H   .   .   .   .   .   4.61   0.0   4.61   .   .   .   .   .   A   .   22   ARG   H      .   .   A   .   20   VAL   MG2    .   .   .   22   .   HN     .   .   .   .   .   20   .   HG##   .   .   c30521_6mk4   1    
     340   1   OR   .   1   1   26   26   LYS   H      H   .   .   .   1   1   20   20   VAL   MG1    H   .   .   .   .   .   4.38   0.0   4.38   .   .   .   .   .   A   .   26   LYS   H      .   .   A   .   20   VAL   MG1    .   .   .   26   .   HN     .   .   .   .   .   20   .   HG##   .   .   c30521_6mk4   1    
     340   2   OR   .   1   1   26   26   LYS   H      H   .   .   .   1   1   20   20   VAL   MG2    H   .   .   .   .   .   4.38   0.0   4.38   .   .   .   .   .   A   .   26   LYS   H      .   .   A   .   20   VAL   MG2    .   .   .   26   .   HN     .   .   .   .   .   20   .   HG##   .   .   c30521_6mk4   1    
     341   1   OR   .   1   1   21   21   CYS   H      H   .   .   .   1   1   21   21   CYS   HB3    H   .   .   .   .   .   2.99   0.0   2.99   .   .   .   .   .   A   .   21   CYS   H      .   .   A   .   21   CYS   HB3    .   .   .   21   .   HN     .   .   .   .   .   21   .   HB#    .   .   c30521_6mk4   1    
     341   2   OR   .   1   1   21   21   CYS   H      H   .   .   .   1   1   21   21   CYS   HB2    H   .   .   .   .   .   2.99   0.0   2.99   .   .   .   .   .   A   .   21   CYS   H      .   .   A   .   21   CYS   HB2    .   .   .   21   .   HN     .   .   .   .   .   21   .   HB#    .   .   c30521_6mk4   1    
     342   1   OR   .   1   1   22   22   ARG   H      H   .   .   .   1   1   22   22   ARG   HB3    H   .   .   .   .   .   3.32   0.0   3.32   .   .   .   .   .   A   .   22   ARG   H      .   .   A   .   22   ARG   HB3    .   .   .   22   .   HN     .   .   .   .   .   22   .   HB#    .   .   c30521_6mk4   1    
     342   2   OR   .   1   1   22   22   ARG   H      H   .   .   .   1   1   22   22   ARG   HB2    H   .   .   .   .   .   3.32   0.0   3.32   .   .   .   .   .   A   .   22   ARG   H      .   .   A   .   22   ARG   HB2    .   .   .   22   .   HN     .   .   .   .   .   22   .   HB#    .   .   c30521_6mk4   1    
     343   1   OR   .   1   1   22   22   ARG   HA     H   .   .   .   1   1   22   22   ARG   HD3    H   .   .   .   .   .   3.80   0.0   3.80   .   .   .   .   .   A   .   22   ARG   HA     .   .   A   .   22   ARG   HD3    .   .   .   22   .   HA     .   .   .   .   .   22   .   HD#    .   .   c30521_6mk4   1    
     343   2   OR   .   1   1   22   22   ARG   HA     H   .   .   .   1   1   22   22   ARG   HD2    H   .   .   .   .   .   3.80   0.0   3.80   .   .   .   .   .   A   .   22   ARG   HA     .   .   A   .   22   ARG   HD2    .   .   .   22   .   HA     .   .   .   .   .   22   .   HD#    .   .   c30521_6mk4   1    
     344   1   OR   .   1   1   22   22   ARG   HE     H   .   .   .   1   1   22   22   ARG   HB3    H   .   .   .   .   .   3.96   0.0   3.96   .   .   .   .   .   A   .   22   ARG   HE     .   .   A   .   22   ARG   HB3    .   .   .   22   .   HE     .   .   .   .   .   22   .   HB#    .   .   c30521_6mk4   1    
     344   2   OR   .   1   1   22   22   ARG   HE     H   .   .   .   1   1   22   22   ARG   HB2    H   .   .   .   .   .   3.96   0.0   3.96   .   .   .   .   .   A   .   22   ARG   HE     .   .   A   .   22   ARG   HB2    .   .   .   22   .   HE     .   .   .   .   .   22   .   HB#    .   .   c30521_6mk4   1    
     345   1   OR   .   1   1   23   23   LEU   H      H   .   .   .   1   1   22   22   ARG   HB3    H   .   .   .   .   .   4.22   0.0   4.22   .   .   .   .   .   A   .   23   LEU   H      .   .   A   .   22   ARG   HB3    .   .   .   23   .   HN     .   .   .   .   .   22   .   HB#    .   .   c30521_6mk4   1    
     345   2   OR   .   1   1   23   23   LEU   H      H   .   .   .   1   1   22   22   ARG   HB2    H   .   .   .   .   .   4.22   0.0   4.22   .   .   .   .   .   A   .   23   LEU   H      .   .   A   .   22   ARG   HB2    .   .   .   23   .   HN     .   .   .   .   .   22   .   HB#    .   .   c30521_6mk4   1    
     346   1   OR   .   1   1   23   23   LEU   H      H   .   .   .   1   1   23   23   LEU   HB3    H   .   .   .   .   .   3.39   0.0   3.39   .   .   .   .   .   A   .   23   LEU   H      .   .   A   .   23   LEU   HB3    .   .   .   23   .   HN     .   .   .   .   .   23   .   HB#    .   .   c30521_6mk4   1    
     346   2   OR   .   1   1   23   23   LEU   H      H   .   .   .   1   1   23   23   LEU   HB2    H   .   .   .   .   .   3.39   0.0   3.39   .   .   .   .   .   A   .   23   LEU   H      .   .   A   .   23   LEU   HB2    .   .   .   23   .   HN     .   .   .   .   .   23   .   HB#    .   .   c30521_6mk4   1    
     347   1   OR   .   1   1   23   23   LEU   H      H   .   .   .   1   1   23   23   LEU   MD2    H   .   .   .   .   .   3.89   0.0   3.89   .   .   .   .   .   A   .   23   LEU   H      .   .   A   .   23   LEU   MD2    .   .   .   23   .   HN     .   .   .   .   .   23   .   HD##   .   .   c30521_6mk4   1    
     347   2   OR   .   1   1   23   23   LEU   H      H   .   .   .   1   1   23   23   LEU   MD1    H   .   .   .   .   .   3.89   0.0   3.89   .   .   .   .   .   A   .   23   LEU   H      .   .   A   .   23   LEU   MD1    .   .   .   23   .   HN     .   .   .   .   .   23   .   HD##   .   .   c30521_6mk4   1    
     348   1   OR   .   1   1   23   23   LEU   HA     H   .   .   .   1   1   23   23   LEU   MD2    H   .   .   .   .   .   3.45   0.0   3.45   .   .   .   .   .   A   .   23   LEU   HA     .   .   A   .   23   LEU   MD2    .   .   .   23   .   HA     .   .   .   .   .   23   .   HD##   .   .   c30521_6mk4   1    
     348   2   OR   .   1   1   23   23   LEU   HA     H   .   .   .   1   1   23   23   LEU   MD1    H   .   .   .   .   .   3.45   0.0   3.45   .   .   .   .   .   A   .   23   LEU   HA     .   .   A   .   23   LEU   MD1    .   .   .   23   .   HA     .   .   .   .   .   23   .   HD##   .   .   c30521_6mk4   1    
     349   1   OR   .   1   1   24   24   TRP   HE3    H   .   .   .   1   1   23   23   LEU   HB3    H   .   .   .   .   .   4.03   0.0   4.03   .   .   .   .   .   A   .   24   TRP   HE3    .   .   A   .   23   LEU   HB3    .   .   .   24   .   HE3    .   .   .   .   .   23   .   HB#    .   .   c30521_6mk4   1    
     349   2   OR   .   1   1   24   24   TRP   HE3    H   .   .   .   1   1   23   23   LEU   HB2    H   .   .   .   .   .   4.03   0.0   4.03   .   .   .   .   .   A   .   24   TRP   HE3    .   .   A   .   23   LEU   HB2    .   .   .   24   .   HE3    .   .   .   .   .   23   .   HB#    .   .   c30521_6mk4   1    
     350   1   OR   .   1   1   24   24   TRP   HZ3    H   .   .   .   1   1   23   23   LEU   HB3    H   .   .   .   .   .   4.72   0.0   4.72   .   .   .   .   .   A   .   24   TRP   HZ3    .   .   A   .   23   LEU   HB3    .   .   .   24   .   HZ3    .   .   .   .   .   23   .   HB#    .   .   c30521_6mk4   1    
     350   2   OR   .   1   1   23   23   LEU   HB2    H   .   .   .   1   1   24   24   TRP   HZ3    H   .   .   .   .   .   4.72   0.0   4.72   .   .   .   .   .   A   .   23   LEU   HB2    .   .   A   .   24   TRP   HZ3    .   .   .   23   .   HB#    .   .   .   .   .   24   .   HZ3    .   .   c30521_6mk4   1    
     351   1   OR   .   1   1   24   24   TRP   H      H   .   .   .   1   1   23   23   LEU   MD2    H   .   .   .   .   .   4.99   0.0   4.99   .   .   .   .   .   A   .   24   TRP   H      .   .   A   .   23   LEU   MD2    .   .   .   24   .   HN     .   .   .   .   .   23   .   HD##   .   .   c30521_6mk4   1    
     351   2   OR   .   1   1   24   24   TRP   H      H   .   .   .   1   1   23   23   LEU   MD1    H   .   .   .   .   .   4.99   0.0   4.99   .   .   .   .   .   A   .   24   TRP   H      .   .   A   .   23   LEU   MD1    .   .   .   24   .   HN     .   .   .   .   .   23   .   HD##   .   .   c30521_6mk4   1    
     352   1   OR   .   1   1   24   24   TRP   HE3    H   .   .   .   1   1   23   23   LEU   MD2    H   .   .   .   .   .   4.41   0.0   4.41   .   .   .   .   .   A   .   24   TRP   HE3    .   .   A   .   23   LEU   MD2    .   .   .   24   .   HE3    .   .   .   .   .   23   .   HD##   .   .   c30521_6mk4   1    
     352   2   OR   .   1   1   24   24   TRP   HE3    H   .   .   .   1   1   23   23   LEU   MD1    H   .   .   .   .   .   4.41   0.0   4.41   .   .   .   .   .   A   .   24   TRP   HE3    .   .   A   .   23   LEU   MD1    .   .   .   24   .   HE3    .   .   .   .   .   23   .   HD##   .   .   c30521_6mk4   1    
     353   1   OR   .   1   1   24   24   TRP   HZ3    H   .   .   .   1   1   23   23   LEU   MD2    H   .   .   .   .   .   3.98   0.0   3.98   .   .   .   .   .   A   .   24   TRP   HZ3    .   .   A   .   23   LEU   MD2    .   .   .   24   .   HZ3    .   .   .   .   .   23   .   HD##   .   .   c30521_6mk4   1    
