NMR Restraints Grid

Result table
 (Save to zip file containing files for each block)

image mrblock_id pdb_id cing stage program type subtype item_count
372788 1dg0 cing 4-filtered-FRED STAR entry full 86


data_FRED_restraints_with_modified_coordinates_PDB_code_1dg0

# This FRED archive file contains, for PDB entry <1dg0>:
# 
# - Coordinates and sequence information from the PDB mmCIF file
# - NMR restraints from the PDB MR file
# 
# In this file, the coordinates and NMR restraints share the same atom names,
# and in this way can differ from the data deposited at the wwPDB. To achieve
# this aim, the NMR restraints were parsed from their original format files, and
# the coordinates and NMR restraints information were subsequently harmonized.
# 
# Due to the complexity of this harmonization process and the filtering process
# used in creating these files, the NMR restraints information in these files
# may differ significantly from that in the originally deposited file. Other 
# modifications could have occurred to the NMR restraints information, or data 
# could have been lost because of parsing or conversion errors. The PDB file 
# remains the authoritative reference for the atomic coordinates and the 
# originally deposited restraints files remain the primary reference for these 
# data.
# 
# This file is generated at the BioMagResBank (BMRB) in collaboration with the 
# PDBe (formerly MSD) group at the European Bioinformatics Institute (EBI) and 
# the CMBI/IMM group at the Radboud University of Nijmegen.
# 
# Several software packages were used to produce this file:
# 
# - Wattos (BMRB and CMBI/IMM).
# - FormatConverter and NMRStarExport (PDBe).
# - CCPN framework (http://www.ccpn.ac.uk/).
# 
# More information about this process can be found in the references below.
# Please cite the original reference for this PDB entry.
# 
# JF Doreleijers, A Nederveen, W Vranken, J Lin, AM Bonvin, R Kaptein, JL
# Markley, and EL Ulrich (2005). BioMagResBank databases DOCR and FRED
# containing converted and filtered sets of experimental NMR restraints and
# coordinates from over 500 protein PDB structures. J. Biomol. NMR 32, 1-12.
# 
# WF Vranken, W Boucher, TJ Stevens, RH Fogh, A Pajon, M Llinas, EL Ulrich, JL
# Markley, J Ionides, ED Laue (2005). The CCPN data model for NMR spectroscopy:
# development of a software pipeline. Proteins 59, 687-696. 
# 
# JF Doreleijers, W Vranken, C Penkett, J Lin, CF Schulte, G Vuister, G Vriend,
# JL Markley, EL Ulrich. BioMagResBank database `NMR Restraints Grid` with
# curated sets of experimental NMR restraints for over 4,000 protein and nucleic
# acid PDB entries. (in preparation)




save_Conversion_project_for_entry_Name_1
    _Study_list.Sf_category  study_list
    _Study_list.Entry_ID     1
    _Study_list.ID           1

    loop_
       _Study.ID
       _Study.Name
       _Study.Type
       _Study.Details
       _Study.Entry_ID
       _Study.Study_list_ID

       1 "Conversion project for entry 1" NMR . 1 1 
    stop_

save_


save_originalConstraints_1
    _Entry.Sf_category          entry_information
    _Entry.ID                   1
    _Entry.Title                "Data for entry 1"
    _Entry.NMR_STAR_version     3.1.0.8
    _Entry.Experimental_method  NMR
    _Entry.Details              .

save_


save_assembly_1dg0
    _Assembly.Sf_category           assembly
    _Assembly.Entry_ID              1
    _Assembly.ID                    1
    _Assembly.Name                  1dg0
    _Assembly.Number_of_components  1
    _Assembly.Organic_ligands       .
    _Assembly.Metal_ions            .
    _Assembly.Paramagnetic          .
    _Assembly.Thiol_state           "all other bound"
    _Assembly.Molecular_mass        931.07

    loop_
       _Entity_assembly.ID
       _Entity_assembly.Entity_assembly_name
       _Entity_assembly.Entity_ID
       _Entity_assembly.Entity_label
       _Entity_assembly.Asym_ID
       _Entity_assembly.Details
       _Entity_assembly.Entry_ID
       _Entity_assembly.Assembly_ID

       1 . 1 $DES_GLY1__CONTRYPHAN_R A . 1 1 
    stop_

save_


save_DES_GLY1__CONTRYPHAN_R
    _Entity.Sf_category                  entity
    _Entity.Entry_ID                     1
    _Entity.ID                           1
    _Entity.Name                         "DES GLY1  CONTRYPHAN R"
    _Entity.Type                         polymer
    _Entity.Polymer_type                 polypeptide(L)
    _Entity.Polymer_seq_one_letter_code  CXXQPWX
    _Entity.Number_of_monomers           7

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

       1 CYS    . 1 1 
       2 HYP $HYP 1 1 
       3 DTR $DTR 1 1 
       4 GLN    . 1 1 
       5 PRO    . 1 1 
       6 TRP    . 1 1 
       7 .     $. 1 1 
    stop_

    loop_
       _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

       CYS 1 1 1 1 
       HYP 2 2 1 1 
       DTR 3 3 1 1 
       GLN 4 4 1 1 
       PRO 5 5 1 1 
       TRP 6 6 1 1 
       .   7 7 1 1 
    stop_

save_


save_HYP
    _Chem_comp.Sf_category  chem_comp
    _Chem_comp.Entry_ID     1
    _Chem_comp.ID           HYP
    _Chem_comp.Type         non-polymer

save_


save_.
    _Chem_comp.Sf_category  chem_comp
    _Chem_comp.Entry_ID     1
    _Chem_comp.ID           .
    _Chem_comp.Type         non-polymer

save_


save_DTR
    _Chem_comp.Sf_category  chem_comp
    _Chem_comp.Entry_ID     1
    _Chem_comp.ID           DTR
    _Chem_comp.Type         non-polymer

save_


save_CNS/XPLOR_distance_constraints_2_1
    _Distance_constraint_list.Sf_category         distance_constraints
    _Distance_constraint_list.Entry_ID            1
    _Distance_constraint_list.ID                  1
    _Distance_constraint_list.Constraint_type     NOE
    _Distance_constraint_list.Constraint_file_ID  .
    _Distance_constraint_list.Block_ID            .

    loop_
       _Dist_constraint_tree.Constraint_ID
       _Dist_constraint_tree.Node_ID
       _Dist_constraint_tree.Down_node_ID
       _Dist_constraint_tree.Right_node_ID
       _Dist_constraint_tree.Logic_operation
       _Dist_constraint_tree.Entry_ID
       _Dist_constraint_tree.Distance_constraint_list_ID

        1 1 . . . 1 1 
        2 1 . . . 1 1 
        3 1 . . . 1 1 
        4 1 . . . 1 1 
        5 1 . . . 1 1 
        6 1 . . . 1 1 
        7 1 . . . 1 1 
        8 1 . . . 1 1 
        9 1 . . . 1 1 
       10 1 . . . 1 1 
       11 1 . . . 1 1 
       12 1 . . . 1 1 
       13 1 . . . 1 1 
       14 1 . . . 1 1 
       15 1 . . . 1 1 
       16 1 . . . 1 1 
       17 1 . . . 1 1 
       18 1 . . . 1 1 
       19 1 . . . 1 1 
       20 1 . . . 1 1 
       21 1 . . . 1 1 
       22 1 . . . 1 1 
       23 1 . . . 1 1 
       24 1 . . . 1 1 
       25 1 . . . 1 1 
       26 1 . . . 1 1 
       27 1 . . . 1 1 
       28 1 . . . 1 1 
       29 1 . . . 1 1 
       30 1 . . . 1 1 
       31 1 . . . 1 1 
       32 1 . . . 1 1 
       33 1 . . . 1 1 
       34 1 . . . 1 1 
       35 1 . . . 1 1 
       36 1 . . . 1 1 
       37 1 . . . 1 1 
       38 1 . . . 1 1 
       39 1 . . . 1 1 
       40 1 . . . 1 1 
       41 1 . . . 1 1 
       42 1 . . . 1 1 
       43 1 . . . 1 1 
       44 1 . . . 1 1 
       45 1 . . . 1 1 
       46 1 . . . 1 1 
       47 1 . . . 1 1 
       48 1 . . . 1 1 
       49 1 . . . 1 1 
       50 1 . . . 1 1 
       51 1 . . . 1 1 
       52 1 . . . 1 1 
       53 1 . . . 1 1 
       54 1 . . . 1 1 
       55 1 . . . 1 1 
       56 1 . . . 1 1 
       57 1 . . . 1 1 
       58 1 . . . 1 1 
       59 1 . . . 1 1 
       60 1 . . . 1 1 
       61 1 . . . 1 1 
       62 1 . . . 1 1 
       63 1 . . . 1 1 
       64 1 . . . 1 1 
       65 1 . . . 1 1 
       66 1 . . . 1 1 
       67 1 . . . 1 1 
       68 1 . . . 1 1 
       69 1 . . . 1 1 
       70 1 . . . 1 1 
       71 1 . . . 1 1 
       72 1 . . . 1 1 
       73 1 . . . 1 1 
       74 1 . . . 1 1 
       75 1 . . . 1 1 
       76 1 . . . 1 1 
       77 1 . . . 1 1 
       78 1 . . . 1 1 
       79 1 . . . 1 1 
       80 1 . . . 1 1 
       81 1 . . . 1 1 
       82 1 . . . 1 1 
       83 1 . . . 1 1 
       84 1 . . . 1 1 
       85 1 . . . 1 1 
       86 1 . . . 1 1 
    stop_

    loop_
       _Dist_constraint.Tree_node_member_constraint_ID
       _Dist_constraint.Tree_node_member_node_ID
       _Dist_constraint.Constraint_tree_node_member_ID
       _Dist_constraint.Entity_assembly_ID
       _Dist_constraint.Entity_ID
       _Dist_constraint.Comp_index_ID
       _Dist_constraint.Comp_ID
       _Dist_constraint.Atom_ID
       _Dist_constraint.Auth_asym_ID
       _Dist_constraint.Auth_seq_ID
       _Dist_constraint.Auth_comp_ID
       _Dist_constraint.Auth_atom_ID
       _Dist_constraint.Entry_ID
       _Dist_constraint.Distance_constraint_list_ID

        1 1 1 1 1 1 CYS HA  . 2 . HA  1 1 
        1 1 2 1 1 2 HYP HA  . 3 . HA  1 1 
        2 1 1 1 1 1 CYS HA  . 2 . HA  1 1 
        2 1 2 1 1 3 DTR H   . 4 . HN  1 1 
        3 1 1 1 1 1 CYS HA  . 2 . HA  1 1 
        3 1 2 1 1 4 GLN H   . 5 . HN  1 1 
        4 1 1 1 1 1 CYS HB2 . 2 . HB1 1 1 
        4 1 2 1 1 3 DTR H   . 4 . HN  1 1 
        5 1 1 1 1 1 CYS HB3 . 2 . HB2 1 1 
        5 1 2 1 1 2 HYP HA  . 3 . HA  1 1 
        6 1 1 1 1 2 HYP HA  . 3 . HA  1 1 
        6 1 2 1 1 2 HYP HB2 . 3 . HB1 1 1 
        7 1 1 1 1 2 HYP HA  . 3 . HA  1 1 
        7 1 2 1 1 2 HYP HB3 . 3 . HB2 1 1 
        8 1 1 1 1 2 HYP HA  . 3 . HA  1 1 
        8 1 2 1 1 2 HYP HD1 . 3 . HD1 1 1 
        9 1 1 1 1 2 HYP HA  . 3 . HA  1 1 
        9 1 2 1 1 2 HYP HG  . 3 . HG  1 1 
       10 1 1 1 1 2 HYP HA  . 3 . HA  1 1 
       10 1 2 1 1 3 DTR H   . 4 . HN  1 1 
       11 1 1 1 1 2 HYP HA  . 3 . HA  1 1 
       11 1 2 1 1 4 GLN H   . 5 . HN  1 1 
       12 1 1 1 1 2 HYP HB2 . 3 . HB1 1 1 
       12 1 2 1 1 2 HYP HD1 . 3 . HD1 1 1 
       13 1 1 1 1 2 HYP HB2 . 3 . HB1 1 1 
       13 1 2 1 1 2 HYP HG  . 3 . HG  1 1 
       14 1 1 1 1 2 HYP HB2 . 3 . HB1 1 1 
       14 1 2 1 1 3 DTR H   . 4 . HN  1 1 
       15 1 1 1 1 2 HYP HB2 . 3 . HB1 1 1 
       15 1 2 1 1 3 DTR HD1 . 4 . HD1 1 1 
       16 1 1 1 1 2 HYP HB2 . 3 . HB1 1 1 
       16 1 2 1 1 3 DTR HE1 . 4 . HE1 1 1 
       17 1 1 1 1 2 HYP HB2 . 3 . HB1 1 1 
       17 1 2 1 1 4 GLN H   . 5 . HN  1 1 
       18 1 1 1 1 2 HYP HB3 . 3 . HB2 1 1 
       18 1 2 1 1 2 HYP HG  . 3 . HG  1 1 
       19 1 1 1 1 2 HYP HB3 . 3 . HB2 1 1 
       19 1 2 1 1 3 DTR HD1 . 4 . HD1 1 1 
       20 1 1 1 1 2 HYP HB3 . 3 . HB2 1 1 
       20 1 2 1 1 3 DTR HE1 . 4 . HE1 1 1 
       21 1 1 1 1 2 HYP HD1 . 3 . HD1 1 1 
       21 1 2 1 1 2 HYP HG  . 3 . HG  1 1 
       22 1 1 1 1 3 DTR H   . 4 . HN  1 1 
       22 1 2 1 1 3 DTR HA  . 4 . HA  1 1 
       23 1 1 1 1 3 DTR H   . 4 . HN  1 1 
       23 1 2 1 1 3 DTR HB2 . 4 . HB1 1 1 
       24 1 1 1 1 3 DTR H   . 4 . HN  1 1 
       24 1 2 1 1 3 DTR HB3 . 4 . HB2 1 1 
       25 1 1 1 1 3 DTR H   . 4 . HN  1 1 
       25 1 2 1 1 3 DTR HE3 . 4 . HE3 1 1 
       26 1 1 1 1 3 DTR H   . 4 . HN  1 1 
       26 1 2 1 1 4 GLN H   . 5 . HN  1 1 
       27 1 1 1 1 3 DTR H   . 4 . HN  1 1 
       27 1 2 1 1 5 PRO HB3 . 6 . HB1 1 1 
       28 1 1 1 1 3 DTR HA  . 4 . HA  1 1 
       28 1 2 1 1 3 DTR HB2 . 4 . HB1 1 1 
       29 1 1 1 1 3 DTR HA  . 4 . HA  1 1 
       29 1 2 1 1 3 DTR HB3 . 4 . HB2 1 1 
       30 1 1 1 1 3 DTR HA  . 4 . HA  1 1 
       30 1 2 1 1 3 DTR HD1 . 4 . HD1 1 1 
       31 1 1 1 1 3 DTR HA  . 4 . HA  1 1 
       31 1 2 1 1 3 DTR HE3 . 4 . HE3 1 1 
       32 1 1 1 1 3 DTR HA  . 4 . HA  1 1 
       32 1 2 1 1 4 GLN H   . 5 . HN  1 1 
       33 1 1 1 1 3 DTR HB2 . 4 . HB1 1 1 
       33 1 2 1 1 3 DTR HD1 . 4 . HD1 1 1 
       34 1 1 1 1 3 DTR HB2 . 4 . HB1 1 1 
       34 1 2 1 1 3 DTR HE3 . 4 . HE3 1 1 
       35 1 1 1 1 3 DTR HB2 . 4 . HB1 1 1 
       35 1 2 1 1 4 GLN H   . 5 . HN  1 1 
       36 1 1 1 1 3 DTR HB3 . 4 . HB2 1 1 
       36 1 2 1 1 3 DTR HD1 . 4 . HD1 1 1 
       37 1 1 1 1 3 DTR HB3 . 4 . HB2 1 1 
       37 1 2 1 1 3 DTR HE3 . 4 . HE3 1 1 
       38 1 1 1 1 3 DTR HD1 . 4 . HD1 1 1 
       38 1 2 1 1 3 DTR HE1 . 4 . HE1 1 1 
       39 1 1 1 1 3 DTR HE1 . 4 . HE1 1 1 
       39 1 2 1 1 3 DTR HZ2 . 4 . HZ2 1 1 
       40 1 1 1 1 3 DTR HE3 . 4 . HE3 1 1 
       40 1 2 1 1 3 DTR HZ3 . 4 . HZ3 1 1 
       41 1 1 1 1 3 DTR HE3 . 4 . HE3 1 1 
       41 1 2 1 1 4 GLN HA  . 5 . HA  1 1 
       42 1 1 1 1 3 DTR HH2 . 4 . HH2 1 1 
       42 1 2 1 1 3 DTR HZ2 . 4 . HZ2 1 1 
       43 1 1 1 1 3 DTR HH2 . 4 . HH2 1 1 
       43 1 2 1 1 3 DTR HZ3 . 4 . HZ3 1 1 
       44 1 1 1 1 4 GLN H   . 5 . HN  1 1 
       44 1 2 1 1 4 GLN HB2 . 5 . HB2 1 1 
       45 1 1 1 1 4 GLN H   . 5 . HN  1 1 
       45 1 2 1 1 4 GLN HG2 . 5 . HG2 1 1 
       46 1 1 1 1 4 GLN H   . 5 . HN  1 1 
       46 1 2 1 1 4 GLN HG3 . 5 . HG1 1 1 
       47 1 1 1 1 4 GLN HA  . 5 . HA  1 1 
       47 1 2 1 1 4 GLN HG2 . 5 . HG2 1 1 
       48 1 1 1 1 4 GLN HA  . 5 . HA  1 1 
       48 1 2 1 1 4 GLN HG3 . 5 . HG1 1 1 
       49 1 1 1 1 4 GLN HA  . 5 . HA  1 1 
       49 1 2 1 1 5 PRO HA  . 6 . HA  1 1 
       50 1 1 1 1 4 GLN HA  . 5 . HA  1 1 
       50 1 2 1 1 5 PRO HD2 . 6 . HD1 1 1 
       51 1 1 1 1 4 GLN HA  . 5 . HA  1 1 
       51 1 2 1 1 5 PRO HD3 . 6 . HD2 1 1 
       52 1 1 1 1 4 GLN HB2 . 5 . HB2 1 1 
       52 1 2 1 1 5 PRO HD2 . 6 . HD1 1 1 
       53 1 1 1 1 4 GLN HB2 . 5 . HB2 1 1 
       53 1 2 1 1 5 PRO HD3 . 6 . HD2 1 1 
       54 1 1 1 1 4 GLN HB2 . 5 . HB2 1 1 
       54 1 2 1 1 6 TRP H   . 7 . HN  1 1 
       55 1 1 1 1 4 GLN HB2 . 5 . HB2 1 1 
       55 1 2 1 1 6 TRP HE1 . 7 . HE1 1 1 
       56 1 1 1 1 4 GLN HB2 . 5 . HB2 1 1 
       56 1 2 1 1 6 TRP HE3 . 7 . HE3 1 1 
       57 1 1 1 1 4 GLN HB2 . 5 . HB2 1 1 
       57 1 2 1 1 6 TRP HZ2 . 7 . HZ2 1 1 
       58 1 1 1 1 4 GLN HB2 . 5 . HB2 1 1 
       58 1 2 1 1 6 TRP HZ3 . 7 . HZ3 1 1 
       59 1 1 1 1 4 GLN HB3 . 5 . HB1 1 1 
       59 1 2 1 1 5 PRO HD2 . 6 . HD1 1 1 
       60 1 1 1 1 4 GLN HB3 . 5 . HB1 1 1 
       60 1 2 1 1 5 PRO HD3 . 6 . HD2 1 1 
       61 1 1 1 1 4 GLN HB3 . 5 . HB1 1 1 
       61 1 2 1 1 6 TRP H   . 7 . HN  1 1 
       62 1 1 1 1 4 GLN HB3 . 5 . HB1 1 1 
       62 1 2 1 1 6 TRP HE1 . 7 . HE1 1 1 
       63 1 1 1 1 4 GLN HB3 . 5 . HB1 1 1 
       63 1 2 1 1 6 TRP HE3 . 7 . HE3 1 1 
       64 1 1 1 1 4 GLN HB3 . 5 . HB1 1 1 
       64 1 2 1 1 6 TRP HZ2 . 7 . HZ2 1 1 
       65 1 1 1 1 4 GLN HB3 . 5 . HB1 1 1 
       65 1 2 1 1 6 TRP HZ3 . 7 . HZ3 1 1 
       66 1 1 1 1 4 GLN HG2 . 5 . HG2 1 1 
       66 1 2 1 1 6 TRP HZ2 . 7 . HZ2 1 1 
       67 1 1 1 1 4 GLN HG2 . 5 . HG2 1 1 
       67 1 2 1 1 6 TRP HZ3 . 7 . HZ3 1 1 
       68 1 1 1 1 4 GLN HG3 . 5 . HG1 1 1 
       68 1 2 1 1 6 TRP H   . 7 . HN  1 1 
       69 1 1 1 1 4 GLN HG3 . 5 . HG1 1 1 
       69 1 2 1 1 6 TRP HE3 . 7 . HE3 1 1 
       70 1 1 1 1 4 GLN HG3 . 5 . HG1 1 1 
       70 1 2 1 1 6 TRP HZ2 . 7 . HZ2 1 1 
       71 1 1 1 1 4 GLN HG3 . 5 . HG1 1 1 
       71 1 2 1 1 6 TRP HZ3 . 7 . HZ3 1 1 
       72 1 1 1 1 5 PRO HA  . 6 . HA  1 1 
       72 1 2 1 1 5 PRO HG2 . 6 . HG1 1 1 
       73 1 1 1 1 5 PRO HA  . 6 . HA  1 1 
       73 1 2 1 1 5 PRO HG3 . 6 . HG2 1 1 
       74 1 1 1 1 5 PRO HA  . 6 . HA  1 1 
       74 1 2 1 1 6 TRP H   . 7 . HN  1 1 
       75 1 1 1 1 5 PRO HB2 . 6 . HB2 1 1 
       75 1 2 1 1 6 TRP H   . 7 . HN  1 1 
       76 1 1 1 1 5 PRO HB3 . 6 . HB1 1 1 
       76 1 2 1 1 5 PRO HD2 . 6 . HD1 1 1 
       77 1 1 1 1 5 PRO HB3 . 6 . HB1 1 1 
       77 1 2 1 1 5 PRO HD3 . 6 . HD2 1 1 
       78 1 1 1 1 6 TRP H   . 7 . HN  1 1 
       78 1 2 1 1 6 TRP HB2 . 7 . HB2 1 1 
       79 1 1 1 1 6 TRP H   . 7 . HN  1 1 
       79 1 2 1 1 6 TRP HB3 . 7 . HB1 1 1 
       80 1 1 1 1 6 TRP H   . 7 . HN  1 1 
       80 1 2 1 1 6 TRP HD1 . 7 . HD1 1 1 
       81 1 1 1 1 6 TRP H   . 7 . HN  1 1 
       81 1 2 1 1 6 TRP HE3 . 7 . HE3 1 1 
       82 1 1 1 1 6 TRP HA  . 7 . HA  1 1 
       82 1 2 1 1 6 TRP HE3 . 7 . HE3 1 1 
       83 1 1 1 1 6 TRP HB2 . 7 . HB2 1 1 
       83 1 2 1 1 6 TRP HD1 . 7 . HD1 1 1 
       84 1 1 1 1 6 TRP HB2 . 7 . HB2 1 1 
       84 1 2 1 1 6 TRP HE3 . 7 . HE3 1 1 
       85 1 1 1 1 6 TRP HB3 . 7 . HB1 1 1 
       85 1 2 1 1 6 TRP HD1 . 7 . HD1 1 1 
       86 1 1 1 1 6 TRP HB3 . 7 . HB1 1 1 
       86 1 2 1 1 6 TRP HE3 . 7 . HE3 1 1 
    stop_

    loop_
       _Dist_constraint_value.Constraint_ID
       _Dist_constraint_value.Tree_node_ID
       _Dist_constraint_value.Source_experiment_ID
       _Dist_constraint_value.Spectral_peak_ID
       _Dist_constraint_value.Intensity_val
       _Dist_constraint_value.Intensity_lower_val_err
       _Dist_constraint_value.Intensity_upper_val_err
       _Dist_constraint_value.Distance_val
       _Dist_constraint_value.Distance_lower_bound_val
       _Dist_constraint_value.Distance_upper_bound_val
       _Dist_constraint_value.Entry_ID
       _Dist_constraint_value.Distance_constraint_list_ID