     353   2   OR   .   1   1   23   23   LEU   MD1    H   .   .   .   1   1   24   24   TRP   HZ3    H   .   .   .   .   .   3.98   0.0   3.98   .   .   .   .   .   A   .   23   LEU   MD1    .   .   A   .   24   TRP   HZ3    .   .   .   23   .   HD##   .   .   .   .   .   24   .   HZ3    .   .   c30521_6mk4   1    
     354   1   OR   .   1   1   24   24   TRP   HE1    H   .   .   .   1   1   26   26   LYS   HB3    H   .   .   .   .   .   4.88   0.0   4.88   .   .   .   .   .   A   .   24   TRP   HE1    .   .   A   .   26   LYS   HB3    .   .   .   24   .   HE1    .   .   .   .   .   26   .   HB#    .   .   c30521_6mk4   1    
     354   2   OR   .   1   1   24   24   TRP   HE1    H   .   .   .   1   1   26   26   LYS   HB2    H   .   .   .   .   .   4.88   0.0   4.88   .   .   .   .   .   A   .   24   TRP   HE1    .   .   A   .   26   LYS   HB2    .   .   .   24   .   HE1    .   .   .   .   .   26   .   HB#    .   .   c30521_6mk4   1    
     355   1   OR   .   1   1   25   25   CYS   H      H   .   .   .   1   1   25   25   CYS   HB3    H   .   .   .   .   .   3.11   0.0   3.11   .   .   .   .   .   A   .   25   CYS   H      .   .   A   .   25   CYS   HB3    .   .   .   25   .   HN     .   .   .   .   .   25   .   HB#    .   .   c30521_6mk4   1    
     355   2   OR   .   1   1   25   25   CYS   H      H   .   .   .   1   1   25   25   CYS   HB2    H   .   .   .   .   .   3.11   0.0   3.11   .   .   .   .   .   A   .   25   CYS   H      .   .   A   .   25   CYS   HB2    .   .   .   25   .   HN     .   .   .   .   .   25   .   HB#    .   .   c30521_6mk4   1    
     356   1   OR   .   1   1   26   26   LYS   H      H   .   .   .   1   1   25   25   CYS   HB3    H   .   .   .   .   .   4.02   0.0   4.02   .   .   .   .   .   A   .   26   LYS   H      .   .   A   .   25   CYS   HB3    .   .   .   26   .   HN     .   .   .   .   .   25   .   HB#    .   .   c30521_6mk4   1    
     356   2   OR   .   1   1   26   26   LYS   H      H   .   .   .   1   1   25   25   CYS   HB2    H   .   .   .   .   .   4.02   0.0   4.02   .   .   .   .   .   A   .   26   LYS   H      .   .   A   .   25   CYS   HB2    .   .   .   26   .   HN     .   .   .   .   .   25   .   HB#    .   .   c30521_6mk4   1    
     357   1   OR   .   1   1   26   26   LYS   H      H   .   .   .   1   1   26   26   LYS   HB3    H   .   .   .   .   .   3.33   0.0   3.33   .   .   .   .   .   A   .   26   LYS   H      .   .   A   .   26   LYS   HB3    .   .   .   26   .   HN     .   .   .   .   .   26   .   HB#    .   .   c30521_6mk4   1    
     357   2   OR   .   1   1   26   26   LYS   H      H   .   .   .   1   1   26   26   LYS   HB2    H   .   .   .   .   .   3.33   0.0   3.33   .   .   .   .   .   A   .   26   LYS   H      .   .   A   .   26   LYS   HB2    .   .   .   26   .   HN     .   .   .   .   .   26   .   HB#    .   .   c30521_6mk4   1    
     358   1   OR   .   1   1   26   26   LYS   QZ     H   .   .   .   1   1   26   26   LYS   HB3    H   .   .   .   .   .   4.52   0.0   4.52   .   .   .   .   .   A   .   26   LYS   QZ     .   .   A   .   26   LYS   HB3    .   .   .   26   .   QZ     .   .   .   .   .   26   .   HB#    .   .   c30521_6mk4   1    
     358   2   OR   .   1   1   26   26   LYS   QZ     H   .   .   .   1   1   26   26   LYS   HB2    H   .   .   .   .   .   4.52   0.0   4.52   .   .   .   .   .   A   .   26   LYS   QZ     .   .   A   .   26   LYS   HB2    .   .   .   26   .   QZ     .   .   .   .   .   26   .   HB#    .   .   c30521_6mk4   1    
     359   1   OR   .   1   1   27   27   LYS   H      H   .   .   .   1   1   26   26   LYS   HB3    H   .   .   .   .   .   3.90   0.0   3.90   .   .   .   .   .   A   .   27   LYS   H      .   .   A   .   26   LYS   HB3    .   .   .   27   .   HN     .   .   .   .   .   26   .   HB#    .   .   c30521_6mk4   1    
     359   2   OR   .   1   1   27   27   LYS   H      H   .   .   .   1   1   26   26   LYS   HB2    H   .   .   .   .   .   3.90   0.0   3.90   .   .   .   .   .   A   .   27   LYS   H      .   .   A   .   26   LYS   HB2    .   .   .   27   .   HN     .   .   .   .   .   26   .   HB#    .   .   c30521_6mk4   1    
     360   1   OR   .   1   1   27   27   LYS   H      H   .   .   .   1   1   27   27   LYS   HB3    H   .   .   .   .   .   3.14   0.0   3.14   .   .   .   .   .   A   .   27   LYS   H      .   .   A   .   27   LYS   HB3    .   .   .   27   .   HN     .   .   .   .   .   27   .   HB#    .   .   c30521_6mk4   1    
     360   2   OR   .   1   1   27   27   LYS   H      H   .   .   .   1   1   27   27   LYS   HB2    H   .   .   .   .   .   3.14   0.0   3.14   .   .   .   .   .   A   .   27   LYS   H      .   .   A   .   27   LYS   HB2    .   .   .   27   .   HN     .   .   .   .   .   27   .   HB#    .   .   c30521_6mk4   1    
     361   1   OR   .   1   1   27   27   LYS   H      H   .   .   .   1   1   27   27   LYS   HG3    H   .   .   .   .   .   3.57   0.0   3.57   .   .   .   .   .   A   .   27   LYS   H      .   .   A   .   27   LYS   HG3    .   .   .   27   .   HN     .   .   .   .   .   27   .   HG#    .   .   c30521_6mk4   1    
     361   2   OR   .   1   1   27   27   LYS   H      H   .   .   .   1   1   27   27   LYS   HG2    H   .   .   .   .   .   3.57   0.0   3.57   .   .   .   .   .   A   .   27   LYS   H      .   .   A   .   27   LYS   HG2    .   .   .   27   .   HN     .   .   .   .   .   27   .   HG#    .   .   c30521_6mk4   1    
     362   1   OR   .   1   1   27   27   LYS   HA     H   .   .   .   1   1   27   27   LYS   HG3    H   .   .   .   .   .   3.61   0.0   3.61   .   .   .   .   .   A   .   27   LYS   HA     .   .   A   .   27   LYS   HG3    .   .   .   27   .   HA     .   .   .   .   .   27   .   HG#    .   .   c30521_6mk4   1    
     362   2   OR   .   1   1   27   27   LYS   HA     H   .   .   .   1   1   27   27   LYS   HG2    H   .   .   .   .   .   3.61   0.0   3.61   .   .   .   .   .   A   .   27   LYS   HA     .   .   A   .   27   LYS   HG2    .   .   .   27   .   HA     .   .   .   .   .   27   .   HG#    .   .   c30521_6mk4   1    
     363   1   OR   .   1   1   28   28   LYS   H      H   .   .   .   1   1   27   27   LYS   HG3    H   .   .   .   .   .   4.06   0.0   4.06   .   .   .   .   .   A   .   28   LYS   H      .   .   A   .   27   LYS   HG3    .   .   .   28   .   HN     .   .   .   .   .   27   .   HG#    .   .   c30521_6mk4   1    
     363   2   OR   .   1   1   28   28   LYS   H      H   .   .   .   1   1   27   27   LYS   HG2    H   .   .   .   .   .   4.06   0.0   4.06   .   .   .   .   .   A   .   28   LYS   H      .   .   A   .   27   LYS   HG2    .   .   .   28   .   HN     .   .   .   .   .   27   .   HG#    .   .   c30521_6mk4   1    
     364   1   OR   .   1   1   29   29   LEU   H      H   .   .   .   1   1   29   29   LEU   MD2    H   .   .   .   .   .   4.00   0.0   4.00   .   .   .   .   .   A   .   29   LEU   H      .   .   A   .   29   LEU   MD2    .   .   .   29   .   HN     .   .   .   .   .   29   .   HD##   .   .   c30521_6mk4   1    
     364   2   OR   .   1   1   29   29   LEU   H      H   .   .   .   1   1   29   29   LEU   MD1    H   .   .   .   .   .   4.00   0.0   4.00   .   .   .   .   .   A   .   29   LEU   H      .   .   A   .   29   LEU   MD1    .   .   .   29   .   HN     .   .   .   .   .   29   .   HD##   .   .   c30521_6mk4   1    
     365   1   OR   .   1   1   29   29   LEU   HA     H   .   .   .   1   1   29   29   LEU   MD2    H   .   .   .   .   .   3.68   0.0   3.68   .   .   .   .   .   A   .   29   LEU   HA     .   .   A   .   29   LEU   MD2    .   .   .   29   .   HA     .   .   .   .   .   29   .   HD##   .   .   c30521_6mk4   1    
     365   2   OR   .   1   1   29   29   LEU   HA     H   .   .   .   1   1   29   29   LEU   MD1    H   .   .   .   .   .   3.68   0.0   3.68   .   .   .   .   .   A   .   29   LEU   HA     .   .   A   .   29   LEU   MD1    .   .   .   29   .   HA     .   .   .   .   .   29   .   HD##   .   .   c30521_6mk4   1    
     366   1   OR   .   1   1   30   30   TRP   H      H   .   .   .   1   1   29   29   LEU   MD2    H   .   .   .   .   .   4.50   0.0   4.50   .   .   .   .   .   A   .   30   TRP   H      .   .   A   .   29   LEU   MD2    .   .   .   30   .   HN     .   .   .   .   .   29   .   HD##   .   .   c30521_6mk4   1    
     366   2   OR   .   1   1   30   30   TRP   H      H   .   .   .   1   1   29   29   LEU   MD1    H   .   .   .   .   .   4.50   0.0   4.50   .   .   .   .   .   A   .   30   TRP   H      .   .   A   .   29   LEU   MD1    .   .   .   30   .   HN     .   .   .   .   .   29   .   HD##   .   .   c30521_6mk4   1    

   stop_

   loop_
      _Gen_dist_constraint_comment_org.ID
      _Gen_dist_constraint_comment_org.Comment_text
      _Gen_dist_constraint_comment_org.Comment_begin_line
      _Gen_dist_constraint_comment_org.Comment_begin_column
      _Gen_dist_constraint_comment_org.Comment_end_line
      _Gen_dist_constraint_comment_org.Comment_end_column
      _Gen_dist_constraint_comment_org.Entry_ID
      _Gen_dist_constraint_comment_org.Gen_dist_constraint_list_ID

     1   'Distance restraints'   2   1   2   21   c30521_6mk4   1    

   stop_

   loop_
      _Gen_dist_constraint_parse_err.ID
      _Gen_dist_constraint_parse_err.Content
      _Gen_dist_constraint_parse_err.Begin_line
      _Gen_dist_constraint_parse_err.Begin_column
      _Gen_dist_constraint_parse_err.End_line
      _Gen_dist_constraint_parse_err.End_column
      _Gen_dist_constraint_parse_err.Entry_ID
      _Gen_dist_constraint_parse_err.Gen_dist_constraint_list_ID

     1   '# Restraints file 1: restraints.tbl'   1   1   1   35   c30521_6mk4   1    

   stop_

save_

save_CNS/XPLOR_distance_constraints_4
   _Gen_dist_constraint_list.Sf_category         general_distance_constraints
   _Gen_dist_constraint_list.Sf_framecode        CNS/XPLOR_distance_constraints_4
   _Gen_dist_constraint_list.Entry_ID            c30521_6mk4
   _Gen_dist_constraint_list.ID                  2
   _Gen_dist_constraint_list.Constraint_type     'hydrogen bond'
   _Gen_dist_constraint_list.Details             'Generated by Wattos'
   _Gen_dist_constraint_list.Constraint_file_ID  1
   _Gen_dist_constraint_list.Block_ID            4

   loop_
      _Gen_dist_constraint_software.Software_ID
      _Gen_dist_constraint_software.Software_label
      _Gen_dist_constraint_software.Method_ID
      _Gen_dist_constraint_software.Method_label
      _Gen_dist_constraint_software.Entry_ID
      _Gen_dist_constraint_software.Gen_dist_constraint_list_ID