        1 1 . . . . . 0.0 0.0 4.3 1 1 
        2 1 . . . . . 0.0 0.0 4.0 1 1 
        3 1 . . . . . 0.0 0.0 4.2 1 1 
        4 1 . . . . . 0.0 0.0 5.3 1 1 
        5 1 . . . . . 0.0 0.0 3.8 1 1 
        6 1 . . . . . 0.0 0.0 3.9 1 1 
        7 1 . . . . . 0.0 0.0 3.7 1 1 
        8 1 . . . . . 0.0 0.0 4.2 1 1 
        9 1 . . . . . 0.0 0.0 4.5 1 1 
       10 1 . . . . . 0.0 0.0 3.7 1 1 
       11 1 . . . . . 0.0 0.0 4.6 1 1 
       12 1 . . . . . 0.0 0.0 4.5 1 1 
       13 1 . . . . . 0.0 0.0 4.5 1 1 
       14 1 . . . . . 0.0 0.0 4.2 1 1 
       15 1 . . . . . 0.0 0.0 3.7 1 1 
       16 1 . . . . . 0.0 0.0 4.5 1 1 
       17 1 . . . . . 0.0 0.0 7.0 1 1 
       18 1 . . . . . 0.0 0.0 5.8 1 1 
       19 1 . . . . . 0.0 0.0 3.7 1 1 
       20 1 . . . . . 0.0 0.0 4.7 1 1 
       21 1 . . . . . 0.0 0.0 3.7 1 1 
       22 1 . . . . . 0.0 0.0 3.2 1 1 
       23 1 . . . . . 0.0 0.0 4.1 1 1 
       24 1 . . . . . 0.0 0.0 4.5 1 1 
       25 1 . . . . . 0.0 0.0 7.0 1 1 
       26 1 . . . . . 0.0 0.0 3.2 1 1 
       27 1 . . . . . 0.0 0.0 5.1 1 1 
       28 1 . . . . . 0.0 0.0 3.7 1 1 
       29 1 . . . . . 0.0 0.0 4.6 1 1 
       30 1 . . . . . 0.0 0.0 4.2 1 1 
       31 1 . . . . . 0.0 0.0 4.1 1 1 
       32 1 . . . . . 0.0 0.0 3.9 1 1 
       33 1 . . . . . 0.0 0.0 3.8 1 1 
       34 1 . . . . . 0.0 0.0 4.4 1 1 
       35 1 . . . . . 0.0 0.0 5.0 1 1 
       36 1 . . . . . 0.0 0.0 3.7 1 1 
       37 1 . . . . . 0.0 0.0 4.5 1 1 
       38 1 . . . . . 0.0 0.0 3.7 1 1 
       39 1 . . . . . 0.0 0.0 3.7 1 1 
       40 1 . . . . . 0.0 0.0 3.7 1 1 
       41 1 . . . . . 0.0 0.0 5.9 1 1 
       42 1 . . . . . 0.0 0.0 3.7 1 1 
       43 1 . . . . . 0.0 0.0 3.7 1 1 
       44 1 . . . . . 0.0 0.0 3.7 1 1 
       45 1 . . . . . 0.0 0.0 4.8 1 1 
       46 1 . . . . . 0.0 0.0 4.7 1 1 
       47 1 . . . . . 0.0 0.0 4.3 1 1 
       48 1 . . . . . 0.0 0.0 4.4 1 1 
       49 1 . . . . . 0.0 0.0 4.4 1 1 
       50 1 . . . . . 0.0 0.0 3.7 1 1 
       51 1 . . . . . 0.0 0.0 3.7 1 1 
       52 1 . . . . . 0.0 0.0 4.6 1 1 
       53 1 . . . . . 0.0 0.0 5.3 1 1 
       54 1 . . . . . 0.0 0.0 4.3 1 1 
       55 1 . . . . . 0.0 0.0 4.9 1 1 
       56 1 . . . . . 0.0 0.0 4.9 1 1 
       57 1 . . . . . 0.0 0.0 4.7 1 1 
       58 1 . . . . . 0.0 0.0 4.7 1 1 
       59 1 . . . . . 0.0 0.0 3.8 1 1 
       60 1 . . . . . 0.0 0.0 4.3 1 1 
       61 1 . . . . . 0.0 0.0 4.1 1 1 
       62 1 . . . . . 0.0 0.0 5.2 1 1 
       63 1 . . . . . 0.0 0.0 4.6 1 1 
       64 1 . . . . . 0.0 0.0 5.0 1 1 
       65 1 . . . . . 0.0 0.0 4.0 1 1 
       66 1 . . . . . 0.0 0.0 3.7 1 1 
       67 1 . . . . . 0.0 0.0 3.7 1 1 
       68 1 . . . . . 0.0 0.0 4.5 1 1 
       69 1 . . . . . 0.0 0.0 3.9 1 1 
       70 1 . . . . . 0.0 0.0 4.0 1 1 
       71 1 . . . . . 0.0 0.0 3.9 1 1 
       72 1 . . . . . 0.0 0.0 3.9 1 1 
       73 1 . . . . . 0.0 0.0 4.3 1 1 
       74 1 . . . . . 0.0 0.0 3.5 1 1 
       75 1 . . . . . 0.0 0.0 5.0 1 1 
       76 1 . . . . . 0.0 0.0 4.0 1 1 
       77 1 . . . . . 0.0 0.0 4.1 1 1 
       78 1 . . . . . 0.0 0.0 3.9 1 1 
       79 1 . . . . . 0.0 0.0 3.7 1 1 
       80 1 . . . . . 0.0 0.0 4.5 1 1 
       81 1 . . . . . 0.0 0.0 3.7 1 1 
       82 1 . . . . . 0.0 0.0 4.4 1 1 
       83 1 . . . . . 0.0 0.0 3.7 1 1 
       84 1 . . . . . 0.0 0.0 3.7 1 1 
       85 1 . . . . . 0.0 0.0 3.8 1 1 
       86 1 . . . . . 0.0 0.0 3.7 1 1 
    stop_

save_


save_conformer_family_coord_set_1
    _Conformer_family_coord_set.Sf_category  conformer_family_coord_set
    _Conformer_family_coord_set.Entry_ID     1
    _Conformer_family_coord_set.ID           1

    loop_
       _Atom_site.Model_ID
       _Atom_site.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.Occupancy
       _Atom_site.Uncertainty
       _Atom_site.PDBX_label_asym_ID
       _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.Entry_ID
       _Atom_site.Conformer_family_coord_set_ID

        1    1 1 1 1 CYS C    C 19.925 17.046 20.631 1.00 . A A . 2 CYS C    1 1 
        1    2 1 1 1 CYS CA   C 21.418 17.449 20.741 1.00 . A A . 2 CYS CA   1 1 
        1    3 1 1 1 CYS CB   C 22.160 17.245 19.395 1.00 . A A . 2 CYS CB   1 1 
        1    4 1 1 1 CYS H1   H 22.881 16.068 21.462 1.00 . A A . 2 CYS H1   1 1 
        1    5 1 1 1 CYS HA   H 21.470 18.477 21.060 1.00 . A A . 2 CYS HA   1 1 
        1    6 1 1 1 CYS HB2  H 21.434 16.993 18.627 1.00 . A A . 2 CYS HB2  1 1 
        1    7 1 1 1 CYS HB3  H 22.618 18.179 19.106 1.00 . A A . 2 CYS HB3  1 1 
        1    8 1 1 1 CYS N    N 22.117 16.613 21.766 1.00 . A A . 2 CYS N    1 1 
        1    9 1 1 1 CYS O    O 19.527 16.098 21.286 1.00 . A A . 2 CYS O    1 1 
        1   10 1 1 1 CYS SG   S 23.457 15.980 19.308 1.00 . A A . 2 CYS SG   1 1 
        1   11 1 1 2 HYP C    C 19.704 20.136 20.229 1.00 . A A . 3 HYP C    1 1 
        1   12 1 1 2 HYP CA   C 19.465 19.037 19.177 1.00 . A A . 3 HYP CA   1 1 
        1   13 1 1 2 HYP CB   C 18.270 19.359 18.274 1.00 . A A . 3 HYP CB   1 1 
        1   14 1 1 2 HYP CD   C 17.765 17.265 19.504 1.00 . A A . 3 HYP CD   1 1 
        1   15 1 1 2 HYP CG   C 17.432 18.061 18.228 1.00 . A A . 3 HYP CG   1 1 
        1   16 1 1 2 HYP HA   H 20.343 18.916 18.562 1.00 . A A . 3 HYP HA   1 1 
        1   17 1 1 2 HYP HB2  H 18.587 19.693 17.299 1.00 . A A . 3 HYP HB2  1 1 
        1   18 1 1 2 HYP HB3  H 17.670 20.139 18.720 1.00 . A A . 3 HYP HB3  1 1 
        1   19 1 1 2 HYP HD1  H 17.301 17.011 16.617 1.00 . A A . 3 HYP HD1  1 1 
        1   20 1 1 2 HYP HD22 H 17.776 16.196 19.358 1.00 . A A . 3 HYP HD22 1 1 
        1   21 1 1 2 HYP HD23 H 17.105 17.499 20.325 1.00 . A A . 3 HYP HD23 1 1 
        1   22 1 1 2 HYP HG   H 16.374 18.208 18.058 1.00 . A A . 3 HYP HG   1 1 
        1   23 1 1 2 HYP N    N 19.132 17.737 19.841 1.00 . A A . 3 HYP N    1 1 
        1   24 1 1 2 HYP O    O 18.807 20.452 20.981 1.00 . A A . 3 HYP O    1 1 
        1   25 1 1 2 HYP OD1  O 18.024 17.308 17.183 1.00 . A A . 3 HYP OD1  1 1 
        1   26 1 1 3 DTR C    C 22.505 22.452 20.438 1.00 . A A . 4 DTR C    1 1 
        1   27 1 1 3 DTR CA   C 21.386 21.723 21.175 1.00 . A A . 4 DTR CA   1 1 
        1   28 1 1 3 DTR CB   C 20.269 22.764 21.554 1.00 . A A . 4 DTR CB   1 1 
        1   29 1 1 3 DTR CD1  C 18.765 23.108 19.539 1.00 . A A . 4 DTR CD1  1 1 
        1   30 1 1 3 DTR CD2  C 19.965 24.857 20.088 1.00 . A A . 4 DTR CD2  1 1 
        1   31 1 1 3 DTR CE2  C 19.221 25.250 18.988 1.00 . A A . 4 DTR CE2  1 1 
        1   32 1 1 3 DTR CE3  C 20.846 25.740 20.694 1.00 . A A . 4 DTR CE3  1 1 
        1   33 1 1 3 DTR CG   C 19.679 23.578 20.399 1.00 . A A . 4 DTR CG   1 1 
        1   34 1 1 3 DTR CH2  C 20.242 27.432 19.094 1.00 . A A . 4 DTR CH2  1 1 
        1   35 1 1 3 DTR CZ2  C 19.358 26.539 18.488 1.00 . A A . 4 DTR CZ2  1 1 
        1   36 1 1 3 DTR CZ3  C 20.991 27.035 20.202 1.00 . A A . 4 DTR CZ3  1 1 
        1   37 1 1 3 DTR H    H 21.560 20.320 19.605 1.00 . A A . 4 DTR H    1 1 
        1   38 1 1 3 DTR HA   H 21.725 21.298 22.091 1.00 . A A . 4 DTR HA   1 1 
        1   39 1 1 3 DTR HB2  H 20.740 23.449 22.223 1.00 . A A . 4 DTR HB2  1 1 
        1   40 1 1 3 DTR HB3  H 19.465 22.297 22.102 1.00 . A A . 4 DTR HB3  1 1 
        1   41 1 1 3 DTR HD1  H 18.358 22.114 19.553 1.00 . A A . 4 DTR HD1  1 1 
        1   42 1 1 3 DTR HE1  H 17.907 24.102 17.995 1.00 . A A . 4 DTR HE1  1 1 
        1   43 1 1 3 DTR HE3  H 21.411 25.395 21.544 1.00 . A A . 4 DTR HE3  1 1 
        1   44 1 1 3 DTR HH2  H 20.343 28.433 18.706 1.00 . A A . 4 DTR HH2  1 1 
        1   45 1 1 3 DTR HZ2  H 18.782 26.849 17.627 1.00 . A A . 4 DTR HZ2  1 1 
        1   46 1 1 3 DTR HZ3  H 21.678 27.726 20.670 1.00 . A A . 4 DTR HZ3  1 1 
        1   47 1 1 3 DTR N    N 20.907 20.648 20.253 1.00 . A A . 4 DTR N    1 1 
        1   48 1 1 3 DTR NE1  N 18.543 24.141 18.743 1.00 . A A . 4 DTR NE1  1 1 
        1   49 1 1 3 DTR O    O 22.395 23.504 19.851 1.00 . A A . 4 DTR O    1 1 
        1   50 1 1 4 GLN C    C 25.064 21.431 18.672 1.00 . A A . 5 GLN C    1 1 
        1   51 1 1 4 GLN CA   C 24.835 22.382 19.827 1.00 . A A . 5 GLN CA   1 1 
        1   52 1 1 4 GLN CB   C 26.057 22.343 20.729 1.00 . A A . 5 GLN CB   1 1 
        1   53 1 1 4 GLN CD   C 24.893 23.893 22.420 1.00 . A A . 5 GLN CD   1 1 
        1   54 1 1 4 GLN CG   C 26.140 23.598 21.586 1.00 . A A . 5 GLN CG   1 1 
        1   55 1 1 4 GLN H    H 23.699 20.963 20.971 1.00 . A A . 5 GLN H    1 1 
        1   56 1 1 4 GLN HA   H 24.634 23.387 19.497 1.00 . A A . 5 GLN HA   1 1 
        1   57 1 1 4 GLN HB2  H 26.103 21.447 21.306 1.00 . A A . 5 GLN HB2  1 1 
        1   58 1 1 4 GLN HB3  H 26.926 22.333 20.093 1.00 . A A . 5 GLN HB3  1 1 
        1   59 1 1 4 GLN HE21 H 23.767 24.611 20.935 1.00 . A A . 5 GLN HE21 1 1 
        1   60 1 1 4 GLN HE22 H 23.053 24.605 22.467 1.00 . A A . 5 GLN HE22 1 1 
        1   61 1 1 4 GLN HG2  H 26.980 23.519 22.260 1.00 . A A . 5 GLN HG2  1 1 
        1   62 1 1 4 GLN HG3  H 26.323 24.393 20.884 1.00 . A A . 5 GLN HG3  1 1 
        1   63 1 1 4 GLN N    N 23.637 21.815 20.496 1.00 . A A . 5 GLN N    1 1 
        1   64 1 1 4 GLN NE2  N 23.825 24.408 21.898 1.00 . A A . 5 GLN NE2  1 1 
        1   65 1 1 4 GLN O    O 25.250 20.258 18.910 1.00 . A A . 5 GLN O    1 1 
        1   66 1 1 4 GLN OE1  O 24.863 23.661 23.614 1.00 . A A . 5 GLN OE1  1 1 
        1   67 1 1 5 PRO C    C 26.376 20.330 16.075 1.00 . A A . 6 PRO C    1 1 
        1   68 1 1 5 PRO CA   C 25.012 21.004 16.297 1.00 . A A . 6 PRO CA   1 1 
        1   69 1 1 5 PRO CB   C 24.548 21.897 15.147 1.00 . A A . 6 PRO CB   1 1 
        1   70 1 1 5 PRO CD   C 25.108 23.352 17.103 1.00 . A A . 6 PRO CD   1 1 
        1   71 1 1 5 PRO CG   C 24.758 23.380 15.601 1.00 . A A . 6 PRO CG   1 1 
        1   72 1 1 5 PRO HA   H 24.282 20.227 16.480 1.00 . A A . 6 PRO HA   1 1 
        1   73 1 1 5 PRO HB2  H 25.061 21.661 14.223 1.00 . A A . 6 PRO HB2  1 1 
        1   74 1 1 5 PRO HB3  H 23.489 21.698 15.027 1.00 . A A . 6 PRO HB3  1 1 
        1   75 1 1 5 PRO HD2  H 26.094 23.757 17.282 1.00 . A A . 6 PRO HD2  1 1 
        1   76 1 1 5 PRO HD3  H 24.386 23.886 17.697 1.00 . A A . 6 PRO HD3  1 1 
        1   77 1 1 5 PRO HG2  H 25.558 23.838 15.035 1.00 . A A . 6 PRO HG2  1 1 
        1   78 1 1 5 PRO HG3  H 23.855 23.950 15.444 1.00 . A A . 6 PRO HG3  1 1 
        1   79 1 1 5 PRO N    N 25.063 21.911 17.461 1.00 . A A . 6 PRO N    1 1 
        1   80 1 1 5 PRO O    O 26.602 19.664 15.082 1.00 . A A . 6 PRO O    1 1 
        1   81 1 1 6 TRP C    C 28.701 18.873 18.010 1.00 . A A . 7 TRP C    1 1 
        1   82 1 1 6 TRP CA   C 28.623 19.913 16.905 1.00 . A A . 7 TRP CA   1 1 
        1   83 1 1 6 TRP CB   C 29.726 20.979 17.138 1.00 . A A . 7 TRP CB   1 1 
        1   84 1 1 6 TRP CD1  C 30.644 20.573 19.499 1.00 . A A . 7 TRP CD1  1 1 
        1   85 1 1 6 TRP CD2  C 29.519 22.421 19.280 1.00 . A A . 7 TRP CD2  1 1 
        1   86 1 1 6 TRP CE2  C 29.944 22.411 20.600 1.00 . A A . 7 TRP CE2  1 1 
        1   87 1 1 6 TRP CE3  C 28.763 23.453 18.778 1.00 . A A . 7 TRP CE3  1 1 
        1   88 1 1 6 TRP CG   C 29.942 21.331 18.628 1.00 . A A . 7 TRP CG   1 1 
        1   89 1 1 6 TRP CH2  C 28.841 24.538 20.923 1.00 . A A . 7 TRP CH2  1 1 
        1   90 1 1 6 TRP CZ2  C 29.599 23.481 21.420 1.00 . A A . 7 TRP CZ2  1 1 
        1   91 1 1 6 TRP CZ3  C 28.418 24.524 19.594 1.00 . A A . 7 TRP CZ3  1 1 
        1   92 1 1 6 TRP H    H 27.066 21.093 17.793 1.00 . A A . 7 TRP H    1 1 
        1   93 1 1 6 TRP HA   H 28.748 19.418 15.949 1.00 . A A . 7 TRP HA   1 1 
        1   94 1 1 6 TRP HB2  H 30.656 20.576 16.765 1.00 . A A . 7 TRP HB2  1 1 
        1   95 1 1 6 TRP HB3  H 29.521 21.882 16.600 1.00 . A A . 7 TRP HB3  1 1 
        1   96 1 1 6 TRP HD1  H 31.103 19.625 19.299 1.00 . A A . 7 TRP HD1  1 1 
        1   97 1 1 6 TRP HE1  H 31.029 20.941 21.454 1.00 . A A . 7 TRP HE1  1 1 
        1   98 1 1 6 TRP HE3  H 28.447 23.381 17.755 1.00 . A A . 7 TRP HE3  1 1 
        1   99 1 1 6 TRP HH2  H 28.586 25.371 21.570 1.00 . A A . 7 TRP HH2  1 1 
        1  100 1 1 6 TRP HZ2  H 29.914 23.499 22.452 1.00 . A A . 7 TRP HZ2  1 1 
        1  101 1 1 6 TRP HZ3  H 27.821 25.334 19.201 1.00 . A A . 7 TRP HZ3  1 1 
        1  102 1 1 6 TRP N    N 27.268 20.530 17.010 1.00 . A A . 7 TRP N    1 1 
        1  103 1 1 6 TRP NE1  N 30.601 21.266 20.624 1.00 . A A . 7 TRP NE1  1 1 
        1  104 1 1 6 TRP O    O 29.717 18.226 18.151 1.00 . A A . 7 TRP O    1 1 
        1  105 1 1 7 .   C    C 28.360 16.547 19.718 1.00 . A A . 8 CY3 C    1 1 
        1  106 1 1 7 .   CA   C 27.514 17.816 19.868 1.00 . A A . 8 CY3 CA   1 1 
        1  107 1 1 7 .   CB   C 26.018 17.432 20.042 1.00 . A A . 8 CY3 CB   1 1 
        1  108 1 1 7 .   H    H 26.844 19.319 18.544 1.00 . A A . 8 CY3 H    1 1 
        1  109 1 1 7 .   HA   H 27.886 18.404 20.701 1.00 . A A . 8 CY3 HA   1 1 
        1  110 1 1 7 .   HB2  H 25.507 18.259 20.506 1.00 . A A . 8 CY3 HB2  1 1 
        1  111 1 1 7 .   HB3  H 25.971 16.611 20.743 1.00 . A A . 8 CY3 HB3  1 1 
        1  112 1 1 7 .   HN11 H 27.260 15.882 18.213 1.00 . A A . 8 CY3 HN11 1 1 
        1  113 1 1 7 .   HN12 H 28.538 14.877 18.683 1.00 . A A . 8 CY3 HN12 1 1 
        1  114 1 1 7 .   N    N 27.624 18.762 18.739 1.00 . A A . 8 CY3 N    1 1 
        1  115 1 1 7 .   N1   N 28.028 15.701 18.792 1.00 . A A . 8 CY3 N1   1 1 
        1  116 1 1 7 .   O    O 29.311 16.319 20.434 1.00 . A A . 8 CY3 O    1 1 
        1  117 1 1 7 .   SG   S 25.073 16.945 18.572 1.00 . A A . 8 CY3 SG   1 1 
        2  118 1 1 1 CYS C    C 20.136 17.178 20.552 1.00 . A A . 2 CYS C    1 1 
        2  119 1 1 1 CYS CA   C 21.615 17.632 20.670 1.00 . A A . 2 CYS CA   1 1 
        2  120 1 1 1 CYS CB   C 22.397 17.417 19.342 1.00 . A A . 2 CYS CB   1 1 
        2  121 1 1 1 CYS H1   H 21.765 16.099 22.149 1.00 . A A . 2 CYS H1   1 1 
        2  122 1 1 1 CYS HA   H 21.636 18.660 20.991 1.00 . A A . 2 CYS HA   1 1 
        2  123 1 1 1 CYS HB2  H 21.687 17.268 18.542 1.00 . A A . 2 CYS HB2  1 1 
        2  124 1 1 1 CYS HB3  H 22.957 18.315 19.120 1.00 . A A . 2 CYS HB3  1 1 
        2  125 1 1 1 CYS N    N 22.284 16.816 21.720 1.00 . A A . 2 CYS N    1 1 
        2  126 1 1 1 CYS O    O 19.766 16.240 21.236 1.00 . A A . 2 CYS O    1 1 
        2  127 1 1 1 CYS SG   S 23.559 16.031 19.243 1.00 . A A . 2 CYS SG   1 1 
        2  128 1 1 2 HYP C    C 19.695 20.286 20.047 1.00 . A A . 3 HYP C    1 1 
        2  129 1 1 2 HYP CA   C 19.642 19.112 19.042 1.00 . A A . 3 HYP CA   1 1 
        2  130 1 1 2 HYP CB   C 18.532 19.320 17.994 1.00 . A A . 3 HYP CB   1 1 
        2  131 1 1 2 HYP CD   C 17.986 17.294 19.388 1.00 . A A . 3 HYP CD   1 1 
        2  132 1 1 2 HYP CG   C 17.584 18.101 18.115 1.00 . A A . 3 HYP CG   1 1 
        2  133 1 1 2 HYP HA   H 20.586 19.033 18.517 1.00 . A A . 3 HYP HA   1 1 
        2  134 1 1 2 HYP HB2  H 18.967 19.424 17.013 1.00 . A A . 3 HYP HB2  1 1 
        2  135 1 1 2 HYP HB3  H 17.971 20.222 18.218 1.00 . A A . 3 HYP HB3  1 1 
        2  136 1 1 2 HYP HD1  H 17.268 16.606 16.936 1.00 . A A . 3 HYP HD1  1 1 
        2  137 1 1 2 HYP HD22 H 18.047 16.226 19.207 1.00 . A A . 3 HYP HD22 1 1 
        2  138 1 1 2 HYP HD23 H 17.311 17.489 20.213 1.00 . A A . 3 HYP HD23 1 1 
        2  139 1 1 2 HYP HG   H 16.533 18.360 18.096 1.00 . A A . 3 HYP HG   1 1 
        2  140 1 1 2 HYP N    N 19.335 17.823 19.732 1.00 . A A . 3 HYP N    1 1 
        2  141 1 1 2 HYP O    O 18.688 20.653 20.614 1.00 . A A . 3 HYP O    1 1 
        2  142 1 1 2 HYP OD1  O 17.941 17.292 17.007 1.00 . A A . 3 HYP OD1  1 1 
        2  143 1 1 3 DTR C    C 22.483 22.527 20.537 1.00 . A A . 4 DTR C    1 1 
        2  144 1 1 3 DTR CA   C 21.217 21.931 21.156 1.00 . A A . 4 DTR CA   1 1 
        2  145 1 1 3 DTR CB   C 20.100 23.038 21.198 1.00 . A A . 4 DTR CB   1 1 
        2  146 1 1 3 DTR CD1  C 18.773 23.094 19.026 1.00 . A A . 4 DTR CD1  1 1 
        2  147 1 1 3 DTR CD2  C 20.045 24.842 19.354 1.00 . A A . 4 DTR CD2  1 1 
        2  148 1 1 3 DTR CE2  C 19.397 25.071 18.147 1.00 . A A . 4 DTR CE2  1 1 
        2  149 1 1 3 DTR CE3  C 20.932 25.778 19.857 1.00 . A A . 4 DTR CE3  1 1 
        2  150 1 1 3 DTR CG   C 19.658 23.659 19.867 1.00 . A A . 4 DTR CG   1 1 
        2  151 1 1 3 DTR CH2  C 20.533 27.186 17.935 1.00 . A A . 4 DTR CH2  1 1 
        2  152 1 1 3 DTR CZ2  C 19.639 26.241 17.437 1.00 . A A . 4 DTR CZ2  1 1 
        2  153 1 1 3 DTR CZ3  C 21.182 26.955 19.149 1.00 . A A . 4 DTR CZ3  1 1 
        2  154 1 1 3 DTR H    H 21.621 20.388 19.754 1.00 . A A . 4 DTR H    1 1 
        2  155 1 1 3 DTR HA   H 21.369 21.603 22.151 1.00 . A A . 4 DTR HA   1 1 
        2  156 1 1 3 DTR HB2  H 20.504 23.820 21.803 1.00 . A A . 4 DTR HB2  1 1 
        2  157 1 1 3 DTR HB3  H 19.226 22.655 21.708 1.00 . A A . 4 DTR HB3  1 1 
        2  158 1 1 3 DTR HD1  H 18.288 22.151 19.170 1.00 . A A . 4 DTR HD1  1 1 
        2  159 1 1 3 DTR HE1  H 18.074 23.836 17.275 1.00 . A A . 4 DTR HE1  1 1 
        2  160 1 1 3 DTR HE3  H 21.424 25.550 20.795 1.00 . A A . 4 DTR HE3  1 1 
        2  161 1 1 3 DTR HH2  H 20.724 28.098 17.386 1.00 . A A . 4 DTR HH2  1 1 
        2  162 1 1 3 DTR HZ2  H 19.138 26.419 16.498 1.00 . A A . 4 DTR HZ2  1 1 
        2  163 1 1 3 DTR HZ3  H 21.873 27.690 19.533 1.00 . A A . 4 DTR HZ3  1 1 
        2  164 1 1 3 DTR N    N 20.881 20.786 20.249 1.00 . A A . 4 DTR N    1 1 
        2  165 1 1 3 DTR NE1  N 18.669 23.973 18.048 1.00 . A A . 4 DTR NE1  1 1 
        2  166 1 1 3 DTR O    O 22.583 23.644 20.091 1.00 . A A . 4 DTR O    1 1 
        2  167 1 1 4 GLN C    C 24.934 21.182 18.778 1.00 . A A . 5 GLN C    1 1 
        2  168 1 1 4 GLN CA   C 24.784 22.094 19.970 1.00 . A A . 5 GLN CA   1 1 
        2  169 1 1 4 GLN CB   C 25.961 21.831 20.887 1.00 . A A . 5 GLN CB   1 1 
        2  170 1 1 4 GLN CD   C 24.815 22.797 22.946 1.00 . A A . 5 GLN CD   1 1 
        2  171 1 1 4 GLN CG   C 26.011 22.865 21.988 1.00 . A A . 5 GLN CG   1 1 
        2  172 1 1 4 GLN H    H 23.372 20.788 20.915 1.00 . A A . 5 GLN H    1 1 
        2  173 1 1 4 GLN HA   H 24.768 23.130 19.689 1.00 . A A . 5 GLN HA   1 1 
        2  174 1 1 4 GLN HB2  H 26.049 20.821 21.211 1.00 . A A . 5 GLN HB2  1 1 
        2  175 1 1 4 GLN HB3  H 26.809 22.012 20.250 1.00 . A A . 5 GLN HB3  1 1 
        2  176 1 1 4 GLN HE21 H 24.796 20.822 23.023 1.00 . A A . 5 GLN HE21 1 1 
        2  177 1 1 4 GLN HE22 H 23.604 21.603 23.952 1.00 . A A . 5 GLN HE22 1 1 
        2  178 1 1 4 GLN HG2  H 26.917 22.773 22.566 1.00 . A A . 5 GLN HG2  1 1 
        2  179 1 1 4 GLN HG3  H 26.028 23.797 21.444 1.00 . A A . 5 GLN HG3  1 1 
        2  180 1 1 4 GLN N    N 23.480 21.684 20.541 1.00 . A A . 5 GLN N    1 1 
        2  181 1 1 4 GLN NE2  N 24.370 21.644 23.337 1.00 . A A . 5 GLN NE2  1 1 
        2  182 1 1 4 GLN O    O 25.130 20.005 18.970 1.00 . A A . 5 GLN O    1 1 
        2  183 1 1 4 GLN OE1  O 24.263 23.796 23.361 1.00 . A A . 5 GLN OE1  1 1 
        2  184 1 1 5 PRO C    C 26.228 20.261 16.146 1.00 . A A . 6 PRO C    1 1 
        2  185 1 1 5 PRO CA   C 24.832 20.827 16.401 1.00 . A A . 6 PRO CA   1 1 
        2  186 1 1 5 PRO CB   C 24.290 21.720 15.272 1.00 . A A . 6 PRO CB   1 1 
        2  187 1 1 5 PRO CD   C 24.752 23.147 17.284 1.00 . A A . 6 PRO CD   1 1 
        2  188 1 1 5 PRO CG   C 24.207 23.188 15.843 1.00 . A A . 6 PRO CG   1 1 
        2  189 1 1 5 PRO HA   H 24.175 19.998 16.611 1.00 . A A . 6 PRO HA   1 1 
        2  190 1 1 5 PRO HB2  H 24.931 21.665 14.399 1.00 . A A . 6 PRO HB2  1 1 
        2  191 1 1 5 PRO HB3  H 23.299 21.367 15.011 1.00 . A A . 6 PRO HB3  1 1 
        2  192 1 1 5 PRO HD2  H 25.734 23.597 17.339 1.00 . A A . 6 PRO HD2  1 1 
        2  193 1 1 5 PRO HD3  H 24.101 23.607 18.014 1.00 . A A . 6 PRO HD3  1 1 
        2  194 1 1 5 PRO HG2  H 24.805 23.861 15.242 1.00 . A A . 6 PRO HG2  1 1 
        2  195 1 1 5 PRO HG3  H 23.184 23.537 15.850 1.00 . A A . 6 PRO HG3  1 1 
        2  196 1 1 5 PRO N    N 24.847 21.700 17.588 1.00 . A A . 6 PRO N    1 1 
        2  197 1 1 5 PRO O    O 26.471 19.631 15.139 1.00 . A A . 6 PRO O    1 1 
        2  198 1 1 6 TRP C    C 28.710 18.905 17.967 1.00 . A A . 7 TRP C    1 1 
        2  199 1 1 6 TRP CA   C 28.499 19.997 16.924 1.00 . A A . 7 TRP CA   1 1 
        2  200 1 1 6 TRP CB   C 29.494 21.149 17.167 1.00 . A A . 7 TRP CB   1 1 
        2  201 1 1 6 TRP CD1  C 30.556 20.617 19.430 1.00 . A A . 7 TRP CD1  1 1 
        2  202 1 1 6 TRP CD2  C 29.281 22.387 19.431 1.00 . A A . 7 TRP CD2  1 1 
        2  203 1 1 6 TRP CE2  C 29.773 22.287 20.727 1.00 . A A . 7 TRP CE2  1 1 
        2  204 1 1 6 TRP CE3  C 28.416 23.399 19.074 1.00 . A A . 7 TRP CE3  1 1 
        2  205 1 1 6 TRP CG   C 29.755 21.389 18.668 1.00 . A A . 7 TRP CG   1 1 
        2  206 1 1 6 TRP CH2  C 28.534 24.264 21.314 1.00 . A A . 7 TRP CH2  1 1 
        2  207 1 1 6 TRP CZ2  C 29.398 23.234 21.669 1.00 . A A . 7 TRP CZ2  1 1 
        2  208 1 1 6 TRP CZ3  C 28.037 24.346 20.016 1.00 . A A . 7 TRP CZ3  1 1 
        2  209 1 1 6 TRP H    H 26.894 21.028 17.874 1.00 . A A . 7 TRP H    1 1 
        2  210 1 1 6 TRP HA   H 28.635 19.588 15.939 1.00 . A A . 7 TRP HA   1 1 
        2  211 1 1 6 TRP HB2  H 30.439 20.918 16.702 1.00 . A A . 7 TRP HB2  1 1 
        2  212 1 1 6 TRP HB3  H 29.136 22.060 16.732 1.00 . A A . 7 TRP HB3  1 1 
        2  213 1 1 6 TRP HD1  H 31.075 19.732 19.114 1.00 . A A . 7 TRP HD1  1 1 
        2  214 1 1 6 TRP HE1  H 31.005 20.815 21.373 1.00 . A A . 7 TRP HE1  1 1 
        2  215 1 1 6 TRP HE3  H 28.043 23.410 18.066 1.00 . A A . 7 TRP HE3  1 1 
        2  216 1 1 6 TRP HH2  H 28.248 25.000 22.053 1.00 . A A . 7 TRP HH2  1 1 
        2  217 1 1 6 TRP HZ2  H 29.780 23.174 22.678 1.00 . A A . 7 TRP HZ2  1 1 
        2  218 1 1 6 TRP HZ3  H 27.352 25.133 19.749 1.00 . A A . 7 TRP HZ3  1 1 