     .   .   .   .   c30521_6mk4   2    

   stop_

   loop_
      _Gen_dist_constraint.ID
      _Gen_dist_constraint.Member_ID
      _Gen_dist_constraint.Member_logic_code
      _Gen_dist_constraint.Assembly_atom_ID_1
      _Gen_dist_constraint.Entity_assembly_ID_1
      _Gen_dist_constraint.Entity_ID_1
      _Gen_dist_constraint.Comp_index_ID_1
      _Gen_dist_constraint.Seq_ID_1
      _Gen_dist_constraint.Comp_ID_1
      _Gen_dist_constraint.Atom_ID_1
      _Gen_dist_constraint.Atom_type_1
      _Gen_dist_constraint.Atom_isotope_number_1
      _Gen_dist_constraint.Resonance_ID_1
      _Gen_dist_constraint.Assembly_atom_ID_2
      _Gen_dist_constraint.Entity_assembly_ID_2
      _Gen_dist_constraint.Entity_ID_2
      _Gen_dist_constraint.Comp_index_ID_2
      _Gen_dist_constraint.Seq_ID_2
      _Gen_dist_constraint.Comp_ID_2
      _Gen_dist_constraint.Atom_ID_2
      _Gen_dist_constraint.Atom_type_2
      _Gen_dist_constraint.Atom_isotope_number_2
      _Gen_dist_constraint.Resonance_ID_2
      _Gen_dist_constraint.Intensity_val
      _Gen_dist_constraint.Intensity_lower_val_err
      _Gen_dist_constraint.Intensity_upper_val_err
      _Gen_dist_constraint.Distance_val
      _Gen_dist_constraint.Distance_lower_bound_val
      _Gen_dist_constraint.Distance_upper_bound_val
      _Gen_dist_constraint.Contribution_fractional_val
      _Gen_dist_constraint.Spectral_peak_ID
      _Gen_dist_constraint.Spectral_peak_list_ID
      _Gen_dist_constraint.PDB_record_ID_1
      _Gen_dist_constraint.PDB_model_num_1
      _Gen_dist_constraint.PDB_strand_ID_1
      _Gen_dist_constraint.PDB_ins_code_1
      _Gen_dist_constraint.PDB_residue_no_1
      _Gen_dist_constraint.PDB_residue_name_1
      _Gen_dist_constraint.PDB_atom_name_1
      _Gen_dist_constraint.PDB_record_ID_2
      _Gen_dist_constraint.PDB_model_num_2
      _Gen_dist_constraint.PDB_strand_ID_2
      _Gen_dist_constraint.PDB_ins_code_2
      _Gen_dist_constraint.PDB_residue_no_2
      _Gen_dist_constraint.PDB_residue_name_2
      _Gen_dist_constraint.PDB_atom_name_2
      _Gen_dist_constraint.Auth_entity_assembly_ID_1
      _Gen_dist_constraint.Auth_asym_ID_1
      _Gen_dist_constraint.Auth_chain_ID_1
      _Gen_dist_constraint.Auth_seq_ID_1
      _Gen_dist_constraint.Auth_comp_ID_1
      _Gen_dist_constraint.Auth_atom_ID_1
      _Gen_dist_constraint.Auth_alt_ID_1
      _Gen_dist_constraint.Auth_atom_name_1
      _Gen_dist_constraint.Auth_entity_assembly_ID_2
      _Gen_dist_constraint.Auth_asym_ID_2
      _Gen_dist_constraint.Auth_chain_ID_2
      _Gen_dist_constraint.Auth_seq_ID_2
      _Gen_dist_constraint.Auth_comp_ID_2
      _Gen_dist_constraint.Auth_atom_ID_2
      _Gen_dist_constraint.Auth_alt_ID_2
      _Gen_dist_constraint.Auth_atom_name_2
      _Gen_dist_constraint.Entry_ID
      _Gen_dist_constraint.Gen_dist_constraint_list_ID

     1    1   .   .   1   1   7    7    TRP   H   H   .   .   .   1   1   4    4    LYS   O   O   .   .   .   .   .   2.3   0.0   2.3   .   .   .   .   .   A   .   7    TRP   H   .   .   A   .   4    LYS   O   .   .   .   7    .   HN   .   .   .   .   .   4    .   O   .   .   c30521_6mk4   2    
     2    1   .   .   1   1   4    4    LYS   O   O   .   .   .   1   1   7    7    TRP   N   N   .   .   .   .   .   3.3   0.0   3.3   .   .   .   .   .   A   .   4    LYS   O   .   .   A   .   7    TRP   N   .   .   .   4    .   O    .   .   .   .   .   7    .   N   .   .   c30521_6mk4   2    
     3    1   .   .   1   1   26   26   LYS   H   H   .   .   .   1   1   20   20   VAL   O   O   .   .   .   .   .   2.3   0.0   2.3   .   .   .   .   .   A   .   26   LYS   H   .   .   A   .   20   VAL   O   .   .   .   26   .   HN   .   .   .   .   .   20   .   O   .   .   c30521_6mk4   2    
     4    1   .   .   1   1   20   20   VAL   O   O   .   .   .   1   1   26   26   LYS   N   N   .   .   .   .   .   3.3   0.0   3.3   .   .   .   .   .   A   .   20   VAL   O   .   .   A   .   26   LYS   N   .   .   .   20   .   O    .   .   .   .   .   26   .   N   .   .   c30521_6mk4   2    
     5    1   .   .   1   1   20   20   VAL   H   H   .   .   .   1   1   26   26   LYS   O   O   .   .   .   .   .   2.3   0.0   2.3   .   .   .   .   .   A   .   20   VAL   H   .   .   A   .   26   LYS   O   .   .   .   20   .   HN   .   .   .   .   .   26   .   O   .   .   c30521_6mk4   2    
     6    1   .   .   1   1   26   26   LYS   O   O   .   .   .   1   1   20   20   VAL   N   N   .   .   .   .   .   3.3   0.0   3.3   .   .   .   .   .   A   .   26   LYS   O   .   .   A   .   20   VAL   N   .   .   .   26   .   O    .   .   .   .   .   20   .   N   .   .   c30521_6mk4   2    
     7    1   .   .   1   1   9    9    CYS   H   H   .   .   .   1   1   22   22   ARG   O   O   .   .   .   .   .   2.3   0.0   2.3   .   .   .   .   .   A   .   9    CYS   H   .   .   A   .   22   ARG   O   .   .   .   9    .   HN   .   .   .   .   .   22   .   O   .   .   c30521_6mk4   2    
     8    1   .   .   1   1   22   22   ARG   O   O   .   .   .   1   1   9    9    CYS   N   N   .   .   .   .   .   3.3   0.0   3.3   .   .   .   .   .   A   .   22   ARG   O   .   .   A   .   9    CYS   N   .   .   .   22   .   O    .   .   .   .   .   9    .   N   .   .   c30521_6mk4   2    
     9    1   .   .   1   1   19   19   MET   H   H   .   .   .   1   1   16   16   CYS   O   O   .   .   .   .   .   2.3   0.0   2.3   .   .   .   .   .   A   .   19   MET   H   .   .   A   .   16   CYS   O   .   .   .   19   .   HN   .   .   .   .   .   16   .   O   .   .   c30521_6mk4   2    
     10   1   .   .   1   1   16   16   CYS   O   O   .   .   .   1   1   19   19   MET   N   N   .   .   .   .   .   3.3   0.0   3.3   .   .   .   .   .   A   .   16   CYS   O   .   .   A   .   19   MET   N   .   .   .   16   .   O    .   .   .   .   .   19   .   N   .   .   c30521_6mk4   2    

   stop_

   loop_
      _Gen_dist_constraint_comment_org.ID
      _Gen_dist_constraint_comment_org.Comment_text
      _Gen_dist_constraint_comment_org.Comment_begin_line
      _Gen_dist_constraint_comment_org.Comment_begin_column
      _Gen_dist_constraint_comment_org.Comment_end_line
      _Gen_dist_constraint_comment_org.Comment_end_column
      _Gen_dist_constraint_comment_org.Entry_ID
      _Gen_dist_constraint_comment_org.Gen_dist_constraint_list_ID