        2  219 1 1 6 TRP N    N 27.115 20.507 17.071 1.00 . A A . 7 TRP N    1 1 
        2  220 1 1 6 TRP NE1  N 30.515 21.197 20.610 1.00 . A A . 7 TRP NE1  1 1 
        2  221 1 1 6 TRP O    O 29.769 18.309 18.006 1.00 . A A . 7 TRP O    1 1 
        2  222 1 1 7 .   C    C 28.566 16.487 19.648 1.00 . A A . 8 CY3 C    1 1 
        2  223 1 1 7 .   CA   C 27.670 17.711 19.845 1.00 . A A . 8 CY3 CA   1 1 
        2  224 1 1 7 .   CB   C 26.211 17.253 20.051 1.00 . A A . 8 CY3 CB   1 1 
        2  225 1 1 7 .   H    H 26.867 19.229 18.594 1.00 . A A . 8 CY3 H    1 1 
        2  226 1 1 7 .   HA   H 28.035 18.273 20.695 1.00 . A A . 8 CY3 HA   1 1 
        2  227 1 1 7 .   HB2  H 25.671 18.032 20.570 1.00 . A A . 8 CY3 HB2  1 1 
        2  228 1 1 7 .   HB3  H 26.214 16.386 20.690 1.00 . A A . 8 CY3 HB3  1 1 
        2  229 1 1 7 .   HN11 H 29.221 16.479 21.519 1.00 . A A . 8 CY3 HN11 1 1 
        2  230 1 1 7 .   HN12 H 29.820 15.250 20.512 1.00 . A A . 8 CY3 HN12 1 1 
        2  231 1 1 7 .   N    N 27.682 18.707 18.745 1.00 . A A . 8 CY3 N    1 1 
        2  232 1 1 7 .   N1   N 29.260 16.041 20.646 1.00 . A A . 8 CY3 N1   1 1 
        2  233 1 1 7 .   O    O 28.649 15.907 18.587 1.00 . A A . 8 CY3 O    1 1 
        2  234 1 1 7 .   SG   S 25.275 16.841 18.557 1.00 . A A . 8 CY3 SG   1 1 
        3  235 1 1 1 CYS C    C 20.120 17.169 20.579 1.00 . A A . 2 CYS C    1 1 
        3  236 1 1 1 CYS CA   C 21.590 17.660 20.668 1.00 . A A . 2 CYS CA   1 1 
        3  237 1 1 1 CYS CB   C 22.337 17.426 19.325 1.00 . A A . 2 CYS CB   1 1 
        3  238 1 1 1 CYS H1   H 21.885 16.096 22.084 1.00 . A A . 2 CYS H1   1 1 
        3  239 1 1 1 CYS HA   H 21.589 18.693 20.953 1.00 . A A . 2 CYS HA   1 1 
        3  240 1 1 1 CYS HB2  H 21.604 17.276 18.541 1.00 . A A . 2 CYS HB2  1 1 
        3  241 1 1 1 CYS HB3  H 22.893 18.316 19.075 1.00 . A A . 2 CYS HB3  1 1 
        3  242 1 1 1 CYS N    N 22.307 16.910 21.733 1.00 . A A . 2 CYS N    1 1 
        3  243 1 1 1 CYS O    O 19.772 16.244 21.291 1.00 . A A . 2 CYS O    1 1 
        3  244 1 1 1 CYS SG   S 23.486 16.036 19.186 1.00 . A A . 2 CYS SG   1 1 
        3  245 1 1 2 HYP C    C 19.672 20.203 20.122 1.00 . A A . 3 HYP C    1 1 
        3  246 1 1 2 HYP CA   C 19.562 19.089 19.064 1.00 . A A . 3 HYP CA   1 1 
        3  247 1 1 2 HYP CB   C 18.383 19.312 18.107 1.00 . A A . 3 HYP CB   1 1 
        3  248 1 1 2 HYP CD   C 17.970 17.218 19.403 1.00 . A A . 3 HYP CD   1 1 
        3  249 1 1 2 HYP CG   C 17.570 18.006 18.123 1.00 . A A . 3 HYP CG   1 1 
        3  250 1 1 2 HYP HA   H 20.470 19.021 18.497 1.00 . A A . 3 HYP HA   1 1 
        3  251 1 1 2 HYP HB2  H 18.740 19.577 17.122 1.00 . A A . 3 HYP HB2  1 1 
        3  252 1 1 2 HYP HB3  H 17.763 20.114 18.470 1.00 . A A . 3 HYP HB3  1 1 
        3  253 1 1 2 HYP HD1  H 17.343 17.036 16.481 1.00 . A A . 3 HYP HD1  1 1 
        3  254 1 1 2 HYP HD22 H 18.067 16.152 19.230 1.00 . A A . 3 HYP HD22 1 1 
        3  255 1 1 2 HYP HD23 H 17.282 17.393 20.217 1.00 . A A . 3 HYP HD23 1 1 
        3  256 1 1 2 HYP HG   H 16.502 18.152 18.021 1.00 . A A . 3 HYP HG   1 1 
        3  257 1 1 2 HYP N    N 19.294 17.790 19.756 1.00 . A A . 3 HYP N    1 1 
        3  258 1 1 2 HYP O    O 18.706 20.512 20.783 1.00 . A A . 3 HYP O    1 1 
        3  259 1 1 2 HYP OD1  O 18.101 17.281 17.028 1.00 . A A . 3 HYP OD1  1 1 
        3  260 1 1 3 DTR C    C 22.426 22.511 20.557 1.00 . A A . 4 DTR C    1 1 
        3  261 1 1 3 DTR CA   C 21.236 21.826 21.221 1.00 . A A . 4 DTR CA   1 1 
        3  262 1 1 3 DTR CB   C 20.089 22.872 21.434 1.00 . A A . 4 DTR CB   1 1 
        3  263 1 1 3 DTR CD1  C 18.763 23.094 19.275 1.00 . A A . 4 DTR CD1  1 1 
        3  264 1 1 3 DTR CD2  C 19.873 24.887 19.847 1.00 . A A . 4 DTR CD2  1 1 
        3  265 1 1 3 DTR CE2  C 19.219 25.216 18.669 1.00 . A A . 4 DTR CE2  1 1 
        3  266 1 1 3 DTR CE3  C 20.679 25.815 20.495 1.00 . A A . 4 DTR CE3  1 1 
        3  267 1 1 3 DTR CG   C 19.592 23.618 20.189 1.00 . A A . 4 DTR CG   1 1 
        3  268 1 1 3 DTR CH2  C 20.169 27.429 18.775 1.00 . A A . 4 DTR CH2  1 1 
        3  269 1 1 3 DTR CZ2  C 19.364 26.488 18.133 1.00 . A A . 4 DTR CZ2  1 1 
        3  270 1 1 3 DTR CZ3  C 20.828 27.094 19.956 1.00 . A A . 4 DTR CZ3  1 1 
        3  271 1 1 3 DTR H    H 21.579 20.392 19.694 1.00 . A A . 4 DTR H    1 1 
        3  272 1 1 3 DTR HA   H 21.485 21.438 22.180 1.00 . A A . 4 DTR HA   1 1 
        3  273 1 1 3 DTR HB2  H 20.491 23.604 22.098 1.00 . A A . 4 DTR HB2  1 1 
        3  274 1 1 3 DTR HB3  H 19.242 22.425 21.932 1.00 . A A . 4 DTR HB3  1 1 
        3  275 1 1 3 DTR HD1  H 18.376 22.094 19.291 1.00 . A A . 4 DTR HD1  1 1 
        3  276 1 1 3 DTR HE1  H 18.023 23.992 17.622 1.00 . A A . 4 DTR HE1  1 1 
        3  277 1 1 3 DTR HE3  H 21.179 25.510 21.407 1.00 . A A . 4 DTR HE3  1 1 
        3  278 1 1 3 DTR HH2  H 20.280 28.420 18.355 1.00 . A A . 4 DTR HH2  1 1 
        3  279 1 1 3 DTR HZ2  H 18.857 26.751 17.218 1.00 . A A . 4 DTR HZ2  1 1 
        3  280 1 1 3 DTR HZ3  H 21.447 27.827 20.449 1.00 . A A . 4 DTR HZ3  1 1 
        3  281 1 1 3 DTR N    N 20.861 20.727 20.268 1.00 . A A . 4 DTR N    1 1 
        3  282 1 1 3 DTR NE1  N 18.589 24.082 18.417 1.00 . A A . 4 DTR NE1  1 1 
        3  283 1 1 3 DTR O    O 22.443 23.636 20.106 1.00 . A A . 4 DTR O    1 1 
        3  284 1 1 4 GLN C    C 24.954 21.272 18.730 1.00 . A A . 5 GLN C    1 1 
        3  285 1 1 4 GLN CA   C 24.740 22.179 19.925 1.00 . A A . 5 GLN CA   1 1 
        3  286 1 1 4 GLN CB   C 25.920 21.995 20.855 1.00 . A A . 5 GLN CB   1 1 
        3  287 1 1 4 GLN CD   C 24.824 23.287 22.791 1.00 . A A . 5 GLN CD   1 1 
        3  288 1 1 4 GLN CG   C 26.009 23.131 21.844 1.00 . A A . 5 GLN CG   1 1 
        3  289 1 1 4 GLN H    H 23.410 20.822 20.905 1.00 . A A . 5 GLN H    1 1 
        3  290 1 1 4 GLN HA   H 24.658 23.213 19.633 1.00 . A A . 5 GLN HA   1 1 
        3  291 1 1 4 GLN HB2  H 25.982 21.025 21.293 1.00 . A A . 5 GLN HB2  1 1 
        3  292 1 1 4 GLN HB3  H 26.782 22.081 20.214 1.00 . A A . 5 GLN HB3  1 1 
        3  293 1 1 4 GLN HE21 H 24.509 21.353 23.067 1.00 . A A . 5 GLN HE21 1 1 
        3  294 1 1 4 GLN HE22 H 23.458 22.397 23.902 1.00 . A A . 5 GLN HE22 1 1 
        3  295 1 1 4 GLN HG2  H 26.906 23.046 22.439 1.00 . A A . 5 GLN HG2  1 1 
        3  296 1 1 4 GLN HG3  H 26.075 24.002 21.207 1.00 . A A . 5 GLN HG3  1 1 
        3  297 1 1 4 GLN N    N 23.464 21.726 20.527 1.00 . A A . 5 GLN N    1 1 
        3  298 1 1 4 GLN NE2  N 24.217 22.258 23.292 1.00 . A A . 5 GLN NE2  1 1 
        3  299 1 1 4 GLN O    O 25.168 20.099 18.931 1.00 . A A . 5 GLN O    1 1 
        3  300 1 1 4 GLN OE1  O 24.442 24.396 23.096 1.00 . A A . 5 GLN OE1  1 1 
        3  301 1 1 5 PRO C    C 26.314 20.307 16.082 1.00 . A A . 6 PRO C    1 1 
        3  302 1 1 5 PRO CA   C 24.920 20.910 16.341 1.00 . A A . 6 PRO CA   1 1 
        3  303 1 1 5 PRO CB   C 24.402 21.815 15.218 1.00 . A A . 6 PRO CB   1 1 
        3  304 1 1 5 PRO CD   C 24.862 23.233 17.229 1.00 . A A . 6 PRO CD   1 1 
        3  305 1 1 5 PRO CG   C 24.399 23.292 15.759 1.00 . A A . 6 PRO CG   1 1 
        3  306 1 1 5 PRO HA   H 24.239 20.091 16.532 1.00 . A A . 6 PRO HA   1 1 
        3  307 1 1 5 PRO HB2  H 24.988 21.708 14.317 1.00 . A A . 6 PRO HB2  1 1 
        3  308 1 1 5 PRO HB3  H 23.386 21.508 15.010 1.00 . A A . 6 PRO HB3  1 1 
        3  309 1 1 5 PRO HD2  H 25.844 23.670 17.350 1.00 . A A . 6 PRO HD2  1 1 
        3  310 1 1 5 PRO HD3  H 24.173 23.702 17.911 1.00 . A A . 6 PRO HD3  1 1 
        3  311 1 1 5 PRO HG2  H 25.066 23.914 15.175 1.00 . A A . 6 PRO HG2  1 1 
        3  312 1 1 5 PRO HG3  H 23.398 23.704 15.709 1.00 . A A . 6 PRO HG3  1 1 
        3  313 1 1 5 PRO N    N 24.916 21.783 17.531 1.00 . A A . 6 PRO N    1 1 
        3  314 1 1 5 PRO O    O 26.590 19.734 15.041 1.00 . A A . 6 PRO O    1 1 
        3  315 1 1 6 TRP C    C 28.715 18.866 18.011 1.00 . A A . 7 TRP C    1 1 
        3  316 1 1 6 TRP CA   C 28.556 19.934 16.939 1.00 . A A . 7 TRP CA   1 1 
        3  317 1 1 6 TRP CB   C 29.575 21.064 17.188 1.00 . A A . 7 TRP CB   1 1 
        3  318 1 1 6 TRP CD1  C 30.553 20.635 19.519 1.00 . A A . 7 TRP CD1  1 1 
        3  319 1 1 6 TRP CD2  C 29.294 22.407 19.364 1.00 . A A . 7 TRP CD2  1 1 
        3  320 1 1 6 TRP CE2  C 29.738 22.387 20.674 1.00 . A A . 7 TRP CE2  1 1 
        3  321 1 1 6 TRP CE3  C 28.456 23.399 18.922 1.00 . A A . 7 TRP CE3  1 1 
        3  322 1 1 6 TRP CG   C 29.786 21.369 18.684 1.00 . A A . 7 TRP CG   1 1 
        3  323 1 1 6 TRP CH2  C 28.497 24.407 21.102 1.00 . A A . 7 TRP CH2  1 1 
        3  324 1 1 6 TRP CZ2  C 29.345 23.392 21.550 1.00 . A A . 7 TRP CZ2  1 1 
        3  325 1 1 6 TRP CZ3  C 28.046 24.406 19.783 1.00 . A A . 7 TRP CZ3  1 1 
        3  326 1 1 6 TRP H    H 26.930 20.953 17.877 1.00 . A A . 7 TRP H    1 1 
        3  327 1 1 6 TRP HA   H 28.716 19.478 15.976 1.00 . A A . 7 TRP HA   1 1 
        3  328 1 1 6 TRP HB2  H 30.530 20.767 16.781 1.00 . A A . 7 TRP HB2  1 1 
        3  329 1 1 6 TRP HB3  H 29.283 21.963 16.684 1.00 . A A . 7 TRP HB3  1 1 
        3  330 1 1 6 TRP HD1  H 31.076 19.728 19.272 1.00 . A A . 7 TRP HD1  1 1 
        3  331 1 1 6 TRP HE1  H 30.931 20.970 21.466 1.00 . A A . 7 TRP HE1  1 1 
        3  332 1 1 6 TRP HE3  H 28.120 23.345 17.908 1.00 . A A . 7 TRP HE3  1 1 
        3  333 1 1 6 TRP HH2  H 28.187 25.192 21.781 1.00 . A A . 7 TRP HH2  1 1 
        3  334 1 1 6 TRP HZ2  H 29.690 23.391 22.580 1.00 . A A . 7 TRP HZ2  1 1 
        3  335 1 1 6 TRP HZ3  H 27.370 25.176 19.445 1.00 . A A . 7 TRP HZ3  1 1 
        3  336 1 1 6 TRP N    N 27.173 20.473 17.051 1.00 . A A . 7 TRP N    1 1 
        3  337 1 1 6 TRP NE1  N 30.476 21.292 20.658 1.00 . A A . 7 TRP NE1  1 1 
        3  338 1 1 6 TRP O    O 29.770 18.279 18.140 1.00 . A A . 7 TRP O    1 1 
        3  339 1 1 7 .   C    C 28.555 16.479 19.647 1.00 . A A . 8 CY3 C    1 1 
        3  340 1 1 7 .   CA   C 27.613 17.677 19.840 1.00 . A A . 8 CY3 CA   1 1 
        3  341 1 1 7 .   CB   C 26.153 17.181 20.002 1.00 . A A . 8 CY3 CB   1 1 
        3  342 1 1 7 .   H    H 26.829 19.164 18.549 1.00 . A A . 8 CY3 H    1 1 
        3  343 1 1 7 .   HA   H 27.949 18.268 20.683 1.00 . A A . 8 CY3 HA   1 1 
        3  344 1 1 7 .   HB2  H 25.609 17.902 20.596 1.00 . A A . 8 CY3 HB2  1 1 
        3  345 1 1 7 .   HB3  H 26.167 16.254 20.563 1.00 . A A . 8 CY3 HB3  1 1 
        3  346 1 1 7 .   HN11 H 29.379 16.645 21.442 1.00 . A A . 8 CY3 HN11 1 1 
        3  347 1 1 7 .   HN12 H 29.971 15.385 20.470 1.00 . A A . 8 CY3 HN12 1 1 
        3  348 1 1 7 .   N    N 27.647 18.662 18.735 1.00 . A A . 8 CY3 N    1 1 
        3  349 1 1 7 .   N1   N 29.365 16.142 20.601 1.00 . A A . 8 CY3 N1   1 1 
        3  350 1 1 7 .   O    O 28.575 15.833 18.622 1.00 . A A . 8 CY3 O    1 1 
        3  351 1 1 7 .   SG   S 25.188 16.880 18.499 1.00 . A A . 8 CY3 SG   1 1 
        4  352 1 1 1 CYS C    C 19.914 17.047 20.748 1.00 . A A . 2 CYS C    1 1 
        4  353 1 1 1 CYS CA   C 21.374 17.437 21.087 1.00 . A A . 2 CYS CA   1 1 
        4  354 1 1 1 CYS CB   C 22.347 16.866 20.034 1.00 . A A . 2 CYS CB   1 1 
        4  355 1 1 1 CYS H1   H 22.282 16.059 22.472 1.00 . A A . 2 CYS H1   1 1 
        4  356 1 1 1 CYS HA   H 21.448 18.507 21.142 1.00 . A A . 2 CYS HA   1 1 
        4  357 1 1 1 CYS HB2  H 21.775 16.350 19.275 1.00 . A A . 2 CYS HB2  1 1 
        4  358 1 1 1 CYS HB3  H 22.840 17.687 19.538 1.00 . A A . 2 CYS HB3  1 1 
        4  359 1 1 1 CYS N    N 21.762 16.895 22.423 1.00 . A A . 2 CYS N    1 1 
        4  360 1 1 1 CYS O    O 19.367 16.216 21.449 1.00 . A A . 2 CYS O    1 1 
        4  361 1 1 1 CYS SG   S 23.633 15.735 20.619 1.00 . A A . 2 CYS SG   1 1 
        4  362 1 1 2 HYP C    C 19.901 20.029 19.877 1.00 . A A . 3 HYP C    1 1 
        4  363 1 1 2 HYP CA   C 19.867 18.788 18.955 1.00 . A A . 3 HYP CA   1 1 
        4  364 1 1 2 HYP CB   C 18.918 18.976 17.743 1.00 . A A . 3 HYP CB   1 1 
        4  365 1 1 2 HYP CD   C 18.002 17.153 19.236 1.00 . A A . 3 HYP CD   1 1 
        4  366 1 1 2 HYP CG   C 17.781 17.931 17.903 1.00 . A A . 3 HYP CG   1 1 
        4  367 1 1 2 HYP HA   H 20.862 18.554 18.604 1.00 . A A . 3 HYP HA   1 1 
        4  368 1 1 2 HYP HB2  H 19.458 18.887 16.812 1.00 . A A . 3 HYP HB2  1 1 
        4  369 1 1 2 HYP HB3  H 18.463 19.954 17.779 1.00 . A A . 3 HYP HB3  1 1 
        4  370 1 1 2 HYP HD1  H 17.208 16.443 16.793 1.00 . A A . 3 HYP HD1  1 1 
        4  371 1 1 2 HYP HD22 H 18.014 16.078 19.135 1.00 . A A . 3 HYP HD22 1 1 
        4  372 1 1 2 HYP HD23 H 17.253 17.427 19.970 1.00 . A A . 3 HYP HD23 1 1 
        4  373 1 1 2 HYP HG   H 16.797 18.390 17.898 1.00 . A A . 3 HYP HG   1 1 
        4  374 1 1 2 HYP N    N 19.323 17.629 19.725 1.00 . A A . 3 HYP N    1 1 
        4  375 1 1 2 HYP O    O 18.851 20.423 20.341 1.00 . A A . 3 HYP O    1 1 
        4  376 1 1 2 HYP OD1  O 17.962 17.044 16.806 1.00 . A A . 3 HYP OD1  1 1 
        4  377 1 1 3 DTR C    C 22.558 22.494 20.538 1.00 . A A . 4 DTR C    1 1 
        4  378 1 1 3 DTR CA   C 21.278 21.785 21.010 1.00 . A A . 4 DTR CA   1 1 
        4  379 1 1 3 DTR CB   C 20.097 22.805 20.892 1.00 . A A . 4 DTR CB   1 1 
        4  380 1 1 3 DTR CD1  C 19.513 22.725 18.398 1.00 . A A . 4 DTR CD1  1 1 
        4  381 1 1 3 DTR CD2  C 20.201 24.658 19.112 1.00 . A A . 4 DTR CD2  1 1 
        4  382 1 1 3 DTR CE2  C 19.949 24.837 17.760 1.00 . A A . 4 DTR CE2  1 1 
        4  383 1 1 3 DTR CE3  C 20.663 25.703 19.896 1.00 . A A . 4 DTR CE3  1 1 
        4  384 1 1 3 DTR CG   C 19.940 23.397 19.480 1.00 . A A . 4 DTR CG   1 1 
        4  385 1 1 3 DTR CH2  C 20.622 27.145 17.969 1.00 . A A . 4 DTR CH2  1 1 
        4  386 1 1 3 DTR CZ2  C 20.161 26.085 17.187 1.00 . A A . 4 DTR CZ2  1 1 
        4  387 1 1 3 DTR CZ3  C 20.873 26.954 19.325 1.00 . A A . 4 DTR CZ3  1 1 
        4  388 1 1 3 DTR H    H 21.864 20.185 19.720 1.00 . A A . 4 DTR H    1 1 
        4  389 1 1 3 DTR HA   H 21.366 21.517 22.035 1.00 . A A . 4 DTR HA   1 1 
        4  390 1 1 3 DTR HB2  H 20.348 23.606 21.543 1.00 . A A . 4 DTR HB2  1 1 
        4  391 1 1 3 DTR HB3  H 19.152 22.411 21.226 1.00 . A A . 4 DTR HB3  1 1 
        4  392 1 1 3 DTR HD1  H 19.221 21.699 18.379 1.00 . A A . 4 DTR HD1  1 1 
        4  393 1 1 3 DTR HE1  H 19.290 23.389 16.504 1.00 . A A . 4 DTR HE1  1 1 
        4  394 1 1 3 DTR HE3  H 20.860 25.518 20.943 1.00 . A A . 4 DTR HE3  1 1 
        4  395 1 1 3 DTR HH2  H 20.787 28.117 17.525 1.00 . A A . 4 DTR HH2  1 1 
        4  396 1 1 3 DTR HZ2  H 19.969 26.238 16.137 1.00 . A A . 4 DTR HZ2  1 1 
        4  397 1 1 3 DTR HZ3  H 21.236 27.768 19.939 1.00 . A A . 4 DTR HZ3  1 1 
        4  398 1 1 3 DTR N    N 21.069 20.572 20.135 1.00 . A A . 4 DTR N    1 1 
        4  399 1 1 3 DTR NE1  N 19.547 23.622 17.430 1.00 . A A . 4 DTR NE1  1 1 
        4  400 1 1 3 DTR O    O 22.633 23.683 20.320 1.00 . A A . 4 DTR O    1 1 
        4  401 1 1 4 GLN C    C 25.063 21.474 18.695 1.00 . A A . 5 GLN C    1 1 
        4  402 1 1 4 GLN CA   C 24.894 22.288 19.945 1.00 . A A . 5 GLN CA   1 1 
        4  403 1 1 4 GLN CB   C 26.106 21.976 20.823 1.00 . A A . 5 GLN CB   1 1 
        4  404 1 1 4 GLN CD   C 25.184 23.016 22.940 1.00 . A A . 5 GLN CD   1 1 
        4  405 1 1 4 GLN CG   C 26.273 23.042 21.861 1.00 . A A . 5 GLN CG   1 1 
        4  406 1 1 4 GLN H    H 23.545 20.764 20.623 1.00 . A A . 5 GLN H    1 1 
        4  407 1 1 4 GLN HA   H 24.800 23.343 19.743 1.00 . A A . 5 GLN HA   1 1 
        4  408 1 1 4 GLN HB2  H 26.157 20.991 21.207 1.00 . A A . 5 GLN HB2  1 1 
        4  409 1 1 4 GLN HB3  H 26.956 22.078 20.169 1.00 . A A . 5 GLN HB3  1 1 
        4  410 1 1 4 GLN HE21 H 23.874 24.098 21.904 1.00 . A A . 5 GLN HE21 1 1 
        4  411 1 1 4 GLN HE22 H 23.380 23.613 23.444 1.00 . A A . 5 GLN HE22 1 1 
        4  412 1 1 4 GLN HG2  H 27.234 22.935 22.350 1.00 . A A . 5 GLN HG2  1 1 
        4  413 1 1 4 GLN HG3  H 26.265 23.957 21.282 1.00 . A A . 5 GLN HG3  1 1 
        4  414 1 1 4 GLN N    N 23.597 21.717 20.411 1.00 . A A . 5 GLN N    1 1 
        4  415 1 1 4 GLN NE2  N 24.058 23.624 22.743 1.00 . A A . 5 GLN NE2  1 1 
        4  416 1 1 4 GLN O    O 25.209 20.274 18.809 1.00 . A A . 5 GLN O    1 1 
        4  417 1 1 4 GLN OE1  O 25.351 22.428 23.991 1.00 . A A . 5 GLN OE1  1 1 
        4  418 1 1 5 PRO C    C 26.360 20.632 16.005 1.00 . A A . 6 PRO C    1 1 
        4  419 1 1 5 PRO CA   C 24.996 21.259 16.309 1.00 . A A . 6 PRO CA   1 1 
        4  420 1 1 5 PRO CB   C 24.474 22.246 15.258 1.00 . A A . 6 PRO CB   1 1 
        4  421 1 1 5 PRO CD   C 25.077 23.537 17.319 1.00 . A A . 6 PRO CD   1 1 
        4  422 1 1 5 PRO CG   C 24.596 23.694 15.860 1.00 . A A . 6 PRO CG   1 1 
        4  423 1 1 5 PRO HA   H 24.301 20.444 16.466 1.00 . A A . 6 PRO HA   1 1 
        4  424 1 1 5 PRO HB2  H 24.996 22.144 14.316 1.00 . A A . 6 PRO HB2  1 1 
        4  425 1 1 5 PRO HB3  H 23.424 21.993 15.144 1.00 . A A . 6 PRO HB3  1 1 
        4  426 1 1 5 PRO HD2  H 26.083 23.910 17.447 1.00 . A A . 6 PRO HD2  1 1 
        4  427 1 1 5 PRO HD3  H 24.431 24.002 18.040 1.00 . A A . 6 PRO HD3  1 1 
        4  428 1 1 5 PRO HG2  H 25.309 24.289 15.309 1.00 . A A . 6 PRO HG2  1 1 
        4  429 1 1 5 PRO HG3  H 23.639 24.200 15.855 1.00 . A A . 6 PRO HG3  1 1 
        4  430 1 1 5 PRO N    N 25.047 22.067 17.540 1.00 . A A . 6 PRO N    1 1 
        4  431 1 1 5 PRO O    O 26.643 20.279 14.877 1.00 . A A . 6 PRO O    1 1 
        4  432 1 1 6 TRP C    C 28.645 18.855 17.978 1.00 . A A . 7 TRP C    1 1 
        4  433 1 1 6 TRP CA   C 28.531 19.935 16.893 1.00 . A A . 7 TRP CA   1 1 
        4  434 1 1 6 TRP CB   C 29.590 21.023 17.121 1.00 . A A . 7 TRP CB   1 1 
        4  435 1 1 6 TRP CD1  C 30.638 20.615 19.419 1.00 . A A . 7 TRP CD1  1 1 
        4  436 1 1 6 TRP CD2  C 29.412 22.396 19.306 1.00 . A A . 7 TRP CD2  1 1 
        4  437 1 1 6 TRP CE2  C 29.909 22.390 20.594 1.00 . A A . 7 TRP CE2  1 1 
        4  438 1 1 6 TRP CE3  C 28.573 23.393 18.887 1.00 . A A . 7 TRP CE3  1 1 
        4  439 1 1 6 TRP CG   C 29.853 21.345 18.609 1.00 . A A . 7 TRP CG   1 1 
        4  440 1 1 6 TRP CH2  C 28.722 24.434 21.057 1.00 . A A . 7 TRP CH2  1 1 
        4  441 1 1 6 TRP CZ2  C 29.569 23.412 21.473 1.00 . A A . 7 TRP CZ2  1 1 
        4  442 1 1 6 TRP CZ3  C 28.220 24.419 19.756 1.00 . A A . 7 TRP CZ3  1 1 
        4  443 1 1 6 TRP H    H 26.924 20.880 17.911 1.00 . A A . 7 TRP H    1 1 
        4  444 1 1 6 TRP HA   H 28.645 19.463 15.924 1.00 . A A . 7 TRP HA   1 1 
        4  445 1 1 6 TRP HB2  H 30.522 20.691 16.692 1.00 . A A . 7 TRP HB2  1 1 
        4  446 1 1 6 TRP HB3  H 29.318 21.935 16.625 1.00 . A A . 7 TRP HB3  1 1 
        4  447 1 1 6 TRP HD1  H 31.129 19.698 19.161 1.00 . A A . 7 TRP HD1  1 1 
        4  448 1 1 6 TRP HE1  H 31.116 20.985 21.352 1.00 . A A . 7 TRP HE1  1 1 
        4  449 1 1 6 TRP HE3  H 28.190 23.340 17.892 1.00 . A A . 7 TRP HE3  1 1 
        4  450 1 1 6 TRP HH2  H 28.467 25.242 21.732 1.00 . A A . 7 TRP HH2  1 1 
        4  451 1 1 6 TRP HZ2  H 29.963 23.419 22.476 1.00 . A A . 7 TRP HZ2  1 1 
        4  452 1 1 6 TRP HZ3  H 27.545 25.195 19.431 1.00 . A A . 7 TRP HZ3  1 1 
        4  453 1 1 6 TRP N    N 27.177 20.539 17.022 1.00 . A A . 7 TRP N    1 1 
        4  454 1 1 6 TRP NE1  N 30.625 21.286 20.559 1.00 . A A . 7 TRP NE1  1 1 
        4  455 1 1 6 TRP O    O 29.675 18.225 18.143 1.00 . A A . 7 TRP O    1 1 
        4  456 1 1 7 .   C    C 28.196 16.334 19.545 1.00 . A A . 8 CY3 C    1 1 
        4  457 1 1 7 .   CA   C 27.518 17.694 19.795 1.00 . A A . 8 CY3 CA   1 1 
        4  458 1 1 7 .   CB   C 26.052 17.424 20.191 1.00 . A A . 8 CY3 CB   1 1 
        4  459 1 1 7 .   H    H 26.760 19.211 18.501 1.00 . A A . 8 CY3 H    1 1 
        4  460 1 1 7 .   HA   H 28.044 18.213 20.587 1.00 . A A . 8 CY3 HA   1 1 
        4  461 1 1 7 .   HB2  H 25.476 18.322 20.071 1.00 . A A . 8 CY3 HB2  1 1 
        4  462 1 1 7 .   HB3  H 26.037 17.188 21.243 1.00 . A A . 8 CY3 HB3  1 1 
        4  463 1 1 7 .   HN11 H 28.651 16.073 21.448 1.00 . A A . 8 CY3 HN11 1 1 
        4  464 1 1 7 .   HN12 H 29.134 14.819 20.424 1.00 . A A . 8 CY3 HN12 1 1 
        4  465 1 1 7 .   N    N 27.566 18.686 18.693 1.00 . A A . 8 CY3 N    1 1 
        4  466 1 1 7 .   N1   N 28.697 15.688 20.548 1.00 . A A . 8 CY3 N1   1 1 
        4  467 1 1 7 .   O    O 28.275 15.827 18.439 1.00 . A A . 8 CY3 O    1 1 
        4  468 1 1 7 .   SG   S 25.162 16.091 19.353 1.00 . A A . 8 CY3 SG   1 1 
        5  469 1 1 1 CYS C    C 20.259 17.142 20.488 1.00 . A A . 2 CYS C    1 1 
        5  470 1 1 1 CYS CA   C 21.632 17.748 20.085 1.00 . A A . 2 CYS CA   1 1 
        5  471 1 1 1 CYS CB   C 22.501 16.679 19.408 1.00 . A A . 2 CYS CB   1 1 
        5  472 1 1 1 CYS H1   H 22.846 17.632 21.823 1.00 . A A . 2 CYS H1   1 1 
        5  473 1 1 1 CYS HA   H 21.498 18.524 19.357 1.00 . A A . 2 CYS HA   1 1 
        5  474 1 1 1 CYS HB2  H 21.849 15.943 18.961 1.00 . A A . 2 CYS HB2  1 1 
        5  475 1 1 1 CYS HB3  H 23.047 17.139 18.599 1.00 . A A . 2 CYS HB3  1 1 
        5  476 1 1 1 CYS N    N 22.371 18.287 21.260 1.00 . A A . 2 CYS N    1 1 
        5  477 1 1 1 CYS O    O 20.259 16.155 21.204 1.00 . A A . 2 CYS O    1 1 
        5  478 1 1 1 CYS SG   S 23.705 15.796 20.427 1.00 . A A . 2 CYS SG   1 1 
        5  479 1 1 2 HYP C    C 19.462 20.155 20.432 1.00 . A A . 3 HYP C    1 1 
        5  480 1 1 2 HYP CA   C 19.088 19.062 19.414 1.00 . A A . 3 HYP CA   1 1 
        5  481 1 1 2 HYP CB   C 17.667 19.216 18.882 1.00 . A A . 3 HYP CB   1 1 
        5  482 1 1 2 HYP CD   C 17.819 17.091 20.234 1.00 . A A . 3 HYP CD   1 1 
        5  483 1 1 2 HYP CG   C 16.853 18.016 19.454 1.00 . A A . 3 HYP CG   1 1 
        5  484 1 1 2 HYP HA   H 19.785 19.087 18.581 1.00 . A A . 3 HYP HA   1 1 
        5  485 1 1 2 HYP HB2  H 17.681 19.240 17.806 1.00 . A A . 3 HYP HB2  1 1 
        5  486 1 1 2 HYP HB3  H 17.233 20.144 19.238 1.00 . A A . 3 HYP HB3  1 1 
        5  487 1 1 2 HYP HD1  H 16.164 17.914 17.644 1.00 . A A . 3 HYP HD1  1 1 
        5  488 1 1 2 HYP HD22 H 17.851 16.093 19.817 1.00 . A A . 3 HYP HD22 1 1 
        5  489 1 1 2 HYP HD23 H 17.571 17.044 21.289 1.00 . A A . 3 HYP HD23 1 1 
        5  490 1 1 2 HYP HG   H 16.006 18.326 20.050 1.00 . A A . 3 HYP HG   1 1 
        5  491 1 1 2 HYP N    N 19.163 17.727 20.087 1.00 . A A . 3 HYP N    1 1 
        5  492 1 1 2 HYP O    O 18.619 20.541 21.229 1.00 . A A . 3 HYP O    1 1 
        5  493 1 1 2 HYP OD1  O 16.450 17.280 18.305 1.00 . A A . 3 HYP OD1  1 1 
        5  494 1 1 3 DTR C    C 22.420 22.269 20.531 1.00 . A A . 4 DTR C    1 1 
        5  495 1 1 3 DTR CA   C 21.240 21.657 21.292 1.00 . A A . 4 DTR CA   1 1 
        5  496 1 1 3 DTR CB   C 20.196 22.801 21.594 1.00 . A A . 4 DTR CB   1 1 
        5  497 1 1 3 DTR CD1  C 18.545 22.962 19.663 1.00 . A A . 4 DTR CD1  1 1 
        5  498 1 1 3 DTR CD2  C 19.936 24.641 19.813 1.00 . A A . 4 DTR CD2  1 1 
        5  499 1 1 3 DTR CE2  C 19.133 24.924 18.713 1.00 . A A . 4 DTR CE2  1 1 
        5  500 1 1 3 DTR CE3  C 20.939 25.519 20.193 1.00 . A A . 4 DTR CE3  1 1 
        5  501 1 1 3 DTR CG   C 19.578 23.462 20.369 1.00 . A A . 4 DTR CG   1 1 
        5  502 1 1 3 DTR CH2  C 20.347 26.980 18.367 1.00 . A A . 4 DTR CH2  1 1 
        5  503 1 1 3 DTR CZ2  C 19.328 26.101 17.993 1.00 . A A . 4 DTR CZ2  1 1 
        5  504 1 1 3 DTR CZ3  C 21.152 26.690 19.468 1.00 . A A . 4 DTR CZ3  1 1 
        5  505 1 1 3 DTR H    H 21.308 20.215 19.729 1.00 . A A . 4 DTR H    1 1 
        5  506 1 1 3 DTR HA   H 21.534 21.249 22.216 1.00 . A A . 4 DTR HA   1 1 
        5  507 1 1 3 DTR HB2  H 20.732 23.542 22.148 1.00 . A A . 4 DTR HB2  1 1 
        5  508 1 1 3 DTR HB3  H 19.407 22.422 22.229 1.00 . A A . 4 DTR HB3  1 1 
        5  509 1 1 3 DTR HD1  H 18.028 22.040 19.870 1.00 . A A . 4 DTR HD1  1 1 
        5  510 1 1 3 DTR HE1  H 17.637 23.754 18.030 1.00 . A A . 4 DTR HE1  1 1 
        5  511 1 1 3 DTR HE3  H 21.545 25.247 21.046 1.00 . A A . 4 DTR HE3  1 1 
        5  512 1 1 3 DTR HH2  H 20.506 27.883 17.796 1.00 . A A . 4 DTR HH2  1 1 
        5  513 1 1 3 DTR HZ2  H 18.705 26.305 17.144 1.00 . A A . 4 DTR HZ2  1 1 
        5  514 1 1 3 DTR HZ3  H 21.936 27.376 19.760 1.00 . A A . 4 DTR HZ3  1 1 
        5  515 1 1 3 DTR N    N 20.686 20.587 20.395 1.00 . A A . 4 DTR N    1 1 
        5  516 1 1 3 DTR NE1  N 18.335 23.858 18.712 1.00 . A A . 4 DTR NE1  1 1 
        5  517 1 1 3 DTR O    O 22.432 23.332 19.972 1.00 . A A . 4 DTR O    1 1 
        5  518 1 1 4 GLN C    C 24.944 21.064 18.660 1.00 . A A . 5 GLN C    1 1 
        5  519 1 1 4 GLN CA   C 24.715 21.958 19.855 1.00 . A A . 5 GLN CA   1 1 
        5  520 1 1 4 GLN CB   C 25.925 21.849 20.757 1.00 . A A . 5 GLN CB   1 1 
        5  521 1 1 4 GLN CD   C 24.731 22.829 22.777 1.00 . A A . 5 GLN CD   1 1 
        5  522 1 1 4 GLN CG   C 25.893 22.949 21.811 1.00 . A A . 5 GLN CG   1 1 
        5  523 1 1 4 GLN H    H 23.439 20.622 20.989 1.00 . A A . 5 GLN H    1 1 
        5  524 1 1 4 GLN HA   H 24.603 22.990 19.573 1.00 . A A . 5 GLN HA   1 1 
        5  525 1 1 4 GLN HB2  H 26.087 20.887 21.167 1.00 . A A . 5 GLN HB2  1 1 
        5  526 1 1 4 GLN HB3  H 26.779 22.048 20.139 1.00 . A A . 5 GLN HB3  1 1 
        5  527 1 1 4 GLN HE21 H 24.979 20.914 23.146 1.00 . A A . 5 GLN HE21 1 1 
        5  528 1 1 4 GLN HE22 H 23.680 21.621 23.948 1.00 . A A . 5 GLN HE22 1 1 
        5  529 1 1 4 GLN HG2  H 26.820 22.976 22.375 1.00 . A A . 5 GLN HG2  1 1 
        5  530 1 1 4 GLN HG3  H 25.812 23.848 21.222 1.00 . A A . 5 GLN HG3  1 1 
        5  531 1 1 4 GLN N    N 23.476 21.489 20.534 1.00 . A A . 5 GLN N    1 1 
        5  532 1 1 4 GLN NE2  N 24.442 21.699 23.331 1.00 . A A . 5 GLN NE2  1 1 
        5  533 1 1 4 GLN O    O 25.137 19.877 18.823 1.00 . A A . 5 GLN O    1 1 
        5  534 1 1 4 GLN OE1  O 24.052 23.804 23.064 1.00 . A A . 5 GLN OE1  1 1 
        5  535 1 1 5 PRO C    C 26.485 20.298 16.062 1.00 . A A . 6 PRO C    1 1 
        5  536 1 1 5 PRO CA   C 25.024 20.786 16.276 1.00 . A A . 6 PRO CA   1 1 
        5  537 1 1 5 PRO CB   C 24.438 21.662 15.192 1.00 . A A . 6 PRO CB   1 1 
        5  538 1 1 5 PRO CD   C 24.825 23.074 17.213 1.00 . A A . 6 PRO CD   1 1 
        5  539 1 1 5 PRO CG   C 24.490 23.143 15.712 1.00 . A A . 6 PRO CG   1 1 
        5  540 1 1 5 PRO HA   H 24.411 19.900 16.413 1.00 . A A . 6 PRO HA   1 1 
        5  541 1 1 5 PRO HB2  H 24.916 21.530 14.226 1.00 . A A . 6 PRO HB2  1 1 
        5  542 1 1 5 PRO HB3  H 23.392 21.370 15.139 1.00 . A A . 6 PRO HB3  1 1 
        5  543 1 1 5 PRO HD2  H 25.759 23.554 17.422 1.00 . A A . 6 PRO HD2  1 1 
        5  544 1 1 5 PRO HD3  H 24.059 23.471 17.842 1.00 . A A . 6 PRO HD3  1 1 
        5  545 1 1 5 PRO HG2  H 25.236 23.719 15.170 1.00 . A A . 6 PRO HG2  1 1 
        5  546 1 1 5 PRO HG3  H 23.528 23.620 15.571 1.00 . A A . 6 PRO HG3  1 1 
        5  547 1 1 5 PRO N    N 24.924 21.623 17.485 1.00 . A A . 6 PRO N    1 1 
        5  548 1 1 5 PRO O    O 26.879 19.840 14.993 1.00 . A A . 6 PRO O    1 1 
        5  549 1 1 6 TRP C    C 28.827 19.015 18.186 1.00 . A A . 7 TRP C    1 1 
        5  550 1 1 6 TRP CA   C 28.706 20.016 17.051 1.00 . A A . 7 TRP CA   1 1 
        5  551 1 1 6 TRP CB   C 29.609 21.255 17.272 1.00 . A A . 7 TRP CB   1 1 
        5  552 1 1 6 TRP CD1  C 30.640 21.020 19.600 1.00 . A A . 7 TRP CD1  1 1 
        5  553 1 1 6 TRP CD2  C 29.193 22.647 19.400 1.00 . A A . 7 TRP CD2  1 1 
        5  554 1 1 6 TRP CE2  C 29.659 22.716 20.705 1.00 . A A . 7 TRP CE2  1 1 
        5  555 1 1 6 TRP CE3  C 28.262 23.520 18.935 1.00 . A A . 7 TRP CE3  1 1 
        5  556 1 1 6 TRP CG   C 29.781 21.647 18.754 1.00 . A A . 7 TRP CG   1 1 
        5  557 1 1 6 TRP CH2  C 28.223 24.623 21.091 1.00 . A A . 7 TRP CH2  1 1 
        5  558 1 1 6 TRP CZ2  C 29.172 23.710 21.558 1.00 . A A . 7 TRP CZ2  1 1 
        5  559 1 1 6 TRP CZ3  C 27.765 24.515 19.768 1.00 . A A . 7 TRP CZ3  1 1 
        5  560 1 1 6 TRP H    H 26.967 20.853 17.946 1.00 . A A . 7 TRP H    1 1 
        5  561 1 1 6 TRP HA   H 28.903 19.518 16.118 1.00 . A A . 7 TRP HA   1 1 
        5  562 1 1 6 TRP HB2  H 30.587 21.003 16.889 1.00 . A A . 7 TRP HB2  1 1 
        5  563 1 1 6 TRP HB3  H 29.247 22.117 16.723 1.00 . A A . 7 TRP HB3  1 1 
        5  564 1 1 6 TRP HD1  H 31.247 20.170 19.356 1.00 . A A . 7 TRP HD1  1 1 
        5  565 1 1 6 TRP HE1  H 30.996 21.479 21.521 1.00 . A A . 7 TRP HE1  1 1 
        5  566 1 1 6 TRP HE3  H 27.919 23.377 17.940 1.00 . A A . 7 TRP HE3  1 1 
        5  567 1 1 6 TRP HH2  H 27.852 25.386 21.758 1.00 . A A . 7 TRP HH2  1 1 
        5  568 1 1 6 TRP HZ2  H 29.532 23.769 22.586 1.00 . A A . 7 TRP HZ2  1 1 
        5  569 1 1 6 TRP HZ3  H 27.016 25.214 19.420 1.00 . A A . 7 TRP HZ3  1 1 
        5  570 1 1 6 TRP N    N 27.281 20.439 17.098 1.00 . A A . 7 TRP N    1 1 
        5  571 1 1 6 TRP NE1  N 30.504 21.700 20.715 1.00 . A A . 7 TRP NE1  1 1 
        5  572 1 1 6 TRP O    O 29.930 18.579 18.480 1.00 . A A . 7 TRP O    1 1 
        5  573 1 1 7 .   C    C 28.449 16.427 19.464 1.00 . A A . 8 CY3 C    1 1 
        5  574 1 1 7 .   CA   C 27.758 17.721 19.893 1.00 . A A . 8 CY3 CA   1 1 
        5  575 1 1 7 .   CB   C 26.333 17.362 20.384 1.00 . A A . 8 CY3 CB   1 1 
        5  576 1 1 7 .   H    H 26.870 19.033 18.495 1.00 . A A . 8 CY3 H    1 1 
        5  577 1 1 7 .   HA   H 28.351 18.234 20.636 1.00 . A A . 8 CY3 HA   1 1 
        5  578 1 1 7 .   HB2  H 25.707 18.236 20.374 1.00 . A A . 8 CY3 HB2  1 1 
        5  579 1 1 7 .   HB3  H 26.391 17.020 21.413 1.00 . A A . 8 CY3 HB3  1 1 
        5  580 1 1 7 .   HN11 H 29.097 15.919 21.287 1.00 . A A . 8 CY3 HN11 1 1 
        5  581 1 1 7 .   HN12 H 29.456 14.845 20.055 1.00 . A A . 8 CY3 HN12 1 1 
        5  582 1 1 7 .   N    N 27.726 18.684 18.780 1.00 . A A . 8 CY3 N    1 1 
        5  583 1 1 7 .   N1   N 29.078 15.711 20.340 1.00 . A A . 8 CY3 N1   1 1 
        5  584 1 1 7 .   O    O 28.432 16.017 18.309 1.00 . A A . 8 CY3 O    1 1 
        5  585 1 1 7 .   SG   S 25.463 16.068 19.470 1.00 . A A . 8 CY3 SG   1 1 
        6  586 1 1 1 CYS C    C 20.292 17.067 20.550 1.00 . A A . 2 CYS C    1 1 
        6  587 1 1 1 CYS CA   C 21.721 17.649 20.409 1.00 . A A . 2 CYS CA   1 1 
        6  588 1 1 1 CYS CB   C 22.712 16.538 19.982 1.00 . A A . 2 CYS CB   1 1 
        6  589 1 1 1 CYS H1   H 21.528 18.163 22.475 1.00 . A A . 2 CYS H1   1 1 
        6  590 1 1 1 CYS HA   H 21.744 18.409 19.655 1.00 . A A . 2 CYS HA   1 1 
        6  591 1 1 1 CYS HB2  H 22.115 15.748 19.551 1.00 . A A . 2 CYS HB2  1 1 
        6  592 1 1 1 CYS HB3  H 23.326 16.933 19.186 1.00 . A A . 2 CYS HB3  1 1 
        6  593 1 1 1 CYS N    N 22.152 18.218 21.715 1.00 . A A . 2 CYS N    1 1 
        6  594 1 1 1 CYS O    O 20.131 16.099 21.269 1.00 . A A . 2 CYS O    1 1 
        6  595 1 1 1 CYS SG   S 23.840 15.848 21.220 1.00 . A A . 2 CYS SG   1 1 
        6  596 1 1 2 HYP C    C 19.546 20.163 20.099 1.00 . A A . 3 HYP C    1 1 
        6  597 1 1 2 HYP CA   C 19.354 18.928 19.174 1.00 . A A . 3 HYP CA   1 1 
        6  598 1 1 2 HYP CB   C 18.035 19.026 18.382 1.00 . A A . 3 HYP CB   1 1 
        6  599 1 1 2 HYP CD   C 17.965 16.978 19.841 1.00 . A A . 3 HYP CD   1 1 
        6  600 1 1 2 HYP CG   C 17.090 17.944 18.982 1.00 . A A . 3 HYP CG   1 1 
        6  601 1 1 2 HYP HA   H 20.178 18.876 18.474 1.00 . A A . 3 HYP HA   1 1 
        6  602 1 1 2 HYP HB2  H 18.238 18.895 17.332 1.00 . A A . 3 HYP HB2  1 1 
        6  603 1 1 2 HYP HB3  H 17.573 19.993 18.519 1.00 . A A . 3 HYP HB3  1 1 
        6  604 1 1 2 HYP HD1  H 17.354 16.839 17.398 1.00 . A A . 3 HYP HD1  1 1 
        6  605 1 1 2 HYP HD22 H 18.067 15.992 19.397 1.00 . A A . 3 HYP HD22 1 1 
        6  606 1 1 2 HYP HD23 H 17.583 16.877 20.847 1.00 . A A . 3 HYP HD23 1 1 
        6  607 1 1 2 HYP HG   H 16.284 18.374 19.555 1.00 . A A . 3 HYP HG   1 1 
        6  608 1 1 2 HYP N    N 19.300 17.631 19.903 1.00 . A A . 3 HYP N    1 1 
        6  609 1 1 2 HYP O    O 18.584 20.632 20.674 1.00 . A A . 3 HYP O    1 1 
        6  610 1 1 2 HYP OD1  O 16.597 17.190 17.883 1.00 . A A . 3 HYP OD1  1 1 
        6  611 1 1 3 DTR C    C 22.459 22.345 20.435 1.00 . A A . 4 DTR C    1 1 
        6  612 1 1 3 DTR CA   C 21.172 21.799 21.062 1.00 . A A . 4 DTR CA   1 1 
        6  613 1 1 3 DTR CB   C 20.088 22.941 21.044 1.00 . A A . 4 DTR CB   1 1 
        6  614 1 1 3 DTR CD1  C 18.938 22.833 18.763 1.00 . A A . 4 DTR CD1  1 1 
        6  615 1 1 3 DTR CD2  C 20.137 24.626 19.082 1.00 . A A . 4 DTR CD2  1 1 
        6  616 1 1 3 DTR CE2  C 19.603 24.757 17.810 1.00 . A A . 4 DTR CE2  1 1 
        6  617 1 1 3 DTR CE3  C 20.957 25.607 19.608 1.00 . A A . 4 DTR CE3  1 1 
        6  618 1 1 3 DTR CG   C 19.730 23.469 19.641 1.00 . A A . 4 DTR CG   1 1 
        6  619 1 1 3 DTR CH2  C 20.715 26.885 17.576 1.00 . A A . 4 DTR CH2  1 1 
        6  620 1 1 3 DTR CZ2  C 19.893 25.888 17.053 1.00 . A A . 4 DTR CZ2  1 1 
        6  621 1 1 3 DTR CZ3  C 21.249 26.745 18.855 1.00 . A A . 4 DTR CZ3  1 1 
        6  622 1 1 3 DTR H    H 21.475 20.159 19.747 1.00 . A A . 4 DTR H    1 1 
        6  623 1 1 3 DTR HA   H 21.323 21.531 22.079 1.00 . A A . 4 DTR HA   1 1 
        6  624 1 1 3 DTR HB2  H 20.510 23.751 21.594 1.00 . A A . 4 DTR HB2  1 1 
        6  625 1 1 3 DTR HB3  H 19.186 22.631 21.549 1.00 . A A . 4 DTR HB3  1 1 
        6  626 1 1 3 DTR HD1  H 18.456 21.891 18.920 1.00 . A A . 4 DTR HD1  1 1 
        6  627 1 1 3 DTR HE1  H 18.394 23.399 16.915 1.00 . A A . 4 DTR HE1  1 1 
        6  628 1 1 3 DTR HE3  H 21.358 25.441 20.602 1.00 . A A . 4 DTR HE3  1 1 
        6  629 1 1 3 DTR HH2  H 20.941 27.766 16.991 1.00 . A A . 4 DTR HH2  1 1 
        6  630 1 1 3 DTR HZ2  H 19.474 25.991 16.063 1.00 . A A . 4 DTR HZ2  1 1 
        6  631 1 1 3 DTR HZ3  H 21.889 27.512 19.260 1.00 . A A . 4 DTR HZ3  1 1 
        6  632 1 1 3 DTR N    N 20.766 20.613 20.233 1.00 . A A . 4 DTR N    1 1 
        6  633 1 1 3 DTR NE1  N 18.909 23.638 17.722 1.00 . A A . 4 DTR NE1  1 1 
        6  634 1 1 3 DTR O    O 22.540 23.377 19.806 1.00 . A A . 4 DTR O    1 1 
        6  635 1 1 4 GLN C    C 25.006 21.164 18.835 1.00 . A A . 5 GLN C    1 1 
        6  636 1 1 4 GLN CA   C 24.817 22.027 20.058 1.00 . A A . 5 GLN CA   1 1 
        6  637 1 1 4 GLN CB   C 26.013 21.754 20.961 1.00 . A A . 5 GLN CB   1 1 
        6  638 1 1 4 GLN CD   C 24.840 22.739 22.972 1.00 . A A . 5 GLN CD   1 1 
        6  639 1 1 4 GLN CG   C 26.074 22.772 22.074 1.00 . A A . 5 GLN CG   1 1 
        6  640 1 1 4 GLN H    H 23.431 20.756 21.134 1.00 . A A . 5 GLN H    1 1 
        6  641 1 1 4 GLN HA   H 24.791 23.074 19.819 1.00 . A A . 5 GLN HA   1 1 
        6  642 1 1 4 GLN HB2  H 26.115 20.740 21.273 1.00 . A A . 5 GLN HB2  1 1 
        6  643 1 1 4 GLN HB3  H 26.861 21.951 20.329 1.00 . A A . 5 GLN HB3  1 1 
        6  644 1 1 4 GLN HE21 H 24.920 20.786 23.270 1.00 . A A . 5 GLN HE21 1 1 
        6  645 1 1 4 GLN HE22 H 23.634 21.572 24.039 1.00 . A A . 5 GLN HE22 1 1 
        6  646 1 1 4 GLN HG2  H 26.957 22.640 22.682 1.00 . A A . 5 GLN HG2  1 1 
        6  647 1 1 4 GLN HG3  H 26.140 23.715 21.547 1.00 . A A . 5 GLN HG3  1 1 
        6  648 1 1 4 GLN N    N 23.509 21.592 20.628 1.00 . A A . 5 GLN N    1 1 
        6  649 1 1 4 GLN NE2  N 24.432 21.611 23.465 1.00 . A A . 5 GLN NE2  1 1 
        6  650 1 1 4 GLN O    O 25.229 19.982 18.970 1.00 . A A . 5 GLN O    1 1 
        6  651 1 1 4 GLN OE1  O 24.227 23.749 23.243 1.00 . A A . 5 GLN OE1  1 1 
        6  652 1 1 5 PRO C    C 26.300 20.336 16.166 1.00 . A A . 6 PRO C    1 1 
        6  653 1 1 5 PRO CA   C 24.908 20.897 16.452 1.00 . A A . 6 PRO CA   1 1 
        6  654 1 1 5 PRO CB   C 24.362 21.831 15.359 1.00 . A A . 6 PRO CB   1 1 
        6  655 1 1 5 PRO CD   C 24.852 23.185 17.416 1.00 . A A . 6 PRO CD   1 1 