     1   'Hydrogen bonds'   1   1   1   16   c30521_6mk4   2    

   stop_

save_

save_CNS/XPLOR_dihedral_3
   _Torsion_angle_constraint_list.Sf_category         torsion_angle_constraints
   _Torsion_angle_constraint_list.Sf_framecode        CNS/XPLOR_dihedral_3
   _Torsion_angle_constraint_list.Entry_ID            c30521_6mk4
   _Torsion_angle_constraint_list.ID                  1
   _Torsion_angle_constraint_list.Details             'Generated by Wattos'
   _Torsion_angle_constraint_list.Constraint_file_ID  1
   _Torsion_angle_constraint_list.Block_ID            3

   loop_
      _Torsion_angle_constraint_software.Software_ID
      _Torsion_angle_constraint_software.Software_label
      _Torsion_angle_constraint_software.Method_ID
      _Torsion_angle_constraint_software.Method_label
      _Torsion_angle_constraint_software.Entry_ID
      _Torsion_angle_constraint_software.Torsion_angle_constraint_list_ID

     .   .   .   .   c30521_6mk4   1    

   stop_

   loop_
      _Torsion_angle_constraint.ID
      _Torsion_angle_constraint.Torsion_angle_name
      _Torsion_angle_constraint.Assembly_atom_ID_1
      _Torsion_angle_constraint.Entity_assembly_ID_1
      _Torsion_angle_constraint.Entity_ID_1
      _Torsion_angle_constraint.Comp_index_ID_1
      _Torsion_angle_constraint.Seq_ID_1
      _Torsion_angle_constraint.Comp_ID_1
      _Torsion_angle_constraint.Atom_ID_1
      _Torsion_angle_constraint.Atom_type_1
      _Torsion_angle_constraint.Resonance_ID_1
      _Torsion_angle_constraint.Assembly_atom_ID_2
      _Torsion_angle_constraint.Entity_assembly_ID_2
      _Torsion_angle_constraint.Entity_ID_2
      _Torsion_angle_constraint.Comp_index_ID_2
      _Torsion_angle_constraint.Seq_ID_2
      _Torsion_angle_constraint.Comp_ID_2
      _Torsion_angle_constraint.Atom_ID_2
      _Torsion_angle_constraint.Atom_type_2
      _Torsion_angle_constraint.Resonance_ID_2
      _Torsion_angle_constraint.Assembly_atom_ID_3
      _Torsion_angle_constraint.Entity_assembly_ID_3
      _Torsion_angle_constraint.Entity_ID_3
      _Torsion_angle_constraint.Comp_index_ID_3
      _Torsion_angle_constraint.Seq_ID_3
      _Torsion_angle_constraint.Comp_ID_3
      _Torsion_angle_constraint.Atom_ID_3
      _Torsion_angle_constraint.Atom_type_3
      _Torsion_angle_constraint.Resonance_ID_3
      _Torsion_angle_constraint.Assembly_atom_ID_4
      _Torsion_angle_constraint.Entity_assembly_ID_4
      _Torsion_angle_constraint.Entity_ID_4
      _Torsion_angle_constraint.Comp_index_ID_4
      _Torsion_angle_constraint.Seq_ID_4
      _Torsion_angle_constraint.Comp_ID_4
      _Torsion_angle_constraint.Atom_ID_4
      _Torsion_angle_constraint.Atom_type_4
      _Torsion_angle_constraint.Resonance_ID_4
      _Torsion_angle_constraint.Angle_lower_bound_val
      _Torsion_angle_constraint.Angle_upper_bound_val
      _Torsion_angle_constraint.Source_experiment_ID
      _Torsion_angle_constraint.PDB_record_ID_1
      _Torsion_angle_constraint.PDB_model_num_1
      _Torsion_angle_constraint.PDB_strand_ID_1
      _Torsion_angle_constraint.PDB_ins_code_1
      _Torsion_angle_constraint.PDB_residue_no_1
      _Torsion_angle_constraint.PDB_residue_name_1
      _Torsion_angle_constraint.PDB_atom_name_1
      _Torsion_angle_constraint.PDB_record_ID_2
      _Torsion_angle_constraint.PDB_model_num_2
      _Torsion_angle_constraint.PDB_strand_ID_2
      _Torsion_angle_constraint.PDB_ins_code_2
      _Torsion_angle_constraint.PDB_residue_no_2
      _Torsion_angle_constraint.PDB_residue_name_2
      _Torsion_angle_constraint.PDB_atom_name_2
      _Torsion_angle_constraint.PDB_record_ID_3
      _Torsion_angle_constraint.PDB_model_num_3
      _Torsion_angle_constraint.PDB_strand_ID_3
      _Torsion_angle_constraint.PDB_ins_code_3
      _Torsion_angle_constraint.PDB_residue_no_3
      _Torsion_angle_constraint.PDB_residue_name_3
      _Torsion_angle_constraint.PDB_atom_name_3
      _Torsion_angle_constraint.PDB_record_ID_4
      _Torsion_angle_constraint.PDB_model_num_4
      _Torsion_angle_constraint.PDB_strand_ID_4
      _Torsion_angle_constraint.PDB_ins_code_4
      _Torsion_angle_constraint.PDB_residue_no_4
      _Torsion_angle_constraint.PDB_residue_name_4
      _Torsion_angle_constraint.PDB_atom_name_4
      _Torsion_angle_constraint.Auth_entity_assembly_ID_1
      _Torsion_angle_constraint.Auth_asym_ID_1
      _Torsion_angle_constraint.Auth_chain_ID_1
      _Torsion_angle_constraint.Auth_seq_ID_1
      _Torsion_angle_constraint.Auth_comp_ID_1
      _Torsion_angle_constraint.Auth_atom_ID_1
      _Torsion_angle_constraint.Auth_alt_ID_1
      _Torsion_angle_constraint.Auth_atom_name_1
      _Torsion_angle_constraint.Auth_entity_assembly_ID_2
      _Torsion_angle_constraint.Auth_asym_ID_2
      _Torsion_angle_constraint.Auth_chain_ID_2
      _Torsion_angle_constraint.Auth_seq_ID_2
      _Torsion_angle_constraint.Auth_comp_ID_2
      _Torsion_angle_constraint.Auth_atom_ID_2
      _Torsion_angle_constraint.Auth_alt_ID_2
      _Torsion_angle_constraint.Auth_atom_name_2
      _Torsion_angle_constraint.Auth_entity_assembly_ID_3
      _Torsion_angle_constraint.Auth_asym_ID_3
      _Torsion_angle_constraint.Auth_chain_ID_3
      _Torsion_angle_constraint.Auth_seq_ID_3
      _Torsion_angle_constraint.Auth_comp_ID_3
      _Torsion_angle_constraint.Auth_atom_ID_3
      _Torsion_angle_constraint.Auth_alt_ID_3
      _Torsion_angle_constraint.Auth_atom_name_3
      _Torsion_angle_constraint.Auth_entity_assembly_ID_4
      _Torsion_angle_constraint.Auth_asym_ID_4
      _Torsion_angle_constraint.Auth_chain_ID_4
      _Torsion_angle_constraint.Auth_seq_ID_4
      _Torsion_angle_constraint.Auth_comp_ID_4
      _Torsion_angle_constraint.Auth_atom_ID_4
      _Torsion_angle_constraint.Auth_alt_ID_4
      _Torsion_angle_constraint.Auth_atom_name_4
      _Torsion_angle_constraint.Entry_ID
      _Torsion_angle_constraint.Torsion_angle_constraint_list_ID