        6  656 1 1 5 PRO CG   C 24.366 23.293 15.951 1.00 . A A . 6 PRO CG   1 1 
        6  657 1 1 5 PRO HA   H 24.273 20.046 16.654 1.00 . A A . 6 PRO HA   1 1 
        6  658 1 1 5 PRO HB2  H 24.946 21.747 14.451 1.00 . A A . 6 PRO HB2  1 1 
        6  659 1 1 5 PRO HB3  H 23.345 21.521 15.165 1.00 . A A . 6 PRO HB3  1 1 
        6  660 1 1 5 PRO HD2  H 25.831 23.632 17.539 1.00 . A A . 6 PRO HD2  1 1 
        6  661 1 1 5 PRO HD3  H 24.174 23.614 18.135 1.00 . A A . 6 PRO HD3  1 1 
        6  662 1 1 5 PRO HG2  H 25.023 23.930 15.372 1.00 . A A . 6 PRO HG2  1 1 
        6  663 1 1 5 PRO HG3  H 23.360 23.701 15.933 1.00 . A A . 6 PRO HG3  1 1 
        6  664 1 1 5 PRO N    N 24.928 21.725 17.665 1.00 . A A . 6 PRO N    1 1 
        6  665 1 1 5 PRO O    O 26.541 19.779 15.116 1.00 . A A . 6 PRO O    1 1 
        6  666 1 1 6 TRP C    C 28.736 18.834 17.909 1.00 . A A . 7 TRP C    1 1 
        6  667 1 1 6 TRP CA   C 28.558 19.988 16.924 1.00 . A A . 7 TRP CA   1 1 
        6  668 1 1 6 TRP CB   C 29.566 21.118 17.213 1.00 . A A . 7 TRP CB   1 1 
        6  669 1 1 6 TRP CD1  C 30.618 20.504 19.442 1.00 . A A . 7 TRP CD1  1 1 
        6  670 1 1 6 TRP CD2  C 29.364 22.281 19.505 1.00 . A A . 7 TRP CD2  1 1 
        6  671 1 1 6 TRP CE2  C 29.858 22.138 20.796 1.00 . A A . 7 TRP CE2  1 1 
        6  672 1 1 6 TRP CE3  C 28.521 23.319 19.181 1.00 . A A . 7 TRP CE3  1 1 
        6  673 1 1 6 TRP CG   C 29.826 21.307 18.707 1.00 . A A . 7 TRP CG   1 1 
        6  674 1 1 6 TRP CH2  C 28.651 24.124 21.447 1.00 . A A . 7 TRP CH2  1 1 
        6  675 1 1 6 TRP CZ2  C 29.499 23.067 21.768 1.00 . A A . 7 TRP CZ2  1 1 
        6  676 1 1 6 TRP CZ3  C 28.156 24.253 20.153 1.00 . A A . 7 TRP CZ3  1 1 
        6  677 1 1 6 TRP H    H 26.967 20.982 17.947 1.00 . A A . 7 TRP H    1 1 
        6  678 1 1 6 TRP HA   H 28.680 19.607 15.923 1.00 . A A . 7 TRP HA   1 1 
        6  679 1 1 6 TRP HB2  H 30.509 20.885 16.756 1.00 . A A . 7 TRP HB2  1 1 
        6  680 1 1 6 TRP HB3  H 29.232 22.049 16.807 1.00 . A A . 7 TRP HB3  1 1 
        6  681 1 1 6 TRP HD1  H 31.134 19.624 19.098 1.00 . A A . 7 TRP HD1  1 1 
        6  682 1 1 6 TRP HE1  H 31.083 20.645 21.385 1.00 . A A . 7 TRP HE1  1 1 
        6  683 1 1 6 TRP HE3  H 28.142 23.361 18.178 1.00 . A A . 7 TRP HE3  1 1 
        6  684 1 1 6 TRP HH2  H 28.383 24.845 22.209 1.00 . A A . 7 TRP HH2  1 1 
        6  685 1 1 6 TRP HZ2  H 29.880 22.972 22.774 1.00 . A A . 7 TRP HZ2  1 1 
        6  686 1 1 6 TRP HZ3  H 27.490 25.066 19.909 1.00 . A A . 7 TRP HZ3  1 1 
        6  687 1 1 6 TRP N    N 27.186 20.511 17.111 1.00 . A A . 7 TRP N    1 1 
        6  688 1 1 6 TRP NE1  N 30.585 21.051 20.643 1.00 . A A . 7 TRP NE1  1 1 
        6  689 1 1 6 TRP O    O 29.739 18.150 17.865 1.00 . A A . 7 TRP O    1 1 
        6  690 1 1 7 .   C    C 28.478 16.353 19.451 1.00 . A A . 8 CY3 C    1 1 
        6  691 1 1 7 .   CA   C 27.704 17.633 19.803 1.00 . A A . 8 CY3 CA   1 1 
        6  692 1 1 7 .   CB   C 26.198 17.308 20.108 1.00 . A A . 8 CY3 CB   1 1 
        6  693 1 1 7 .   H    H 26.970 19.280 18.664 1.00 . A A . 8 CY3 H    1 1 
        6  694 1 1 7 .   HA   H 28.164 18.125 20.652 1.00 . A A . 8 CY3 HA   1 1 
        6  695 1 1 7 .   HB2  H 25.598 17.760 19.333 1.00 . A A . 8 CY3 HB2  1 1 
        6  696 1 1 7 .   HB3  H 25.937 17.807 21.033 1.00 . A A . 8 CY3 HB3  1 1 
        6  697 1 1 7 .   HN11 H 29.191 16.101 21.274 1.00 . A A . 8 CY3 HN11 1 1 
        6  698 1 1 7 .   HN12 H 29.661 14.936 20.145 1.00 . A A . 8 CY3 HN12 1 1 
        6  699 1 1 7 .   N    N 27.741 18.681 18.746 1.00 . A A . 8 CY3 N    1 1 
        6  700 1 1 7 .   N1   N 29.164 15.749 20.366 1.00 . A A . 8 CY3 N1   1 1 
        6  701 1 1 7 .   O    O 28.468 15.880 18.332 1.00 . A A . 8 CY3 O    1 1 
        6  702 1 1 7 .   SG   S 25.590 15.607 20.240 1.00 . A A . 8 CY3 SG   1 1 
        7  703 1 1 1 CYS C    C 19.872 17.018 20.810 1.00 . A A . 2 CYS C    1 1 
        7  704 1 1 1 CYS CA   C 21.214 17.558 21.355 1.00 . A A . 2 CYS CA   1 1 
        7  705 1 1 1 CYS CB   C 22.364 17.244 20.396 1.00 . A A . 2 CYS CB   1 1 
        7  706 1 1 1 CYS H1   H 20.867 16.189 22.938 1.00 . A A . 2 CYS H1   1 1 
        7  707 1 1 1 CYS HA   H 21.128 18.620 21.533 1.00 . A A . 2 CYS HA   1 1 
        7  708 1 1 1 CYS HB2  H 23.026 16.523 20.851 1.00 . A A . 2 CYS HB2  1 1 
        7  709 1 1 1 CYS HB3  H 21.974 16.780 19.501 1.00 . A A . 2 CYS HB3  1 1 
        7  710 1 1 1 CYS N    N 21.506 16.888 22.662 1.00 . A A . 2 CYS N    1 1 
        7  711 1 1 1 CYS O    O 19.345 16.115 21.441 1.00 . A A . 2 CYS O    1 1 
        7  712 1 1 1 CYS SG   S 23.386 18.635 19.867 1.00 . A A . 2 CYS SG   1 1 
        7  713 1 1 2 HYP C    C 19.897 19.965 19.794 1.00 . A A . 3 HYP C    1 1 
        7  714 1 1 2 HYP CA   C 19.902 18.686 18.929 1.00 . A A . 3 HYP CA   1 1 
        7  715 1 1 2 HYP CB   C 18.996 18.817 17.675 1.00 . A A . 3 HYP CB   1 1 
        7  716 1 1 2 HYP CD   C 18.101 16.966 19.138 1.00 . A A . 3 HYP CD   1 1 
        7  717 1 1 2 HYP CG   C 17.855 17.775 17.824 1.00 . A A . 3 HYP CG   1 1 
        7  718 1 1 2 HYP HA   H 20.911 18.462 18.616 1.00 . A A . 3 HYP HA   1 1 
        7  719 1 1 2 HYP HB2  H 19.583 18.690 16.777 1.00 . A A . 3 HYP HB2  1 1 
        7  720 1 1 2 HYP HB3  H 18.547 19.797 17.648 1.00 . A A . 3 HYP HB3  1 1 
        7  721 1 1 2 HYP HD1  H 17.164 16.381 16.660 1.00 . A A . 3 HYP HD1  1 1 
        7  722 1 1 2 HYP HD22 H 18.217 15.903 18.997 1.00 . A A . 3 HYP HD22 1 1 
        7  723 1 1 2 HYP HD23 H 17.295 17.127 19.843 1.00 . A A . 3 HYP HD23 1 1 
        7  724 1 1 2 HYP HG   H 16.878 18.249 17.868 1.00 . A A . 3 HYP HG   1 1 
        7  725 1 1 2 HYP N    N 19.352 17.527 19.711 1.00 . A A . 3 HYP N    1 1 
        7  726 1 1 2 HYP O    O 18.835 20.378 20.210 1.00 . A A . 3 HYP O    1 1 
        7  727 1 1 2 HYP OD1  O 17.976 16.902 16.704 1.00 . A A . 3 HYP OD1  1 1 
        7  728 1 1 3 DTR C    C 22.535 22.493 20.436 1.00 . A A . 4 DTR C    1 1 
        7  729 1 1 3 DTR CA   C 21.239 21.782 20.879 1.00 . A A . 4 DTR CA   1 1 
        7  730 1 1 3 DTR CB   C 20.050 22.795 20.700 1.00 . A A . 4 DTR CB   1 1 
        7  731 1 1 3 DTR CD1  C 19.374 22.616 18.248 1.00 . A A . 4 DTR CD1  1 1 
        7  732 1 1 3 DTR CD2  C 20.233 24.538 18.801 1.00 . A A . 4 DTR CD2  1 1 
        7  733 1 1 3 DTR CE2  C 19.946 24.640 17.448 1.00 . A A . 4 DTR CE2  1 1 
        7  734 1 1 3 DTR CE3  C 20.791 25.602 19.490 1.00 . A A . 4 DTR CE3  1 1 
        7  735 1 1 3 DTR CG   C 19.889 23.323 19.263 1.00 . A A . 4 DTR CG   1 1 
        7  736 1 1 3 DTR CH2  C 20.792 26.903 17.468 1.00 . A A . 4 DTR CH2  1 1 
        7  737 1 1 3 DTR CZ2  C 20.226 25.829 16.778 1.00 . A A . 4 DTR CZ2  1 1 
        7  738 1 1 3 DTR CZ3  C 21.072 26.792 18.825 1.00 . A A . 4 DTR CZ3  1 1 
        7  739 1 1 3 DTR H    H 21.856 20.126 19.678 1.00 . A A . 4 DTR H    1 1 
        7  740 1 1 3 DTR HA   H 21.296 21.550 21.919 1.00 . A A . 4 DTR HA   1 1 
        7  741 1 1 3 DTR HB2  H 20.313 23.633 21.308 1.00 . A A . 4 DTR HB2  1 1 
        7  742 1 1 3 DTR HB3  H 19.103 22.405 21.054 1.00 . A A . 4 DTR HB3  1 1 
        7  743 1 1 3 DTR HD1  H 19.006 21.616 18.314 1.00 . A A . 4 DTR HD1  1 1 
        7  744 1 1 3 DTR HE1  H 19.123 23.161 16.328 1.00 . A A . 4 DTR HE1  1 1 
        7  745 1 1 3 DTR HE3  H 21.012 25.472 20.541 1.00 . A A . 4 DTR HE3  1 1 
        7  746 1 1 3 DTR HH2  H 21.018 27.825 16.951 1.00 . A A . 4 DTR HH2  1 1 
        7  747 1 1 3 DTR HZ2  H 20.006 25.920 15.727 1.00 . A A . 4 DTR HZ2  1 1 
        7  748 1 1 3 DTR HZ3  H 21.500 27.627 19.366 1.00 . A A . 4 DTR HZ3  1 1 
        7  749 1 1 3 DTR N    N 21.050 20.528 20.058 1.00 . A A . 4 DTR N    1 1 
        7  750 1 1 3 DTR NE1  N 19.440 23.440 17.219 1.00 . A A . 4 DTR NE1  1 1 
        7  751 1 1 3 DTR O    O 22.587 23.668 20.137 1.00 . A A . 4 DTR O    1 1 
        7  752 1 1 4 GLN C    C 25.183 21.562 18.758 1.00 . A A . 5 GLN C    1 1 
        7  753 1 1 4 GLN CA   C 24.901 22.360 19.995 1.00 . A A . 5 GLN CA   1 1 
        7  754 1 1 4 GLN CB   C 26.096 22.107 20.925 1.00 . A A . 5 GLN CB   1 1 
        7  755 1 1 4 GLN CD   C 25.112 23.326 22.948 1.00 . A A . 5 GLN CD   1 1 
        7  756 1 1 4 GLN CG   C 26.246 23.234 21.913 1.00 . A A . 5 GLN CG   1 1 
        7  757 1 1 4 GLN H    H 23.576 20.798 20.661 1.00 . A A . 5 GLN H    1 1 
        7  758 1 1 4 GLN HA   H 24.790 23.412 19.804 1.00 . A A . 5 GLN HA   1 1 
        7  759 1 1 4 GLN HB2  H 26.173 21.128 21.324 1.00 . A A . 5 GLN HB2  1 1 
        7  760 1 1 4 GLN HB3  H 26.955 22.200 20.282 1.00 . A A . 5 GLN HB3  1 1 
        7  761 1 1 4 GLN HE21 H 24.337 21.575 22.478 1.00 . A A . 5 GLN HE21 1 1 
        7  762 1 1 4 GLN HE22 H 23.558 22.405 23.743 1.00 . A A . 5 GLN HE22 1 1 
        7  763 1 1 4 GLN HG2  H 27.180 23.135 22.447 1.00 . A A . 5 GLN HG2  1 1 
        7  764 1 1 4 GLN HG3  H 26.281 24.097 21.258 1.00 . A A . 5 GLN HG3  1 1 
        7  765 1 1 4 GLN N    N 23.608 21.747 20.420 1.00 . A A . 5 GLN N    1 1 
        7  766 1 1 4 GLN NE2  N 24.262 22.353 23.066 1.00 . A A . 5 GLN NE2  1 1 
        7  767 1 1 4 GLN O    O 25.499 20.402 18.894 1.00 . A A . 5 GLN O    1 1 
        7  768 1 1 4 GLN OE1  O 24.988 24.291 23.683 1.00 . A A . 5 GLN OE1  1 1 
        7  769 1 1 5 PRO C    C 26.368 20.650 16.050 1.00 . A A . 6 PRO C    1 1 
        7  770 1 1 5 PRO CA   C 25.021 21.312 16.374 1.00 . A A . 6 PRO CA   1 1 
        7  771 1 1 5 PRO CB   C 24.493 22.287 15.308 1.00 . A A . 6 PRO CB   1 1 
        7  772 1 1 5 PRO CD   C 25.043 23.594 17.372 1.00 . A A . 6 PRO CD   1 1 
        7  773 1 1 5 PRO CG   C 24.564 23.738 15.917 1.00 . A A . 6 PRO CG   1 1 
        7  774 1 1 5 PRO HA   H 24.301 20.521 16.542 1.00 . A A . 6 PRO HA   1 1 
        7  775 1 1 5 PRO HB2  H 25.048 22.197 14.385 1.00 . A A . 6 PRO HB2  1 1 
        7  776 1 1 5 PRO HB3  H 23.452 22.010 15.156 1.00 . A A . 6 PRO HB3  1 1 
        7  777 1 1 5 PRO HD2  H 26.031 24.014 17.506 1.00 . A A . 6 PRO HD2  1 1 
        7  778 1 1 5 PRO HD3  H 24.370 24.021 18.101 1.00 . A A . 6 PRO HD3  1 1 
        7  779 1 1 5 PRO HG2  H 25.245 24.355 15.350 1.00 . A A . 6 PRO HG2  1 1 
        7  780 1 1 5 PRO HG3  H 23.582 24.194 15.899 1.00 . A A . 6 PRO HG3  1 1 
        7  781 1 1 5 PRO N    N 25.088 22.132 17.591 1.00 . A A . 6 PRO N    1 1 
        7  782 1 1 5 PRO O    O 26.603 20.217 14.935 1.00 . A A . 6 PRO O    1 1 
        7  783 1 1 6 TRP C    C 28.689 18.866 17.922 1.00 . A A . 7 TRP C    1 1 
        7  784 1 1 6 TRP CA   C 28.573 19.982 16.870 1.00 . A A . 7 TRP CA   1 1 
        7  785 1 1 6 TRP CB   C 29.646 21.047 17.112 1.00 . A A . 7 TRP CB   1 1 
        7  786 1 1 6 TRP CD1  C 30.688 20.626 19.417 1.00 . A A . 7 TRP CD1  1 1 
        7  787 1 1 6 TRP CD2  C 29.453 22.410 19.301 1.00 . A A . 7 TRP CD2  1 1 
        7  788 1 1 6 TRP CE2  C 29.950 22.401 20.592 1.00 . A A . 7 TRP CE2  1 1 
        7  789 1 1 6 TRP CE3  C 28.619 23.412 18.883 1.00 . A A . 7 TRP CE3  1 1 
        7  790 1 1 6 TRP CG   C 29.900 21.358 18.603 1.00 . A A . 7 TRP CG   1 1 
        7  791 1 1 6 TRP CH2  C 28.771 24.453 21.050 1.00 . A A . 7 TRP CH2  1 1 
        7  792 1 1 6 TRP CZ2  C 29.614 23.427 21.474 1.00 . A A . 7 TRP CZ2  1 1 
        7  793 1 1 6 TRP CZ3  C 28.268 24.443 19.749 1.00 . A A . 7 TRP CZ3  1 1 
        7  794 1 1 6 TRP H    H 27.013 20.995 17.913 1.00 . A A . 7 TRP H    1 1 
        7  795 1 1 6 TRP HA   H 28.668 19.540 15.888 1.00 . A A . 7 TRP HA   1 1 
        7  796 1 1 6 TRP HB2  H 30.576 20.702 16.691 1.00 . A A . 7 TRP HB2  1 1 
        7  797 1 1 6 TRP HB3  H 29.389 21.963 16.617 1.00 . A A . 7 TRP HB3  1 1 
        7  798 1 1 6 TRP HD1  H 31.185 19.708 19.161 1.00 . A A . 7 TRP HD1  1 1 
        7  799 1 1 6 TRP HE1  H 31.156 20.997 21.349 1.00 . A A . 7 TRP HE1  1 1 
        7  800 1 1 6 TRP HE3  H 28.234 23.340 17.889 1.00 . A A . 7 TRP HE3  1 1 
        7  801 1 1 6 TRP HH2  H 28.511 25.254 21.731 1.00 . A A . 7 TRP HH2  1 1 
        7  802 1 1 6 TRP HZ2  H 30.006 23.435 22.482 1.00 . A A . 7 TRP HZ2  1 1 
        7  803 1 1 6 TRP HZ3  H 27.610 25.230 19.419 1.00 . A A . 7 TRP HZ3  1 1 
        7  804 1 1 6 TRP N    N 27.233 20.606 17.031 1.00 . A A . 7 TRP N    1 1 
        7  805 1 1 6 TRP NE1  N 30.667 21.296 20.553 1.00 . A A . 7 TRP NE1  1 1 
        7  806 1 1 6 TRP O    O 29.735 18.262 18.073 1.00 . A A . 7 TRP O    1 1 
        7  807 1 1 7 .   C    C 28.240 16.245 19.393 1.00 . A A . 8 CY3 C    1 1 
        7  808 1 1 7 .   CA   C 27.558 17.610 19.677 1.00 . A A . 8 CY3 CA   1 1 
        7  809 1 1 7 .   CB   C 26.075 17.378 20.045 1.00 . A A . 8 CY3 CB   1 1 
        7  810 1 1 7 .   H    H 26.791 19.151 18.425 1.00 . A A . 8 CY3 H    1 1 
        7  811 1 1 7 .   HA   H 28.081 18.126 20.474 1.00 . A A . 8 CY3 HA   1 1 
        7  812 1 1 7 .   HB2  H 25.838 18.004 20.889 1.00 . A A . 8 CY3 HB2  1 1 
        7  813 1 1 7 .   HB3  H 25.937 16.360 20.371 1.00 . A A . 8 CY3 HB3  1 1 
        7  814 1 1 7 .   HN11 H 30.045 16.919 19.793 1.00 . A A . 8 CY3 HN11 1 1 
        7  815 1 1 7 .   HN12 H 29.962 15.273 19.406 1.00 . A A . 8 CY3 HN12 1 1 
        7  816 1 1 7 .   N    N 27.608 18.638 18.614 1.00 . A A . 8 CY3 N    1 1 
        7  817 1 1 7 .   N1   N 29.521 16.137 19.529 1.00 . A A . 8 CY3 N1   1 1 
        7  818 1 1 7 .   O    O 27.614 15.252 19.057 1.00 . A A . 8 CY3 O    1 1 
        7  819 1 1 7 .   SG   S 24.818 17.708 18.790 1.00 . A A . 8 CY3 SG   1 1 
        8  820 1 1 1 CYS C    C 20.440 17.167 20.272 1.00 . A A . 2 CYS C    1 1 
        8  821 1 1 1 CYS CA   C 21.788 17.866 19.939 1.00 . A A . 2 CYS CA   1 1 
        8  822 1 1 1 CYS CB   C 22.780 16.864 19.380 1.00 . A A . 2 CYS CB   1 1 
        8  823 1 1 1 CYS H1   H 22.798 17.873 21.811 1.00 . A A . 2 CYS H1   1 1 
        8  824 1 1 1 CYS HA   H 21.652 18.612 19.175 1.00 . A A . 2 CYS HA   1 1 
        8  825 1 1 1 CYS HB2  H 22.230 16.183 18.752 1.00 . A A . 2 CYS HB2  1 1 
        8  826 1 1 1 CYS HB3  H 23.473 17.390 18.737 1.00 . A A . 2 CYS HB3  1 1 
        8  827 1 1 1 CYS N    N 22.393 18.484 21.151 1.00 . A A . 2 CYS N    1 1 
        8  828 1 1 1 CYS O    O 20.453 16.127 20.907 1.00 . A A . 2 CYS O    1 1 
        8  829 1 1 1 CYS SG   S 23.764 15.899 20.555 1.00 . A A . 2 CYS SG   1 1 
        8  830 1 1 2 HYP C    C 19.533 20.151 20.402 1.00 . A A . 3 HYP C    1 1 
        8  831 1 1 2 HYP CA   C 19.212 19.103 19.313 1.00 . A A . 3 HYP CA   1 1 
        8  832 1 1 2 HYP CB   C 17.770 19.219 18.790 1.00 . A A . 3 HYP CB   1 1 
        8  833 1 1 2 HYP CD   C 18.025 17.009 19.925 1.00 . A A . 3 HYP CD   1 1 
        8  834 1 1 2 HYP CG   C 17.158 17.794 18.916 1.00 . A A . 3 HYP CG   1 1 
        8  835 1 1 2 HYP HA   H 19.905 19.201 18.492 1.00 . A A . 3 HYP HA   1 1 
        8  836 1 1 2 HYP HB2  H 17.770 19.580 17.773 1.00 . A A . 3 HYP HB2  1 1 
        8  837 1 1 2 HYP HB3  H 17.200 19.911 19.398 1.00 . A A . 3 HYP HB3  1 1 
        8  838 1 1 2 HYP HD1  H 17.325 17.897 16.979 1.00 . A A . 3 HYP HD1  1 1 
        8  839 1 1 2 HYP HD22 H 18.161 15.976 19.635 1.00 . A A . 3 HYP HD22 1 1 
        8  840 1 1 2 HYP HD23 H 17.624 17.065 20.929 1.00 . A A . 3 HYP HD23 1 1 
        8  841 1 1 2 HYP HG   H 16.095 17.790 19.147 1.00 . A A . 3 HYP HG   1 1 
        8  842 1 1 2 HYP N    N 19.324 17.728 19.874 1.00 . A A . 3 HYP N    1 1 
        8  843 1 1 2 HYP O    O 18.684 20.473 21.212 1.00 . A A . 3 HYP O    1 1 
        8  844 1 1 2 HYP OD1  O 17.434 17.211 17.651 1.00 . A A . 3 HYP OD1  1 1 
        8  845 1 1 3 DTR C    C 22.430 22.295 20.621 1.00 . A A . 4 DTR C    1 1 
        8  846 1 1 3 DTR CA   C 21.285 21.638 21.378 1.00 . A A . 4 DTR CA   1 1 
        8  847 1 1 3 DTR CB   C 20.232 22.735 21.752 1.00 . A A . 4 DTR CB   1 1 
        8  848 1 1 3 DTR CD1  C 18.708 23.082 19.740 1.00 . A A . 4 DTR CD1  1 1 
        8  849 1 1 3 DTR CD2  C 19.964 24.802 20.235 1.00 . A A . 4 DTR CD2  1 1 
        8  850 1 1 3 DTR CE2  C 19.212 25.198 19.139 1.00 . A A . 4 DTR CE2  1 1 
        8  851 1 1 3 DTR CE3  C 20.881 25.656 20.819 1.00 . A A . 4 DTR CE3  1 1 
        8  852 1 1 3 DTR CG   C 19.651 23.540 20.583 1.00 . A A . 4 DTR CG   1 1 
        8  853 1 1 3 DTR CH2  C 20.300 27.345 19.202 1.00 . A A . 4 DTR CH2  1 1 
        8  854 1 1 3 DTR CZ2  C 19.378 26.474 18.620 1.00 . A A . 4 DTR CZ2  1 1 
        8  855 1 1 3 DTR CZ3  C 21.051 26.936 20.302 1.00 . A A . 4 DTR CZ3  1 1 
        8  856 1 1 3 DTR H    H 21.387 20.274 19.770 1.00 . A A . 4 DTR H    1 1 
        8  857 1 1 3 DTR HA   H 21.622 21.186 22.272 1.00 . A A . 4 DTR HA   1 1 
        8  858 1 1 3 DTR HB2  H 20.749 23.423 22.385 1.00 . A A . 4 DTR HB2  1 1 
        8  859 1 1 3 DTR HB3  H 19.420 22.319 22.328 1.00 . A A . 4 DTR HB3  1 1 
        8  860 1 1 3 DTR HD1  H 18.259 22.107 19.772 1.00 . A A . 4 DTR HD1  1 1 
        8  861 1 1 3 DTR HE1  H 17.845 24.056 18.195 1.00 . A A . 4 DTR HE1  1 1 
        8  862 1 1 3 DTR HE3  H 21.456 25.299 21.664 1.00 . A A . 4 DTR HE3  1 1 
        8  863 1 1 3 DTR HH2  H 20.427 28.339 18.791 1.00 . A A . 4 DTR HH2  1 1 
        8  864 1 1 3 DTR HZ2  H 18.796 26.795 17.766 1.00 . A A . 4 DTR HZ2  1 1 
        8  865 1 1 3 DTR HZ3  H 21.757 27.623 20.743 1.00 . A A . 4 DTR HZ3  1 1 
        8  866 1 1 3 DTR N    N 20.750 20.612 20.429 1.00 . A A . 4 DTR N    1 1 
        8  867 1 1 3 DTR NE1  N 18.500 24.104 18.928 1.00 . A A . 4 DTR NE1  1 1 
        8  868 1 1 3 DTR O    O 22.387 23.376 20.075 1.00 . A A . 4 DTR O    1 1 
        8  869 1 1 4 GLN C    C 24.892 21.083 18.731 1.00 . A A . 5 GLN C    1 1 
        8  870 1 1 4 GLN CA   C 24.722 22.001 19.913 1.00 . A A . 5 GLN CA   1 1 
        8  871 1 1 4 GLN CB   C 25.980 21.865 20.760 1.00 . A A . 5 GLN CB   1 1 
        8  872 1 1 4 GLN CD   C 24.883 22.864 22.809 1.00 . A A . 5 GLN CD   1 1 
        8  873 1 1 4 GLN CG   C 26.024 22.961 21.790 1.00 . A A . 5 GLN CG   1 1 
        8  874 1 1 4 GLN H    H 23.479 20.656 21.041 1.00 . A A . 5 GLN H    1 1 
        8  875 1 1 4 GLN HA   H 24.615 23.028 19.608 1.00 . A A . 5 GLN HA   1 1 
        8  876 1 1 4 GLN HB2  H 26.129 20.888 21.159 1.00 . A A . 5 GLN HB2  1 1 
        8  877 1 1 4 GLN HB3  H 26.790 22.033 20.077 1.00 . A A . 5 GLN HB3  1 1 
        8  878 1 1 4 GLN HE21 H 24.950 20.894 22.954 1.00 . A A . 5 GLN HE21 1 1 
        8  879 1 1 4 GLN HE22 H 23.771 21.651 23.900 1.00 . A A . 5 GLN HE22 1 1 
        8  880 1 1 4 GLN HG2  H 26.965 22.962 22.320 1.00 . A A . 5 GLN HG2  1 1 
        8  881 1 1 4 GLN HG3  H 25.939 23.865 21.201 1.00 . A A . 5 GLN HG3  1 1 
        8  882 1 1 4 GLN N    N 23.492 21.537 20.606 1.00 . A A . 5 GLN N    1 1 
        8  883 1 1 4 GLN NE2  N 24.505 21.708 23.255 1.00 . A A . 5 GLN NE2  1 1 
        8  884 1 1 4 GLN O    O 25.112 19.908 18.938 1.00 . A A . 5 GLN O    1 1 
        8  885 1 1 4 GLN OE1  O 24.317 23.856 23.215 1.00 . A A . 5 GLN OE1  1 1 
        8  886 1 1 5 PRO C    C 26.259 20.204 16.103 1.00 . A A . 6 PRO C    1 1 
        8  887 1 1 5 PRO CA   C 24.838 20.701 16.366 1.00 . A A . 6 PRO CA   1 1 
        8  888 1 1 5 PRO CB   C 24.234 21.548 15.229 1.00 . A A . 6 PRO CB   1 1 
        8  889 1 1 5 PRO CD   C 24.666 23.031 17.212 1.00 . A A . 6 PRO CD   1 1 
        8  890 1 1 5 PRO CG   C 24.176 23.041 15.749 1.00 . A A . 6 PRO CG   1 1 
        8  891 1 1 5 PRO HA   H 24.232 19.838 16.589 1.00 . A A . 6 PRO HA   1 1 
        8  892 1 1 5 PRO HB2  H 24.818 21.464 14.317 1.00 . A A . 6 PRO HB2  1 1 
        8  893 1 1 5 PRO HB3  H 23.223 21.195 15.064 1.00 . A A . 6 PRO HB3  1 1 
        8  894 1 1 5 PRO HD2  H 25.622 23.516 17.314 1.00 . A A . 6 PRO HD2  1 1 
        8  895 1 1 5 PRO HD3  H 23.964 23.463 17.904 1.00 . A A . 6 PRO HD3  1 1 
        8  896 1 1 5 PRO HG2  H 24.803 23.674 15.142 1.00 . A A . 6 PRO HG2  1 1 
        8  897 1 1 5 PRO HG3  H 23.162 23.405 15.714 1.00 . A A . 6 PRO HG3  1 1 
        8  898 1 1 5 PRO N    N 24.804 21.591 17.533 1.00 . A A . 6 PRO N    1 1 
        8  899 1 1 5 PRO O    O 26.576 19.734 15.024 1.00 . A A . 6 PRO O    1 1 
        8  900 1 1 6 TRP C    C 28.721 18.889 18.088 1.00 . A A . 7 TRP C    1 1 
        8  901 1 1 6 TRP CA   C 28.490 19.876 16.965 1.00 . A A . 7 TRP CA   1 1 
        8  902 1 1 6 TRP CB   C 29.445 21.083 17.090 1.00 . A A . 7 TRP CB   1 1 
        8  903 1 1 6 TRP CD1  C 30.596 20.855 19.353 1.00 . A A . 7 TRP CD1  1 1 
        8  904 1 1 6 TRP CD2  C 29.198 22.523 19.220 1.00 . A A . 7 TRP CD2  1 1 
        8  905 1 1 6 TRP CE2  C 29.724 22.596 20.493 1.00 . A A . 7 TRP CE2  1 1 
        8  906 1 1 6 TRP CE3  C 28.260 23.431 18.795 1.00 . A A . 7 TRP CE3  1 1 
        8  907 1 1 6 TRP CG   C 29.724 21.490 18.546 1.00 . A A . 7 TRP CG   1 1 
        8  908 1 1 6 TRP CH2  C 28.370 24.539 20.922 1.00 . A A . 7 TRP CH2  1 1 
        8  909 1 1 6 TRP CZ2  C 29.313 23.610 21.349 1.00 . A A . 7 TRP CZ2  1 1 
        8  910 1 1 6 TRP CZ3  C 27.838 24.448 19.639 1.00 . A A . 7 TRP CZ3  1 1 
        8  911 1 1 6 TRP H    H 26.828 20.752 17.952 1.00 . A A . 7 TRP H    1 1 
        8  912 1 1 6 TRP HA   H 28.613 19.355 16.032 1.00 . A A . 7 TRP HA   1 1 
        8  913 1 1 6 TRP HB2  H 30.387 20.815 16.638 1.00 . A A . 7 TRP HB2  1 1 
        8  914 1 1 6 TRP HB3  H 29.069 21.931 16.560 1.00 . A A . 7 TRP HB3  1 1 
        8  915 1 1 6 TRP HD1  H 31.166 19.974 19.111 1.00 . A A . 7 TRP HD1  1 1 
        8  916 1 1 6 TRP HE1  H 31.062 21.329 21.263 1.00 . A A . 7 TRP HE1  1 1 
        8  917 1 1 6 TRP HE3  H 27.874 23.295 17.808 1.00 . A A . 7 TRP HE3  1 1 
        8  918 1 1 6 TRP HH2  H 28.062 25.330 21.593 1.00 . A A . 7 TRP HH2  1 1 
        8  919 1 1 6 TRP HZ2  H 29.720 23.666 22.347 1.00 . A A . 7 TRP HZ2  1 1 
        8  920 1 1 6 TRP HZ3  H 27.091 25.152 19.316 1.00 . A A . 7 TRP HZ3  1 1 
        8  921 1 1 6 TRP N    N 27.093 20.340 17.097 1.00 . A A . 7 TRP N    1 1 
        8  922 1 1 6 TRP NE1  N 30.539 21.560 20.468 1.00 . A A . 7 TRP NE1  1 1 
        8  923 1 1 6 TRP O    O 29.804 18.355 18.199 1.00 . A A . 7 TRP O    1 1 
        8  924 1 1 7 .   C    C 28.635 16.478 19.647 1.00 . A A . 8 CY3 C    1 1 
        8  925 1 1 7 .   CA   C 27.834 17.737 20.022 1.00 . A A . 8 CY3 CA   1 1 
        8  926 1 1 7 .   CB   C 26.422 17.321 20.522 1.00 . A A . 8 CY3 CB   1 1 
        8  927 1 1 7 .   H    H 26.844 19.118 18.715 1.00 . A A . 8 CY3 H    1 1 
        8  928 1 1 7 .   HA   H 28.368 18.322 20.761 1.00 . A A . 8 CY3 HA   1 1 
        8  929 1 1 7 .   HB2  H 25.759 18.168 20.473 1.00 . A A . 8 CY3 HB2  1 1 
        8  930 1 1 7 .   HB3  H 26.518 17.054 21.566 1.00 . A A . 8 CY3 HB3  1 1 
        8  931 1 1 7 .   HN11 H 29.755 16.467 21.275 1.00 . A A . 8 CY3 HN11 1 1 
        8  932 1 1 7 .   HN12 H 30.057 15.223 20.161 1.00 . A A . 8 CY3 HN12 1 1 
        8  933 1 1 7 .   N    N 27.702 18.674 18.880 1.00 . A A . 8 CY3 N    1 1 
        8  934 1 1 7 .   N1   N 29.557 16.019 20.430 1.00 . A A . 8 CY3 N1   1 1 
        8  935 1 1 7 .   O    O 28.434 15.881 18.610 1.00 . A A . 8 CY3 O    1 1 
        8  936 1 1 7 .   SG   S 25.595 15.930 19.710 1.00 . A A . 8 CY3 SG   1 1 
        9  937 1 1 1 CYS C    C 20.229 16.999 20.605 1.00 . A A . 2 CYS C    1 1 
        9  938 1 1 1 CYS CA   C 21.687 17.443 20.361 1.00 . A A . 2 CYS CA   1 1 
        9  939 1 1 1 CYS CB   C 22.101 17.173 18.897 1.00 . A A . 2 CYS CB   1 1 
        9  940 1 1 1 CYS H1   H 23.298 16.126 20.810 1.00 . A A . 2 CYS H1   1 1 
        9  941 1 1 1 CYS HA   H 21.773 18.491 20.592 1.00 . A A . 2 CYS HA   1 1 
        9  942 1 1 1 CYS HB2  H 21.255 16.762 18.355 1.00 . A A . 2 CYS HB2  1 1 
        9  943 1 1 1 CYS HB3  H 22.361 18.109 18.429 1.00 . A A . 2 CYS HB3  1 1 
        9  944 1 1 1 CYS N    N 22.626 16.692 21.247 1.00 . A A . 2 CYS N    1 1 
        9  945 1 1 1 CYS O    O 20.031 15.997 21.269 1.00 . A A . 2 CYS O    1 1 
        9  946 1 1 1 CYS SG   S 23.491 16.050 18.612 1.00 . A A . 2 CYS SG   1 1 
        9  947 1 1 2 HYP C    C 19.679 20.206 20.281 1.00 . A A . 3 HYP C    1 1 
        9  948 1 1 2 HYP CA   C 19.396 19.007 19.349 1.00 . A A . 3 HYP CA   1 1 
        9  949 1 1 2 HYP CB   C 18.069 19.209 18.591 1.00 . A A . 3 HYP CB   1 1 
        9  950 1 1 2 HYP CD   C 17.843 17.256 20.179 1.00 . A A . 3 HYP CD   1 1 
        9  951 1 1 2 HYP CG   C 17.063 18.190 19.220 1.00 . A A . 3 HYP CG   1 1 
        9  952 1 1 2 HYP HA   H 20.198 18.923 18.628 1.00 . A A . 3 HYP HA   1 1 
        9  953 1 1 2 HYP HB2  H 18.204 19.104 17.524 1.00 . A A . 3 HYP HB2  1 1 
        9  954 1 1 2 HYP HB3  H 17.670 20.197 18.783 1.00 . A A . 3 HYP HB3  1 1 
        9  955 1 1 2 HYP HD1  H 16.208 17.969 17.487 1.00 . A A . 3 HYP HD1  1 1 
        9  956 1 1 2 HYP HD22 H 17.779 16.215 19.894 1.00 . A A . 3 HYP HD22 1 1 
        9  957 1 1 2 HYP HD23 H 17.504 17.357 21.198 1.00 . A A . 3 HYP HD23 1 1 
        9  958 1 1 2 HYP HG   H 16.242 18.700 19.711 1.00 . A A . 3 HYP HG   1 1 
        9  959 1 1 2 HYP N    N 19.255 17.710 20.082 1.00 . A A . 3 HYP N    1 1 
        9  960 1 1 2 HYP O    O 18.783 20.589 21.004 1.00 . A A . 3 HYP O    1 1 
        9  961 1 1 2 HYP OD1  O 16.612 17.386 18.140 1.00 . A A . 3 HYP OD1  1 1 
        9  962 1 1 3 DTR C    C 22.441 22.609 20.375 1.00 . A A . 4 DTR C    1 1 
        9  963 1 1 3 DTR CA   C 21.289 21.918 21.119 1.00 . A A . 4 DTR CA   1 1 
        9  964 1 1 3 DTR CB   C 20.135 22.956 21.291 1.00 . A A . 4 DTR CB   1 1 
        9  965 1 1 3 DTR CD1  C 18.967 22.934 19.012 1.00 . A A . 4 DTR CD1  1 1 
        9  966 1 1 3 DTR CD2  C 19.829 24.844 19.582 1.00 . A A . 4 DTR CD2  1 1 
        9  967 1 1 3 DTR CE2  C 19.261 25.060 18.335 1.00 . A A . 4 DTR CE2  1 1 
        9  968 1 1 3 DTR CE3  C 20.472 25.863 20.263 1.00 . A A . 4 DTR CE3  1 1 
        9  969 1 1 3 DTR CG   C 19.648 23.575 19.974 1.00 . A A . 4 DTR CG   1 1 
        9  970 1 1 3 DTR CH2  C 19.981 27.365 18.436 1.00 . A A . 4 DTR CH2  1 1 
        9  971 1 1 3 DTR CZ2  C 19.341 26.326 17.760 1.00 . A A . 4 DTR CZ2  1 1 
        9  972 1 1 3 DTR CZ3  C 20.547 27.132 19.688 1.00 . A A . 4 DTR CZ3  1 1 
        9  973 1 1 3 DTR H    H 21.559 20.361 19.679 1.00 . A A . 4 DTR H    1 1 
        9  974 1 1 3 DTR HA   H 21.608 21.622 22.092 1.00 . A A . 4 DTR HA   1 1 
        9  975 1 1 3 DTR HB2  H 20.550 23.738 21.879 1.00 . A A . 4 DTR HB2  1 1 
        9  976 1 1 3 DTR HB3  H 19.292 22.565 21.836 1.00 . A A . 4 DTR HB3  1 1 
        9  977 1 1 3 DTR HD1  H 18.664 21.911 19.043 1.00 . A A . 4 DTR HD1  1 1 
        9  978 1 1 3 DTR HE1  H 18.295 23.635 17.256 1.00 . A A . 4 DTR HE1  1 1 
        9  979 1 1 3 DTR HE3  H 20.909 25.644 21.233 1.00 . A A . 4 DTR HE3  1 1 
        9  980 1 1 3 DTR HH2  H 20.039 28.350 17.985 1.00 . A A . 4 DTR HH2  1 1 
        9  981 1 1 3 DTR HZ2  H 18.900 26.505 16.790 1.00 . A A . 4 DTR HZ2  1 1 
        9  982 1 1 3 DTR HZ3  H 21.040 27.939 20.211 1.00 . A A . 4 DTR HZ3  1 1 
        9  983 1 1 3 DTR N    N 20.879 20.735 20.274 1.00 . A A . 4 DTR N    1 1 
        9  984 1 1 3 DTR NE1  N 18.774 23.853 18.087 1.00 . A A . 4 DTR NE1  1 1 
        9  985 1 1 3 DTR O    O 22.374 23.657 19.759 1.00 . A A . 4 DTR O    1 1 
        9  986 1 1 4 GLN C    C 25.007 21.434 18.693 1.00 . A A . 5 GLN C    1 1 
        9  987 1 1 4 GLN CA   C 24.795 22.382 19.839 1.00 . A A . 5 GLN CA   1 1 
        9  988 1 1 4 GLN CB   C 25.969 22.259 20.782 1.00 . A A . 5 GLN CB   1 1 
        9  989 1 1 4 GLN CD   C 24.711 23.638 22.484 1.00 . A A . 5 GLN CD   1 1 
        9  990 1 1 4 GLN CG   C 26.011 23.464 21.702 1.00 . A A . 5 GLN CG   1 1 
        9  991 1 1 4 GLN H    H 23.535 21.069 20.974 1.00 . A A . 5 GLN H    1 1 
        9  992 1 1 4 GLN HA   H 24.674 23.404 19.519 1.00 . A A . 5 GLN HA   1 1 
        9  993 1 1 4 GLN HB2  H 25.954 21.332 21.311 1.00 . A A . 5 GLN HB2  1 1 
        9  994 1 1 4 GLN HB3  H 26.858 22.264 20.176 1.00 . A A . 5 GLN HB3  1 1 
        9  995 1 1 4 GLN HE21 H 24.986 22.037 23.620 1.00 . A A . 5 GLN HE21 1 1 
        9  996 1 1 4 GLN HE22 H 23.551 22.889 23.895 1.00 . A A . 5 GLN HE22 1 1 
        9  997 1 1 4 GLN HG2  H 26.842 23.391 22.391 1.00 . A A . 5 GLN HG2  1 1 
        9  998 1 1 4 GLN HG3  H 26.162 24.282 21.012 1.00 . A A . 5 GLN HG3  1 1 
        9  999 1 1 4 GLN N    N 23.537 21.912 20.472 1.00 . A A . 5 GLN N    1 1 
        9 1000 1 1 4 GLN NE2  N 24.393 22.784 23.405 1.00 . A A . 5 GLN NE2  1 1 
        9 1001 1 1 4 GLN O    O 25.158 20.256 18.938 1.00 . A A . 5 GLN O    1 1 
        9 1002 1 1 4 GLN OE1  O 23.969 24.570 22.253 1.00 . A A . 5 GLN OE1  1 1 
        9 1003 1 1 5 PRO C    C 26.339 20.291 16.131 1.00 . A A . 6 PRO C    1 1 
        9 1004 1 1 5 PRO CA   C 24.976 20.977 16.333 1.00 . A A . 6 PRO CA   1 1 
        9 1005 1 1 5 PRO CB   C 24.520 21.867 15.167 1.00 . A A . 6 PRO CB   1 1 
        9 1006 1 1 5 PRO CD   C 25.107 23.339 17.109 1.00 . A A . 6 PRO CD   1 1 
        9 1007 1 1 5 PRO CG   C 24.747 23.355 15.599 1.00 . A A . 6 PRO CG   1 1 
        9 1008 1 1 5 PRO HA   H 24.242 20.204 16.533 1.00 . A A . 6 PRO HA   1 1 
        9 1009 1 1 5 PRO HB2  H 25.045 21.611 14.254 1.00 . A A . 6 PRO HB2  1 1 
        9 1010 1 1 5 PRO HB3  H 23.461 21.680 15.065 1.00 . A A . 6 PRO HB3  1 1 
        9 1011 1 1 5 PRO HD2  H 26.107 23.708 17.287 1.00 . A A . 6 PRO HD2  1 1 
        9 1012 1 1 5 PRO HD3  H 24.416 23.900 17.718 1.00 . A A . 6 PRO HD3  1 1 
        9 1013 1 1 5 PRO HG2  H 25.551 23.802 15.031 1.00 . A A . 6 PRO HG2  1 1 
        9 1014 1 1 5 PRO HG3  H 23.851 23.940 15.453 1.00 . A A . 6 PRO HG3  1 1 
        9 1015 1 1 5 PRO N    N 25.031 21.902 17.482 1.00 . A A . 6 PRO N    1 1 
        9 1016 1 1 5 PRO O    O 26.561 19.638 15.130 1.00 . A A . 6 PRO O    1 1 
        9 1017 1 1 6 TRP C    C 28.634 18.777 18.089 1.00 . A A . 7 TRP C    1 1 
        9 1018 1 1 6 TRP CA   C 28.569 19.844 17.004 1.00 . A A . 7 TRP CA   1 1 
        9 1019 1 1 6 TRP CB   C 29.654 20.896 17.268 1.00 . A A . 7 TRP CB   1 1 
        9 1020 1 1 6 TRP CD1  C 30.500 20.479 19.654 1.00 . A A . 7 TRP CD1  1 1 
        9 1021 1 1 6 TRP CD2  C 29.394 22.334 19.401 1.00 . A A . 7 TRP CD2  1 1 
        9 1022 1 1 6 TRP CE2  C 29.786 22.329 20.729 1.00 . A A . 7 TRP CE2  1 1 
        9 1023 1 1 6 TRP CE3  C 28.655 23.372 18.897 1.00 . A A . 7 TRP CE3  1 1 
        9 1024 1 1 6 TRP CG   C 29.826 21.238 18.765 1.00 . A A . 7 TRP CG   1 1 
        9 1025 1 1 6 TRP CH2  C 28.699 24.454 21.045 1.00 . A A . 7 TRP CH2  1 1 
        9 1026 1 1 6 TRP CZ2  C 29.441 23.394 21.559 1.00 . A A . 7 TRP CZ2  1 1 
        9 1027 1 1 6 TRP CZ3  C 28.300 24.445 19.710 1.00 . A A . 7 TRP CZ3  1 1 
        9 1028 1 1 6 TRP H    H 26.987 21.024 17.877 1.00 . A A . 7 TRP H    1 1 
        9 1029 1 1 6 TRP HA   H 28.706 19.367 16.044 1.00 . A A . 7 TRP HA   1 1 
        9 1030 1 1 6 TRP HB2  H 30.596 20.503 16.920 1.00 . A A . 7 TRP HB2  1 1 
        9 1031 1 1 6 TRP HB3  H 29.454 21.807 16.740 1.00 . A A . 7 TRP HB3  1 1 
        9 1032 1 1 6 TRP HD1  H 30.958 19.529 19.453 1.00 . A A . 7 TRP HD1  1 1 
        9 1033 1 1 6 TRP HE1  H 30.842 20.856 21.617 1.00 . A A . 7 TRP HE1  1 1 
        9 1034 1 1 6 TRP HE3  H 28.350 23.309 17.876 1.00 . A A . 7 TRP HE3  1 1 
        9 1035 1 1 6 TRP HH2  H 28.436 25.284 21.682 1.00 . A A . 7 TRP HH2  1 1 
        9 1036 1 1 6 TRP HZ2  H 29.757 23.387 22.592 1.00 . A A . 7 TRP HZ2  1 1 
        9 1037 1 1 6 TRP HZ3  H 27.708 25.259 19.318 1.00 . A A . 7 TRP HZ3  1 1 
        9 1038 1 1 6 TRP N    N 27.214 20.473 17.089 1.00 . A A . 7 TRP N    1 1 
        9 1039 1 1 6 TRP NE1  N 30.436 21.181 20.778 1.00 . A A . 7 TRP NE1  1 1 
        9 1040 1 1 6 TRP O    O 29.635 18.108 18.248 1.00 . A A . 7 TRP O    1 1 
        9 1041 1 1 7 .   C    C 28.162 16.431 19.801 1.00 . A A . 8 CY3 C    1 1 
        9 1042 1 1 7 .   CA   C 27.351 17.733 19.910 1.00 . A A . 8 CY3 CA   1 1 
        9 1043 1 1 7 .   CB   C 25.851 17.409 19.975 1.00 . A A . 8 CY3 CB   1 1 
        9 1044 1 1 7 .   H    H 26.780 19.256 18.577 1.00 . A A . 8 CY3 H    1 1 
        9 1045 1 1 7 .   HA   H 27.697 18.308 20.759 1.00 . A A . 8 CY3 HA   1 1 
        9 1046 1 1 7 .   HB2  H 25.356 18.171 20.555 1.00 . A A . 8 CY3 HB2  1 1 
        9 1047 1 1 7 .   HB3  H 25.717 16.465 20.485 1.00 . A A . 8 CY3 HB3  1 1 
        9 1048 1 1 7 .   HN11 H 27.683 16.194 17.915 1.00 . A A . 8 CY3 HN11 1 1 
        9 1049 1 1 7 .   HN12 H 28.695 14.990 18.562 1.00 . A A . 8 CY3 HN12 1 1 
        9 1050 1 1 7 .   N    N 27.540 18.679 18.791 1.00 . A A . 8 CY3 N    1 1 
        9 1051 1 1 7 .   N1   N 28.182 15.814 18.666 1.00 . A A . 8 CY3 N1   1 1 
        9 1052 1 1 7 .   O    O 28.780 15.966 20.738 1.00 . A A . 8 CY3 O    1 1 
        9 1053 1 1 7 .   SG   S 25.045 17.305 18.358 1.00 . A A . 8 CY3 SG   1 1 
       10 1054 1 1 1 CYS C    C 19.792 17.020 20.732 1.00 . A A . 2 CYS C    1 1 
       10 1055 1 1 1 CYS CA   C 21.163 17.499 21.268 1.00 . A A . 2 CYS CA   1 1 
       10 1056 1 1 1 CYS CB   C 22.315 17.168 20.287 1.00 . A A . 2 CYS CB   1 1 
       10 1057 1 1 1 CYS H1   H 20.766 16.089 22.786 1.00 . A A . 2 CYS H1   1 1 
       10 1058 1 1 1 CYS HA   H 21.121 18.553 21.485 1.00 . A A . 2 CYS HA   1 1 
       10 1059 1 1 1 CYS HB2  H 22.940 16.408 20.731 1.00 . A A . 2 CYS HB2  1 1 
       10 1060 1 1 1 CYS HB3  H 21.904 16.738 19.386 1.00 . A A . 2 CYS HB3  1 1 
       10 1061 1 1 1 CYS N    N 21.422 16.777 22.542 1.00 . A A . 2 CYS N    1 1 
       10 1062 1 1 1 CYS O    O 19.224 16.109 21.316 1.00 . A A . 2 CYS O    1 1 
       10 1063 1 1 1 CYS SG   S 23.391 18.538 19.796 1.00 . A A . 2 CYS SG   1 1 
       10 1064 1 1 2 HYP C    C 19.888 20.047 19.842 1.00 . A A . 3 HYP C    1 1 
       10 1065 1 1 2 HYP CA   C 19.882 18.779 18.956 1.00 . A A . 3 HYP CA   1 1 
       10 1066 1 1 2 HYP CB   C 19.021 18.976 17.680 1.00 . A A . 3 HYP CB   1 1 
       10 1067 1 1 2 HYP CD   C 18.017 17.134 19.065 1.00 . A A . 3 HYP CD   1 1 
       10 1068 1 1 2 HYP CG   C 17.962 17.838 17.692 1.00 . A A . 3 HYP CG   1 1 
       10 1069 1 1 2 HYP HA   H 20.892 18.542 18.654 1.00 . A A . 3 HYP HA   1 1 
       10 1070 1 1 2 HYP HB2  H 19.648 18.984 16.797 1.00 . A A . 3 HYP HB2  1 1 
       10 1071 1 1 2 HYP HB3  H 18.495 19.917 17.739 1.00 . A A . 3 HYP HB3  1 1 
       10 1072 1 1 2 HYP HD1  H 17.664 16.450 16.394 1.00 . A A . 3 HYP HD1  1 1 
       10 1073 1 1 2 HYP HD22 H 18.035 16.054 18.987 1.00 . A A . 3 HYP HD22 1 1 
       10 1074 1 1 2 HYP HD23 H 17.193 17.430 19.698 1.00 . A A . 3 HYP HD23 1 1 
       10 1075 1 1 2 HYP HG   H 16.968 18.168 17.434 1.00 . A A . 3 HYP HG   1 1 
       10 1076 1 1 2 HYP N    N 19.285 17.609 19.670 1.00 . A A . 3 HYP N    1 1 
       10 1077 1 1 2 HYP O    O 18.830 20.477 20.253 1.00 . A A . 3 HYP O    1 1 
       10 1078 1 1 2 HYP OD1  O 18.442 16.872 16.776 1.00 . A A . 3 HYP OD1  1 1 
       10 1079 1 1 3 DTR C    C 22.568 22.505 20.504 1.00 . A A . 4 DTR C    1 1 
       10 1080 1 1 3 DTR CA   C 21.274 21.811 20.962 1.00 . A A . 4 DTR CA   1 1 
       10 1081 1 1 3 DTR CB   C 20.098 22.851 20.825 1.00 . A A . 4 DTR CB   1 1 
       10 1082 1 1 3 DTR CD1  C 19.448 22.786 18.364 1.00 . A A . 4 DTR CD1  1 1 
       10 1083 1 1 3 DTR CD2  C 20.232 24.703 19.042 1.00 . A A . 4 DTR CD2  1 1 
       10 1084 1 1 3 DTR CE2  C 19.941 24.876 17.698 1.00 . A A . 4 DTR CE2  1 1 
       10 1085 1 1 3 DTR CE3  C 20.756 25.745 19.791 1.00 . A A . 4 DTR CE3  1 1 
       10 1086 1 1 3 DTR CG   C 19.931 23.451 19.420 1.00 . A A . 4 DTR CG   1 1 
       10 1087 1 1 3 DTR CH2  C 20.692 27.158 17.839 1.00 . A A . 4 DTR CH2  1 1 
       10 1088 1 1 3 DTR CZ2  C 20.168 26.103 17.094 1.00 . A A . 4 DTR CZ2  1 1 
       10 1089 1 1 3 DTR CZ3  C 20.986 26.983 19.189 1.00 . A A . 4 DTR CZ3  1 1 
       10 1090 1 1 3 DTR H    H 21.848 20.164 19.744 1.00 . A A . 4 DTR H    1 1 
       10 1091 1 1 3 DTR HA   H 21.343 21.562 21.994 1.00 . A A . 4 DTR HA   1 1 
       10 1092 1 1 3 DTR HB2  H 20.371 23.639 21.484 1.00 . A A . 4 DTR HB2  1 1 