     1    .   .   1   1   1    1    TYR   C   C   .   .   1   1   2    2    CYS   N    N   .   .   1   1   2    2    CYS   CA   C   .   .   1   1   2    2    CYS   C    C   .   -170.5   -75.7    .   .   .   A   .   1    TYR   C   .   .   A   .   2    CYS   N    .   .   A   .   2    CYS   CA   .   .   A   .   2    CYS   C    .   .   .   1    .   C   .   .   .   .   .   2    .   N    .   .   .   .   .   2    .   CA   .   .   .   .   .   2    .   C    .   .   c30521_6mk4   1    
     2    .   .   1   1   2    2    CYS   N   N   .   .   1   1   2    2    CYS   CA   C   .   .   1   1   2    2    CYS   C    C   .   .   1   1   3    3    GLN   N    N   .   121.1    186.7    .   .   .   A   .   2    CYS   N   .   .   A   .   2    CYS   CA   .   .   A   .   2    CYS   C    .   .   A   .   3    GLN   N    .   .   .   2    .   N   .   .   .   .   .   2    .   CA   .   .   .   .   .   2    .   C    .   .   .   .   .   3    .   N    .   .   c30521_6mk4   1    
     3    .   .   1   1   2    2    CYS   C   C   .   .   1   1   3    3    GLN   N    N   .   .   1   1   3    3    GLN   CA   C   .   .   1   1   3    3    GLN   C    C   .   -128.4   -84.4    .   .   .   A   .   2    CYS   C   .   .   A   .   3    GLN   N    .   .   A   .   3    GLN   CA   .   .   A   .   3    GLN   C    .   .   .   2    .   C   .   .   .   .   .   3    .   N    .   .   .   .   .   3    .   CA   .   .   .   .   .   3    .   C    .   .   c30521_6mk4   1    
     4    .   .   1   1   3    3    GLN   C   C   .   .   1   1   4    4    LYS   N    N   .   .   1   1   4    4    LYS   CA   C   .   .   1   1   4    4    LYS   C    C   .   -94.2    -44.2    .   .   .   A   .   3    GLN   C   .   .   A   .   4    LYS   N    .   .   A   .   4    LYS   CA   .   .   A   .   4    LYS   C    .   .   .   3    .   C   .   .   .   .   .   4    .   N    .   .   .   .   .   4    .   CA   .   .   .   .   .   4    .   C    .   .   c30521_6mk4   1    
     5    .   .   1   1   4    4    LYS   N   N   .   .   1   1   4    4    LYS   CA   C   .   .   1   1   4    4    LYS   C    C   .   .   1   1   5    5    TRP   N    N   .   114.3    176.5    .   .   .   A   .   4    LYS   N   .   .   A   .   4    LYS   CA   .   .   A   .   4    LYS   C    .   .   A   .   5    TRP   N    .   .   .   4    .   N   .   .   .   .   .   4    .   CA   .   .   .   .   .   4    .   C    .   .   .   .   .   5    .   N    .   .   c30521_6mk4   1    
     6    .   .   1   1   5    5    TRP   C   C   .   .   1   1   6    6    MET   N    N   .   .   1   1   6    6    MET   CA   C   .   .   1   1   6    6    MET   C    C   .   -97.0    -37.0    .   .   .   A   .   5    TRP   C   .   .   A   .   6    MET   N    .   .   A   .   6    MET   CA   .   .   A   .   6    MET   C    .   .   .   5    .   C   .   .   .   .   .   6    .   N    .   .   .   .   .   6    .   CA   .   .   .   .   .   6    .   C    .   .   c30521_6mk4   1    
     7    .   .   1   1   6    6    MET   N   N   .   .   1   1   6    6    MET   CA   C   .   .   1   1   6    6    MET   C    C   .   .   1   1   7    7    TRP   N    N   .   -51.8    8.2      .   .   .   A   .   6    MET   N   .   .   A   .   6    MET   CA   .   .   A   .   6    MET   C    .   .   A   .   7    TRP   N    .   .   .   6    .   N   .   .   .   .   .   6    .   CA   .   .   .   .   .   6    .   C    .   .   .   .   .   7    .   N    .   .   c30521_6mk4   1    
     8    .   .   1   1   7    7    TRP   N   N   .   .   1   1   7    7    TRP   CA   C   .   .   1   1   7    7    TRP   CB   C   .   .   1   1   7    7    TRP   CG   C   .   -90.0    -30.0    .   .   .   A   .   7    TRP   N   .   .   A   .   7    TRP   CA   .   .   A   .   7    TRP   CB   .   .   A   .   7    TRP   CG   .   .   .   7    .   N   .   .   .   .   .   7    .   CA   .   .   .   .   .   7    .   CB   .   .   .   .   .   7    .   CG   .   .   c30521_6mk4   1    
     9    .   .   1   1   8    8    THR   C   C   .   .   1   1   9    9    CYS   N    N   .   .   1   1   9    9    CYS   CA   C   .   .   1   1   9    9    CYS   C    C   .   -160.6   -120.6   .   .   .   A   .   8    THR   C   .   .   A   .   9    CYS   N    .   .   A   .   9    CYS   CA   .   .   A   .   9    CYS   C    .   .   .   8    .   C   .   .   .   .   .   9    .   N    .   .   .   .   .   9    .   CA   .   .   .   .   .   9    .   C    .   .   c30521_6mk4   1    
     10   .   .   1   1   9    9    CYS   N   N   .   .   1   1   9    9    CYS   CA   C   .   .   1   1   9    9    CYS   C    C   .   .   1   1   10   10   ASP   N    N   .   141.3    181.3    .   .   .   A   .   9    CYS   N   .   .   A   .   9    CYS   CA   .   .   A   .   9    CYS   C    .   .   A   .   10   ASP   N    .   .   .   9    .   N   .   .   .   .   .   9    .   CA   .   .   .   .   .   9    .   C    .   .   .   .   .   10   .   N    .   .   c30521_6mk4   1    
     11   .   .   1   1   9    9    CYS   N   N   .   .   1   1   9    9    CYS   CA   C   .   .   1   1   9    9    CYS   CB   C   .   .   1   1   9    9    CYS   SG   S   .   30.0     90.0     .   .   .   A   .   9    CYS   N   .   .   A   .   9    CYS   CA   .   .   A   .   9    CYS   CB   .   .   A   .   9    CYS   SG   .   .   .   9    .   N   .   .   .   .   .   9    .   CA   .   .   .   .   .   9    .   CB   .   .   .   .   .   9    .   SG   .   .   c30521_6mk4   1    
     12   .   .   1   1   10   10   ASP   C   C   .   .   1   1   11   11   SER   N    N   .   .   1   1   11   11   SER   CA   C   .   .   1   1   11   11   SER   C    C   .   -82.8    -42.8    .   .   .   A   .   10   ASP   C   .   .   A   .   11   SER   N    .   .   A   .   11   SER   CA   .   .   A   .   11   SER   C    .   .   .   10   .   C   .   .   .   .   .   11   .   N    .   .   .   .   .   11   .   CA   .   .   .   .   .   11   .   C    .   .   c30521_6mk4   1    
     13   .   .   1   1   11   11   SER   N   N   .   .   1   1   11   11   SER   CA   C   .   .   1   1   11   11   SER   C    C   .   .   1   1   12   12   GLU   N    N   .   -44.7    -4.7     .   .   .   A   .   11   SER   N   .   .   A   .   11   SER   CA   .   .   A   .   11   SER   C    .   .   A   .   12   GLU   N    .   .   .   11   .   N   .   .   .   .   .   11   .   CA   .   .   .   .   .   11   .   C    .   .   .   .   .   12   .   N    .   .   c30521_6mk4   1    
     14   .   .   1   1   12   12   GLU   C   C   .   .   1   1   13   13   ARG   N    N   .   .   1   1   13   13   ARG   CA   C   .   .   1   1   13   13   ARG   C    C   .   -98.5    -52.5    .   .   .   A   .   12   GLU   C   .   .   A   .   13   ARG   N    .   .   A   .   13   ARG   CA   .   .   A   .   13   ARG   C    .   .   .   12   .   C   .   .   .   .   .   13   .   N    .   .   .   .   .   13   .   CA   .   .   .   .   .   13   .   C    .   .   c30521_6mk4   1    
     15   .   .   1   1   13   13   ARG   N   N   .   .   1   1   13   13   ARG   CA   C   .   .   1   1   13   13   ARG   C    C   .   .   1   1   14   14   LYS   N    N   .   112.3    159.9    .   .   .   A   .   13   ARG   N   .   .   A   .   13   ARG   CA   .   .   A   .   13   ARG   C    .   .   A   .   14   LYS   N    .   .   .   13   .   N   .   .   .   .   .   13   .   CA   .   .   .   .   .   13   .   C    .   .   .   .   .   14   .   N    .   .   c30521_6mk4   1    
     16   .   .   1   1   13   13   ARG   C   C   .   .   1   1   14   14   LYS   N    N   .   .   1   1   14   14   LYS   CA   C   .   .   1   1   14   14   LYS   C    C   .   -104.8   -57.6    .   .   .   A   .   13   ARG   C   .   .   A   .   14   LYS   N    .   .   A   .   14   LYS   CA   .   .   A   .   14   LYS   C    .   .   .   13   .   C   .   .   .   .   .   14   .   N    .   .   .   .   .   14   .   CA   .   .   .   .   .   14   .   C    .   .   c30521_6mk4   1    
     17   .   .   1   1   14   14   LYS   N   N   .   .   1   1   14   14   LYS   CA   C   .   .   1   1   14   14   LYS   C    C   .   .   1   1   15   15   CYS   N    N   .   108.7    166.9    .   .   .   A   .   14   LYS   N   .   .   A   .   14   LYS   CA   .   .   A   .   14   LYS   C    .   .   A   .   15   CYS   N    .   .   .   14   .   N   .   .   .   .   .   14   .   CA   .   .   .   .   .   14   .   C    .   .   .   .   .   15   .   N    .   .   c30521_6mk4   1    
     18   .   .   1   1   14   14   LYS   C   C   .   .   1   1   15   15   CYS   N    N   .   .   1   1   15   15   CYS   CA   C   .   .   1   1   15   15   CYS   C    C   .   -93.9    -53.9    .   .   .   A   .   14   LYS   C   .   .   A   .   15   CYS   N    .   .   A   .   15   CYS   CA   .   .   A   .   15   CYS   C    .   .   .   14   .   C   .   .   .   .   .   15   .   N    .   .   .   .   .   15   .   CA   .   .   .   .   .   15   .   C    .   .   c30521_6mk4   1    
     19   .   .   1   1   15   15   CYS   N   N   .   .   1   1   15   15   CYS   CA   C   .   .   1   1   15   15   CYS   C    C   .   .   1   1   16   16   CYS   N    N   .   121.0    164.0    .   .   .   A   .   15   CYS   N   .   .   A   .   15   CYS   CA   .   .   A   .   15   CYS   C    .   .   A   .   16   CYS   N    .   .   .   15   .   N   .   .   .   .   .   15   .   CA   .   .   .   .   .   15   .   C    .   .   .   .   .   16   .   N    .   .   c30521_6mk4   1    
     20   .   .   1   1   16   16   CYS   C   C   .   .   1   1   17   17   LYS   N    N   .   .   1   1   17   17   LYS   CA   C   .   .   1   1   17   17   LYS   C    C   .   -77.9    -37.9    .   .   .   A   .   16   CYS   C   .   .   A   .   17   LYS   N    .   .   A   .   17   LYS   CA   .   .   A   .   17   LYS   C    .   .   .   16   .   C   .   .   .   .   .   17   .   N    .   .   .   .   .   17   .   CA   .   .   .   .   .   17   .   C    .   .   c30521_6mk4   1    
     21   .   .   1   1   17   17   LYS   N   N   .   .   1   1   17   17   LYS   CA   C   .   .   1   1   17   17   LYS   C    C   .   .   1   1   18   18   GLY   N    N   .   113.5    153.5    .   .   .   A   .   17   LYS   N   .   .   A   .   17   LYS   CA   .   .   A   .   17   LYS   C    .   .   A   .   18   GLY   N    .   .   .   17   .   N   .   .   .   .   .   17   .   CA   .   .   .   .   .   17   .   C    .   .   .   .   .   18   .   N    .   .   c30521_6mk4   1    
     22   .   .   1   1   17   17   LYS   C   C   .   .   1   1   18   18   GLY   N    N   .   .   1   1   18   18   GLY   CA   C   .   .   1   1   18   18   GLY   C    C   .   72.0     112.0    .   .   .   A   .   17   LYS   C   .   .   A   .   18   GLY   N    .   .   A   .   18   GLY   CA   .   .   A   .   18   GLY   C    .   .   .   17   .   C   .   .   .   .   .   18   .   N    .   .   .   .   .   18   .   CA   .   .   .   .   .   18   .   C    .   .   c30521_6mk4   1    
     23   .   .   1   1   18   18   GLY   N   N   .   .   1   1   18   18   GLY   CA   C   .   .   1   1   18   18   GLY   C    C   .   .   1   1   19   19   MET   N    N   .   -21.3    18.7     .   .   .   A   .   18   GLY   N   .   .   A   .   18   GLY   CA   .   .   A   .   18   GLY   C    .   .   A   .   19   MET   N    .   .   .   18   .   N   .   .   .   .   .   18   .   CA   .   .   .   .   .   18   .   C    .   .   .   .   .   19   .   N    .   .   c30521_6mk4   1    
     24   .   .   1   1   18   18   GLY   C   C   .   .   1   1   19   19   MET   N    N   .   .   1   1   19   19   MET   CA   C   .   .   1   1   19   19   MET   C    C   .   -144.3   -104.3   .   .   .   A   .   18   GLY   C   .   .   A   .   19   MET   N    .   .   A   .   19   MET   CA   .   .   A   .   19   MET   C    .   .   .   18   .   C   .   .   .   .   .   19   .   N    .   .   .   .   .   19   .   CA   .   .   .   .   .   19   .   C    .   .   c30521_6mk4   1    
     25   .   .   1   1   19   19   MET   C   C   .   .   1   1   20   20   VAL   N    N   .   .   1   1   20   20   VAL   CA   C   .   .   1   1   20   20   VAL   C    C   .   -147.3   -107.3   .   .   .   A   .   19   MET   C   .   .   A   .   20   VAL   N    .   .   A   .   20   VAL   CA   .   .   A   .   20   VAL   C    .   .   .   19   .   C   .   .   .   .   .   20   .   N    .   .   .   .   .   20   .   CA   .   .   .   .   .   20   .   C    .   .   c30521_6mk4   1    
     26   .   .   1   1   20   20   VAL   N   N   .   .   1   1   20   20   VAL   CA   C   .   .   1   1   20   20   VAL   C    C   .   .   1   1   21   21   CYS   N    N   .   119.6    172.0    .   .   .   A   .   20   VAL   N   .   .   A   .   20   VAL   CA   .   .   A   .   20   VAL   C    .   .   A   .   21   CYS   N    .   .   .   20   .   N   .   .   .   .   .   20   .   CA   .   .   .   .   .   20   .   C    .   .   .   .   .   21   .   N    .   .   c30521_6mk4   1    
     27   .   .   1   1   20   20   VAL   C   C   .   .   1   1   21   21   CYS   N    N   .   .   1   1   21   21   CYS   CA   C   .   .   1   1   21   21   CYS   C    C   .   -90.7    -50.7    .   .   .   A   .   20   VAL   C   .   .   A   .   21   CYS   N    .   .   A   .   21   CYS   CA   .   .   A   .   21   CYS   C    .   .   .   20   .   C   .   .   .   .   .   21   .   N    .   .   .   .   .   21   .   CA   .   .   .   .   .   21   .   C    .   .   c30521_6mk4   1    
     28   .   .   1   1   21   21   CYS   N   N   .   .   1   1   21   21   CYS   CA   C   .   .   1   1   21   21   CYS   C    C   .   .   1   1   22   22   ARG   N    N   .   106.0    166.0    .   .   .   A   .   21   CYS   N   .   .   A   .   21   CYS   CA   .   .   A   .   21   CYS   C    .   .   A   .   22   ARG   N    .   .   .   21   .   N   .   .   .   .   .   21   .   CA   .   .   .   .   .   21   .   C    .   .   .   .   .   22   .   N    .   .   c30521_6mk4   1    
     29   .   .   1   1   21   21   CYS   N   N   .   .   1   1   21   21   CYS   CA   C   .   .   1   1   21   21   CYS   CB   C   .   .   1   1   21   21   CYS   SG   S   .   150.0    210.0    .   .   .   A   .   21   CYS   N   .   .   A   .   21   CYS   CA   .   .   A   .   21   CYS   CB   .   .   A   .   21   CYS   SG   .   .   .   21   .   N   .   .   .   .   .   21   .   CA   .   .   .   .   .   21   .   CB   .   .   .   .   .   21   .   SG   .   .   c30521_6mk4   1    
     30   .   .   1   1   22   22   ARG   C   C   .   .   1   1   23   23   LEU   N    N   .   .   1   1   23   23   LEU   CA   C   .   .   1   1   23   23   LEU   C    C   .   -81.9    -41.9    .   .   .   A   .   22   ARG   C   .   .   A   .   23   LEU   N    .   .   A   .   23   LEU   CA   .   .   A   .   23   LEU   C    .   .   .   22   .   C   .   .   .   .   .   23   .   N    .   .   .   .   .   23   .   CA   .   .   .   .   .   23   .   C    .   .   c30521_6mk4   1    
     31   .   .   1   1   23   23   LEU   N   N   .   .   1   1   23   23   LEU   CA   C   .   .   1   1   23   23   LEU   C    C   .   .   1   1   24   24   TRP   N    N   .   -58.3    -18.3    .   .   .   A   .   23   LEU   N   .   .   A   .   23   LEU   CA   .   .   A   .   23   LEU   C    .   .   A   .   24   TRP   N    .   .   .   23   .   N   .   .   .   .   .   23   .   CA   .   .   .   .   .   23   .   C    .   .   .   .   .   24   .   N    .   .   c30521_6mk4   1    
     32   .   .   1   1   24   24   TRP   C   C   .   .   1   1   25   25   CYS   N    N   .   .   1   1   25   25   CYS   CA   C   .   .   1   1   25   25   CYS   C    C   .   -92.9    -52.9    .   .   .   A   .   24   TRP   C   .   .   A   .   25   CYS   N    .   .   A   .   25   CYS   CA   .   .   A   .   25   CYS   C    .   .   .   24   .   C   .   .   .   .   .   25   .   N    .   .   .   .   .   25   .   CA   .   .   .   .   .   25   .   C    .   .   c30521_6mk4   1    
     33   .   .   1   1   25   25   CYS   N   N   .   .   1   1   25   25   CYS   CA   C   .   .   1   1   25   25   CYS   C    C   .   .   1   1   26   26   LYS   N    N   .   113.4    161.4    .   .   .   A   .   25   CYS   N   .   .   A   .   25   CYS   CA   .   .   A   .   25   CYS   C    .   .   A   .   26   LYS   N    .   .   .   25   .   N   .   .   .   .   .   25   .   CA   .   .   .   .   .   25   .   C    .   .   .   .   .   26   .   N    .   .   c30521_6mk4   1    
     34   .   .   1   1   25   25   CYS   N   N   .   .   1   1   25   25   CYS   CA   C   .   .   1   1   25   25   CYS   CB   C   .   .   1   1   25   25   CYS   SG   S   .   -90.0    -30.0    .   .   .   A   .   25   CYS   N   .   .   A   .   25   CYS   CA   .   .   A   .   25   CYS   CB   .   .   A   .   25   CYS   SG   .   .   .   25   .   N   .   .   .   .   .   25   .   CA   .   .   .   .   .   25   .   CB   .   .   .   .   .   25   .   SG   .   .   c30521_6mk4   1    
     35   .   .   1   1   25   25   CYS   C   C   .   .   1   1   26   26   LYS   N    N   .   .   1   1   26   26   LYS   CA   C   .   .   1   1   26   26   LYS   C    C   .   -164.3   -83.3    .   .   .   A   .   25   CYS   C   .   .   A   .   26   LYS   N    .   .   A   .   26   LYS   CA   .   .   A   .   26   LYS   C    .   .   .   25   .   C   .   .   .   .   .   26   .   N    .   .   .   .   .   26   .   CA   .   .   .   .   .   26   .   C    .   .   c30521_6mk4   1    
     36   .   .   1   1   26   26   LYS   N   N   .   .   1   1   26   26   LYS   CA   C   .   .   1   1   26   26   LYS   C    C   .   .   1   1   27   27   LYS   N    N   .   118.5    181.9    .   .   .   A   .   26   LYS   N   .   .   A   .   26   LYS   CA   .   .   A   .   26   LYS   C    .   .   A   .   27   LYS   N    .   .   .   26   .   N   .   .   .   .   .   26   .   CA   .   .   .   .   .   26   .   C    .   .   .   .   .   27   .   N    .   .   c30521_6mk4   1    
     37   .   .   1   1   26   26   LYS   C   C   .   .   1   1   27   27   LYS   N    N   .   .   1   1   27   27   LYS   CA   C   .   .   1   1   27   27   LYS   C    C   .   -96.2    -36.2    .   .   .   A   .   26   LYS   C   .   .   A   .   27   LYS   N    .   .   A   .   27   LYS   CA   .   .   A   .   27   LYS   C    .   .   .   26   .   C   .   .   .   .   .   27   .   N    .   .   .   .   .   27   .   CA   .   .   .   .   .   27   .   C    .   .   c30521_6mk4   1    
     38   .   .   1   1   27   27   LYS   N   N   .   .   1   1   27   27   LYS   CA   C   .   .   1   1   27   27   LYS   C    C   .   .   1   1   28   28   LYS   N    N   .   112.5    172.5    .   .   .   A   .   27   LYS   N   .   .   A   .   27   LYS   CA   .   .   A   .   27   LYS   C    .   .   A   .   28   LYS   N    .   .   .   27   .   N   .   .   .   .   .   27   .   CA   .   .   .   .   .   27   .   C    .   .   .   .   .   28   .   N    .   .   c30521_6mk4   1    

   stop_

   loop_
      _TA_constraint_comment_org.ID
      _TA_constraint_comment_org.Comment_text
      _TA_constraint_comment_org.Comment_begin_line
      _TA_constraint_comment_org.Comment_begin_column
      _TA_constraint_comment_org.Comment_end_line
      _TA_constraint_comment_org.Comment_end_column
      _TA_constraint_comment_org.Entry_ID
      _TA_constraint_comment_org.Torsion_angle_constraint_list_ID

     1   'Dihedral restraints'   1   1   1   21   c30521_6mk4   1    

   stop_

save_

save_MR_file_comment_1
   _Org_constr_file_comment.Sf_framecode        MR_file_comment_1
   _Org_constr_file_comment.Sf_category         org_constr_file_comment
   _Org_constr_file_comment.Entry_ID            c30521_6mk4
   _Org_constr_file_comment.ID                  1
   _Org_constr_file_comment.Constraint_file_ID  1
   _Org_constr_file_comment.Block_ID            1
   _Org_constr_file_comment.Details             'Generated by Wattos'
   _Org_constr_file_comment.Comment             '*HEADER TOXIN 25-SEP-18 6MK4 *TITLE SOLUTION NMR STRUCTURE OF SPIDER TOXIN ANALOGUE [E17K]PROTX-II *COMPND MOL_ID: 1; *COMPND 2 MOLECULE: BETA/OMEGA-THERAPHOTOXIN-TP2A; *COMPND 3 CHAIN: A; *COMPND 4 SYNONYM: BETA/OMEGA-TRTX-TP2A, PROTX-II, PT-II, PROTOXIN-2, PROTX2; *COMPND 5 ENGINEERED: YES; *COMPND 6 MUTATION: YES *SOURCE MOL_ID: 1; *SOURCE 2 SYNTHETIC: YES; *SOURCE 3 ORGANISM_SCIENTIFIC: THRIXOPELMA PRURIENS; *SOURCE 4 ORGANISM_COMMON: PERUVIAN GREEN VELVET TARANTULA; *SOURCE 5 ORGANISM_TAXID: 213387 *KEYWDS PROTX-II ANALOGUE, SPIDER TOXIN, PEPTIDE-MEMBRANE INTERACTIONS, *KEYWDS 2 VOLTAGE-SENSITIVE SODIUM CHANNELS, TOXIN *EXPDTA SOLUTION NMR *NUMMDL 20 *AUTHOR C.I.SCHROEDER *REVDAT 1 19-DEC-18 6MK4 0'

save_