       10 1093 1 1 3 DTR HB3  H 19.156 22.452 21.173 1.00 . A A . 4 DTR HB3  1 1 
       10 1094 1 1 3 DTR HD1  H 19.121 21.767 18.363 1.00 . A A . 4 DTR HD1  1 1 
       10 1095 1 1 3 DTR HE1  H 19.183 23.457 16.480 1.00 . A A . 4 DTR HE1  1 1 
       10 1096 1 1 3 DTR HE3  H 20.978 25.562 20.833 1.00 . A A . 4 DTR HE3  1 1 
       10 1097 1 1 3 DTR HH2  H 20.863 28.116 17.365 1.00 . A A . 4 DTR HH2  1 1 
       10 1098 1 1 3 DTR HZ2  H 19.940 26.242 16.046 1.00 . A A . 4 DTR HZ2  1 1 
       10 1099 1 1 3 DTR HZ3  H 21.388 27.807 19.753 1.00 . A A . 4 DTR HZ3  1 1 
       10 1100 1 1 3 DTR N    N 21.051 20.582 20.122 1.00 . A A . 4 DTR N    1 1 
       10 1101 1 1 3 DTR NE1  N 19.480 23.675 17.395 1.00 . A A . 4 DTR NE1  1 1 
       10 1102 1 1 3 DTR O    O 22.640 23.692 20.252 1.00 . A A . 4 DTR O    1 1 
       10 1103 1 1 4 GLN C    C 25.152 21.480 18.746 1.00 . A A . 5 GLN C    1 1 
       10 1104 1 1 4 GLN CA   C 24.914 22.296 19.982 1.00 . A A . 5 GLN CA   1 1 
       10 1105 1 1 4 GLN CB   C 26.089 22.005 20.895 1.00 . A A . 5 GLN CB   1 1 
       10 1106 1 1 4 GLN CD   C 25.041 23.072 22.938 1.00 . A A . 5 GLN CD   1 1 
       10 1107 1 1 4 GLN CG   C 26.234 23.037 21.973 1.00 . A A . 5 GLN CG   1 1 
       10 1108 1 1 4 GLN H    H 23.563 20.775 20.652 1.00 . A A . 5 GLN H    1 1 
       10 1109 1 1 4 GLN HA   H 24.835 23.350 19.765 1.00 . A A . 5 GLN HA   1 1 
       10 1110 1 1 4 GLN HB2  H 26.139 21.000 21.247 1.00 . A A . 5 GLN HB2  1 1 
       10 1111 1 1 4 GLN HB3  H 26.950 22.129 20.258 1.00 . A A . 5 GLN HB3  1 1 
       10 1112 1 1 4 GLN HE21 H 23.868 24.164 21.766 1.00 . A A . 5 GLN HE21 1 1 
       10 1113 1 1 4 GLN HE22 H 23.213 23.723 23.272 1.00 . A A . 5 GLN HE22 1 1 
       10 1114 1 1 4 GLN HG2  H 27.128 22.857 22.551 1.00 . A A . 5 GLN HG2  1 1 
       10 1115 1 1 4 GLN HG3  H 26.336 23.954 21.417 1.00 . A A . 5 GLN HG3  1 1 
       10 1116 1 1 4 GLN N    N 23.612 21.731 20.427 1.00 . A A . 5 GLN N    1 1 
       10 1117 1 1 4 GLN NE2  N 23.958 23.704 22.629 1.00 . A A . 5 GLN NE2  1 1 
       10 1118 1 1 4 GLN O    O 25.463 20.323 18.892 1.00 . A A . 5 GLN O    1 1 
       10 1119 1 1 4 GLN OE1  O 25.075 22.509 24.016 1.00 . A A . 5 GLN OE1  1 1 
       10 1120 1 1 5 PRO C    C 26.339 20.522 16.077 1.00 . A A . 6 PRO C    1 1 
       10 1121 1 1 5 PRO CA   C 24.963 21.151 16.379 1.00 . A A . 6 PRO CA   1 1 
       10 1122 1 1 5 PRO CB   C 24.416 22.072 15.283 1.00 . A A . 6 PRO CB   1 1 
       10 1123 1 1 5 PRO CD   C 24.972 23.466 17.293 1.00 . A A . 6 PRO CD   1 1 
       10 1124 1 1 5 PRO CG   C 24.413 23.535 15.856 1.00 . A A . 6 PRO CG   1 1 
       10 1125 1 1 5 PRO HA   H 24.276 20.337 16.589 1.00 . A A . 6 PRO HA   1 1 
       10 1126 1 1 5 PRO HB2  H 24.994 21.979 14.373 1.00 . A A . 6 PRO HB2  1 1 
       10 1127 1 1 5 PRO HB3  H 23.397 21.750 15.108 1.00 . A A . 6 PRO HB3  1 1 
       10 1128 1 1 5 PRO HD2  H 25.969 23.889 17.351 1.00 . A A . 6 PRO HD2  1 1 
       10 1129 1 1 5 PRO HD3  H 24.350 23.916 18.047 1.00 . A A . 6 PRO HD3  1 1 
       10 1130 1 1 5 PRO HG2  H 25.043 24.171 15.251 1.00 . A A . 6 PRO HG2  1 1 
       10 1131 1 1 5 PRO HG3  H 23.413 23.943 15.871 1.00 . A A . 6 PRO HG3  1 1 
       10 1132 1 1 5 PRO N    N 25.036 22.017 17.569 1.00 . A A . 6 PRO N    1 1 
       10 1133 1 1 5 PRO O    O 26.567 19.994 15.008 1.00 . A A . 6 PRO O    1 1 
       10 1134 1 1 6 TRP C    C 28.716 18.892 17.879 1.00 . A A . 7 TRP C    1 1 
       10 1135 1 1 6 TRP CA   C 28.585 20.032 16.863 1.00 . A A . 7 TRP CA   1 1 
       10 1136 1 1 6 TRP CB   C 29.656 21.109 17.158 1.00 . A A . 7 TRP CB   1 1 
       10 1137 1 1 6 TRP CD1  C 30.657 20.469 19.425 1.00 . A A . 7 TRP CD1  1 1 
       10 1138 1 1 6 TRP CD2  C 29.506 22.316 19.441 1.00 . A A . 7 TRP CD2  1 1 
       10 1139 1 1 6 TRP CE2  C 29.975 22.171 20.734 1.00 . A A . 7 TRP CE2  1 1 
       10 1140 1 1 6 TRP CE3  C 28.727 23.390 19.091 1.00 . A A . 7 TRP CE3  1 1 
       10 1141 1 1 6 TRP CG   C 29.920 21.306 18.667 1.00 . A A . 7 TRP CG   1 1 
       10 1142 1 1 6 TRP CH2  C 28.872 24.235 21.340 1.00 . A A . 7 TRP CH2  1 1 
       10 1143 1 1 6 TRP CZ2  C 29.658 23.140 21.691 1.00 . A A . 7 TRP CZ2  1 1 
       10 1144 1 1 6 TRP CZ3  C 28.401 24.360 20.036 1.00 . A A . 7 TRP CZ3  1 1 
       10 1145 1 1 6 TRP H    H 27.018 21.060 17.889 1.00 . A A . 7 TRP H    1 1 
       10 1146 1 1 6 TRP HA   H 28.695 19.636 15.863 1.00 . A A . 7 TRP HA   1 1 
       10 1147 1 1 6 TRP HB2  H 30.587 20.809 16.706 1.00 . A A . 7 TRP HB2  1 1 
       10 1148 1 1 6 TRP HB3  H 29.384 22.054 16.734 1.00 . A A . 7 TRP HB3  1 1 
       10 1149 1 1 6 TRP HD1  H 31.124 19.558 19.106 1.00 . A A . 7 TRP HD1  1 1 
       10 1150 1 1 6 TRP HE1  H 31.087 20.613 21.388 1.00 . A A . 7 TRP HE1  1 1 
       10 1151 1 1 6 TRP HE3  H 28.364 23.438 18.082 1.00 . A A . 7 TRP HE3  1 1 
       10 1152 1 1 6 TRP HH2  H 28.630 24.983 22.084 1.00 . A A . 7 TRP HH2  1 1 
       10 1153 1 1 6 TRP HZ2  H 30.020 23.039 22.707 1.00 . A A . 7 TRP HZ2  1 1 
       10 1154 1 1 6 TRP HZ3  H 27.785 25.203 19.761 1.00 . A A . 7 TRP HZ3  1 1 
       10 1155 1 1 6 TRP N    N 27.230 20.612 17.035 1.00 . A A . 7 TRP N    1 1 
       10 1156 1 1 6 TRP NE1  N 30.642 21.040 20.616 1.00 . A A . 7 TRP NE1  1 1 
       10 1157 1 1 6 TRP O    O 29.748 18.247 17.915 1.00 . A A . 7 TRP O    1 1 
       10 1158 1 1 7 .   C    C 28.479 16.424 19.434 1.00 . A A . 8 CY3 C    1 1 
       10 1159 1 1 7 .   CA   C 27.615 17.667 19.697 1.00 . A A . 8 CY3 CA   1 1 
       10 1160 1 1 7 .   CB   C 26.119 17.228 19.915 1.00 . A A . 8 CY3 CB   1 1 
       10 1161 1 1 7 .   H    H 26.876 19.254 18.505 1.00 . A A . 8 CY3 H    1 1 
       10 1162 1 1 7 .   HA   H 27.990 18.200 20.561 1.00 . A A . 8 CY3 HA   1 1 
       10 1163 1 1 7 .   HB2  H 25.795 17.628 20.860 1.00 . A A . 8 CY3 HB2  1 1 
       10 1164 1 1 7 .   HB3  H 26.093 16.147 20.008 1.00 . A A . 8 CY3 HB3  1 1 
       10 1165 1 1 7 .   HN11 H 29.934 17.028 20.628 1.00 . A A . 8 CY3 HN11 1 1 
       10 1166 1 1 7 .   HN12 H 30.182 15.529 19.867 1.00 . A A . 8 CY3 HN12 1 1 
       10 1167 1 1 7 .   N    N 27.671 18.703 18.641 1.00 . A A . 8 CY3 N    1 1 
       10 1168 1 1 7 .   N1   N 29.626 16.322 20.027 1.00 . A A . 8 CY3 N1   1 1 
       10 1169 1 1 7 .   O    O 28.136 15.527 18.693 1.00 . A A . 8 CY3 O    1 1 
       10 1170 1 1 7 .   SG   S 24.847 17.663 18.700 1.00 . A A . 8 CY3 SG   1 1 
       11 1171 1 1 1 CYS C    C 20.508 17.220 20.142 1.00 . A A . 2 CYS C    1 1 
       11 1172 1 1 1 CYS CA   C 21.770 17.987 19.650 1.00 . A A . 2 CYS CA   1 1 
       11 1173 1 1 1 CYS CB   C 22.709 17.034 18.902 1.00 . A A . 2 CYS CB   1 1 
       11 1174 1 1 1 CYS H1   H 22.924 18.010 21.456 1.00 . A A . 2 CYS H1   1 1 
       11 1175 1 1 1 CYS HA   H 21.495 18.745 18.939 1.00 . A A . 2 CYS HA   1 1 
       11 1176 1 1 1 CYS HB2  H 22.096 16.440 18.239 1.00 . A A . 2 CYS HB2  1 1 
       11 1177 1 1 1 CYS HB3  H 23.368 17.624 18.287 1.00 . A A . 2 CYS HB3  1 1 
       11 1178 1 1 1 CYS N    N 22.529 18.605 20.776 1.00 . A A . 2 CYS N    1 1 
       11 1179 1 1 1 CYS O    O 20.656 16.149 20.699 1.00 . A A . 2 CYS O    1 1 
       11 1180 1 1 1 CYS SG   S 23.744 15.890 19.847 1.00 . A A . 2 CYS SG   1 1 
       11 1181 1 1 2 HYP C    C 19.456 20.151 20.609 1.00 . A A . 3 HYP C    1 1 
       11 1182 1 1 2 HYP CA   C 19.078 19.154 19.497 1.00 . A A . 3 HYP CA   1 1 
       11 1183 1 1 2 HYP CB   C 17.576 19.198 19.128 1.00 . A A . 3 HYP CB   1 1 
       11 1184 1 1 2 HYP CD   C 18.078 16.981 20.164 1.00 . A A . 3 HYP CD   1 1 
       11 1185 1 1 2 HYP CG   C 17.059 17.733 19.274 1.00 . A A . 3 HYP CG   1 1 
       11 1186 1 1 2 HYP HA   H 19.670 19.358 18.620 1.00 . A A . 3 HYP HA   1 1 
       11 1187 1 1 2 HYP HB2  H 17.455 19.605 18.139 1.00 . A A . 3 HYP HB2  1 1 
       11 1188 1 1 2 HYP HB3  H 17.040 19.833 19.825 1.00 . A A . 3 HYP HB3  1 1 
       11 1189 1 1 2 HYP HD1  H 18.195 17.155 17.819 1.00 . A A . 3 HYP HD1  1 1 
       11 1190 1 1 2 HYP HD22 H 18.217 15.954 19.852 1.00 . A A . 3 HYP HD22 1 1 
       11 1191 1 1 2 HYP HD23 H 17.798 17.021 21.206 1.00 . A A . 3 HYP HD23 1 1 
       11 1192 1 1 2 HYP HG   H 16.028 17.655 19.601 1.00 . A A . 3 HYP HG   1 1 
       11 1193 1 1 2 HYP N    N 19.329 17.756 19.952 1.00 . A A . 3 HYP N    1 1 
       11 1194 1 1 2 HYP O    O 18.667 20.438 21.491 1.00 . A A . 3 HYP O    1 1 
       11 1195 1 1 2 HYP OD1  O 17.246 17.187 17.976 1.00 . A A . 3 HYP OD1  1 1 
       11 1196 1 1 3 DTR C    C 22.397 22.265 20.682 1.00 . A A . 4 DTR C    1 1 
       11 1197 1 1 3 DTR CA   C 21.294 21.584 21.481 1.00 . A A . 4 DTR CA   1 1 
       11 1198 1 1 3 DTR CB   C 20.286 22.687 21.979 1.00 . A A . 4 DTR CB   1 1 
       11 1199 1 1 3 DTR CD1  C 18.521 23.088 20.191 1.00 . A A . 4 DTR CD1  1 1 
       11 1200 1 1 3 DTR CD2  C 19.878 24.768 20.509 1.00 . A A . 4 DTR CD2  1 1 
       11 1201 1 1 3 DTR CE2  C 18.996 25.189 19.527 1.00 . A A . 4 DTR CE2  1 1 
       11 1202 1 1 3 DTR CE3  C 20.891 25.595 20.967 1.00 . A A . 4 DTR CE3  1 1 
       11 1203 1 1 3 DTR CG   C 19.580 23.515 20.897 1.00 . A A . 4 DTR CG   1 1 
       11 1204 1 1 3 DTR CH2  C 20.152 27.313 19.447 1.00 . A A . 4 DTR CH2  1 1 
       11 1205 1 1 3 DTR CZ2  C 19.137 26.470 18.992 1.00 . A A . 4 DTR CZ2  1 1 
       11 1206 1 1 3 DTR CZ3  C 21.034 26.875 20.433 1.00 . A A . 4 DTR CZ3  1 1 
       11 1207 1 1 3 DTR H    H 21.253 20.281 19.821 1.00 . A A . 4 DTR H    1 1 
       11 1208 1 1 3 DTR HA   H 21.679 21.096 22.347 1.00 . A A . 4 DTR HA   1 1 
       11 1209 1 1 3 DTR HB2  H 20.866 23.364 22.567 1.00 . A A . 4 DTR HB2  1 1 
       11 1210 1 1 3 DTR HB3  H 19.538 22.260 22.627 1.00 . A A . 4 DTR HB3  1 1 
       11 1211 1 1 3 DTR HD1  H 18.054 22.126 20.279 1.00 . A A . 4 DTR HD1  1 1 
       11 1212 1 1 3 DTR HE1  H 17.485 24.075 18.775 1.00 . A A . 4 DTR HE1  1 1 
       11 1213 1 1 3 DTR HE3  H 21.563 25.214 21.728 1.00 . A A . 4 DTR HE3  1 1 
       11 1214 1 1 3 DTR HH2  H 20.250 28.306 19.028 1.00 . A A . 4 DTR HH2  1 1 
       11 1215 1 1 3 DTR HZ2  H 18.454 26.817 18.229 1.00 . A A . 4 DTR HZ2  1 1 
       11 1216 1 1 3 DTR HZ3  H 21.821 27.528 20.781 1.00 . A A . 4 DTR HZ3  1 1 
       11 1217 1 1 3 DTR N    N 20.678 20.598 20.546 1.00 . A A . 4 DTR N    1 1 
       11 1218 1 1 3 DTR NE1  N 18.231 24.113 19.411 1.00 . A A . 4 DTR NE1  1 1 
       11 1219 1 1 3 DTR O    O 22.333 23.354 20.160 1.00 . A A . 4 DTR O    1 1 
       11 1220 1 1 4 GLN C    C 24.870 21.040 18.703 1.00 . A A . 5 GLN C    1 1 
       11 1221 1 1 4 GLN CA   C 24.662 21.974 19.868 1.00 . A A . 5 GLN CA   1 1 
       11 1222 1 1 4 GLN CB   C 25.924 21.904 20.712 1.00 . A A . 5 GLN CB   1 1 
       11 1223 1 1 4 GLN CD   C 24.781 22.999 22.699 1.00 . A A . 5 GLN CD   1 1 
       11 1224 1 1 4 GLN CG   C 25.955 23.030 21.716 1.00 . A A . 5 GLN CG   1 1 
       11 1225 1 1 4 GLN H    H 23.435 20.618 21.009 1.00 . A A . 5 GLN H    1 1 
       11 1226 1 1 4 GLN HA   H 24.518 22.991 19.548 1.00 . A A . 5 GLN HA   1 1 
       11 1227 1 1 4 GLN HB2  H 26.079 20.946 21.145 1.00 . A A . 5 GLN HB2  1 1 
       11 1228 1 1 4 GLN HB3  H 26.745 22.060 20.036 1.00 . A A . 5 GLN HB3  1 1 
       11 1229 1 1 4 GLN HE21 H 24.964 21.062 23.108 1.00 . A A . 5 GLN HE21 1 1 
       11 1230 1 1 4 GLN HE22 H 23.704 21.859 23.913 1.00 . A A . 5 GLN HE22 1 1 
       11 1231 1 1 4 GLN HG2  H 26.878 23.020 22.274 1.00 . A A . 5 GLN HG2  1 1 
       11 1232 1 1 4 GLN HG3  H 25.919 23.910 21.095 1.00 . A A . 5 GLN HG3  1 1 
       11 1233 1 1 4 GLN N    N 23.455 21.508 20.600 1.00 . A A . 5 GLN N    1 1 
       11 1234 1 1 4 GLN NE2  N 24.460 21.884 23.285 1.00 . A A . 5 GLN NE2  1 1 
       11 1235 1 1 4 GLN O    O 25.106 19.868 18.913 1.00 . A A . 5 GLN O    1 1 
       11 1236 1 1 4 GLN OE1  O 24.145 24.002 22.948 1.00 . A A . 5 GLN OE1  1 1 
       11 1237 1 1 5 PRO C    C 26.283 20.115 16.081 1.00 . A A . 6 PRO C    1 1 
       11 1238 1 1 5 PRO CA   C 24.856 20.620 16.337 1.00 . A A . 6 PRO CA   1 1 
       11 1239 1 1 5 PRO CB   C 24.236 21.450 15.205 1.00 . A A . 6 PRO CB   1 1 
       11 1240 1 1 5 PRO CD   C 24.678 22.963 17.152 1.00 . A A . 6 PRO CD   1 1 
       11 1241 1 1 5 PRO CG   C 24.257 22.950 15.660 1.00 . A A . 6 PRO CG   1 1 
       11 1242 1 1 5 PRO HA   H 24.265 19.748 16.581 1.00 . A A . 6 PRO HA   1 1 
       11 1243 1 1 5 PRO HB2  H 24.752 21.292 14.266 1.00 . A A . 6 PRO HB2  1 1 
       11 1244 1 1 5 PRO HB3  H 23.207 21.123 15.127 1.00 . A A . 6 PRO HB3  1 1 
       11 1245 1 1 5 PRO HD2  H 25.626 23.461 17.291 1.00 . A A . 6 PRO HD2  1 1 
       11 1246 1 1 5 PRO HD3  H 23.940 23.404 17.804 1.00 . A A . 6 PRO HD3  1 1 
       11 1247 1 1 5 PRO HG2  H 24.964 23.520 15.069 1.00 . A A . 6 PRO HG2  1 1 
       11 1248 1 1 5 PRO HG3  H 23.272 23.386 15.559 1.00 . A A . 6 PRO HG3  1 1 
       11 1249 1 1 5 PRO N    N 24.808 21.527 17.497 1.00 . A A . 6 PRO N    1 1 
       11 1250 1 1 5 PRO O    O 26.589 19.586 15.023 1.00 . A A . 6 PRO O    1 1 
       11 1251 1 1 6 TRP C    C 28.764 18.851 18.067 1.00 . A A . 7 TRP C    1 1 
       11 1252 1 1 6 TRP CA   C 28.536 19.847 16.934 1.00 . A A . 7 TRP CA   1 1 
       11 1253 1 1 6 TRP CB   C 29.482 21.051 17.077 1.00 . A A . 7 TRP CB   1 1 
       11 1254 1 1 6 TRP CD1  C 30.566 20.789 19.375 1.00 . A A . 7 TRP CD1  1 1 
       11 1255 1 1 6 TRP CD2  C 29.219 22.491 19.210 1.00 . A A . 7 TRP CD2  1 1 
       11 1256 1 1 6 TRP CE2  C 29.716 22.548 20.503 1.00 . A A . 7 TRP CE2  1 1 
       11 1257 1 1 6 TRP CE3  C 28.316 23.427 18.762 1.00 . A A . 7 TRP CE3  1 1 
       11 1258 1 1 6 TRP CG   C 29.732 21.447 18.544 1.00 . A A . 7 TRP CG   1 1 
       11 1259 1 1 6 TRP CH2  C 28.400 24.518 20.901 1.00 . A A . 7 TRP CH2  1 1 
       11 1260 1 1 6 TRP CZ2  C 29.310 23.567 21.349 1.00 . A A . 7 TRP CZ2  1 1 
       11 1261 1 1 6 TRP CZ3  C 27.900 24.445 19.604 1.00 . A A . 7 TRP CZ3  1 1 
       11 1262 1 1 6 TRP H    H 26.852 20.767 17.891 1.00 . A A . 7 TRP H    1 1 
       11 1263 1 1 6 TRP HA   H 28.696 19.348 15.995 1.00 . A A . 7 TRP HA   1 1 
       11 1264 1 1 6 TRP HB2  H 30.433 20.792 16.641 1.00 . A A . 7 TRP HB2  1 1 
       11 1265 1 1 6 TRP HB3  H 29.110 21.914 16.560 1.00 . A A . 7 TRP HB3  1 1 
       11 1266 1 1 6 TRP HD1  H 31.129 19.903 19.149 1.00 . A A . 7 TRP HD1  1 1 
       11 1267 1 1 6 TRP HE1  H 31.010 21.236 21.290 1.00 . A A . 7 TRP HE1  1 1 
       11 1268 1 1 6 TRP HE3  H 27.937 23.328 17.764 1.00 . A A . 7 TRP HE3  1 1 
       11 1269 1 1 6 TRP HH2  H 28.093 25.307 21.573 1.00 . A A . 7 TRP HH2  1 1 
       11 1270 1 1 6 TRP HZ2  H 29.705 23.609 22.354 1.00 . A A . 7 TRP HZ2  1 1 
       11 1271 1 1 6 TRP HZ3  H 27.180 25.173 19.273 1.00 . A A . 7 TRP HZ3  1 1 
       11 1272 1 1 6 TRP N    N 27.125 20.306 17.059 1.00 . A A . 7 TRP N    1 1 
       11 1273 1 1 6 TRP NE1  N 30.503 21.490 20.489 1.00 . A A . 7 TRP NE1  1 1 
       11 1274 1 1 6 TRP O    O 29.824 18.262 18.168 1.00 . A A . 7 TRP O    1 1 
       11 1275 1 1 7 .   C    C 28.703 16.564 19.923 1.00 . A A . 8 CY3 C    1 1 
       11 1276 1 1 7 .   CA   C 27.783 17.787 20.052 1.00 . A A . 8 CY3 CA   1 1 
       11 1277 1 1 7 .   CB   C 26.353 17.305 20.333 1.00 . A A . 8 CY3 CB   1 1 
       11 1278 1 1 7 .   H    H 26.924 19.190 18.694 1.00 . A A . 8 CY3 H    1 1 
       11 1279 1 1 7 .   HA   H 28.157 18.426 20.844 1.00 . A A . 8 CY3 HA   1 1 
       11 1280 1 1 7 .   HB2  H 25.703 18.148 20.490 1.00 . A A . 8 CY3 HB2  1 1 
       11 1281 1 1 7 .   HB3  H 26.382 16.759 21.258 1.00 . A A . 8 CY3 HB3  1 1 
       11 1282 1 1 7 .   HN11 H 27.911 16.039 18.184 1.00 . A A . 8 CY3 HN11 1 1 
       11 1283 1 1 7 .   HN12 H 29.167 15.055 18.730 1.00 . A A . 8 CY3 HN12 1 1 
       11 1284 1 1 7 .   N    N 27.752 18.696 18.873 1.00 . A A . 8 CY3 N    1 1 
       11 1285 1 1 7 .   N1   N 28.579 15.820 18.866 1.00 . A A . 8 CY3 N1   1 1 
       11 1286 1 1 7 .   O    O 29.536 16.282 20.767 1.00 . A A . 8 CY3 O    1 1 
       11 1287 1 1 7 .   SG   S 25.586 16.228 19.097 1.00 . A A . 8 CY3 SG   1 1 
       12 1288 1 1 1 CYS C    C 20.012 17.062 20.668 1.00 . A A . 2 CYS C    1 1 
       12 1289 1 1 1 CYS CA   C 21.471 17.581 20.727 1.00 . A A . 2 CYS CA   1 1 
       12 1290 1 1 1 CYS CB   C 22.330 17.043 19.537 1.00 . A A . 2 CYS CB   1 1 
       12 1291 1 1 1 CYS H1   H 21.542 16.667 22.667 1.00 . A A . 2 CYS H1   1 1 
       12 1292 1 1 1 CYS HA   H 21.467 18.654 20.754 1.00 . A A . 2 CYS HA   1 1 
       12 1293 1 1 1 CYS HB2  H 21.656 16.601 18.813 1.00 . A A . 2 CYS HB2  1 1 
       12 1294 1 1 1 CYS HB3  H 22.801 17.883 19.053 1.00 . A A . 2 CYS HB3  1 1 
       12 1295 1 1 1 CYS N    N 22.105 17.115 21.995 1.00 . A A . 2 CYS N    1 1 
       12 1296 1 1 1 CYS O    O 19.756 16.052 21.305 1.00 . A A . 2 CYS O    1 1 
       12 1297 1 1 1 CYS SG   S 23.630 15.820 19.867 1.00 . A A . 2 CYS SG   1 1 
       12 1298 1 1 2 HYP C    C 19.508 20.236 20.055 1.00 . A A . 3 HYP C    1 1 
       12 1299 1 1 2 HYP CA   C 19.303 18.975 19.184 1.00 . A A . 3 HYP CA   1 1 
       12 1300 1 1 2 HYP CB   C 18.047 19.117 18.290 1.00 . A A . 3 HYP CB   1 1 
       12 1301 1 1 2 HYP CD   C 17.714 17.169 19.838 1.00 . A A . 3 HYP CD   1 1 
       12 1302 1 1 2 HYP CG   C 16.974 18.184 18.911 1.00 . A A . 3 HYP CG   1 1 
       12 1303 1 1 2 HYP HA   H 20.168 18.851 18.551 1.00 . A A . 3 HYP HA   1 1 
       12 1304 1 1 2 HYP HB2  H 18.287 18.885 17.264 1.00 . A A . 3 HYP HB2  1 1 
       12 1305 1 1 2 HYP HB3  H 17.673 20.127 18.321 1.00 . A A . 3 HYP HB3  1 1 
       12 1306 1 1 2 HYP HD1  H 17.097 16.884 17.463 1.00 . A A . 3 HYP HD1  1 1 
       12 1307 1 1 2 HYP HD22 H 17.744 16.169 19.425 1.00 . A A . 3 HYP HD22 1 1 
       12 1308 1 1 2 HYP HD23 H 17.265 17.135 20.822 1.00 . A A . 3 HYP HD23 1 1 
       12 1309 1 1 2 HYP HG   H 16.209 18.734 19.447 1.00 . A A . 3 HYP HG   1 1 
       12 1310 1 1 2 HYP N    N 19.104 17.702 19.954 1.00 . A A . 3 HYP N    1 1 
       12 1311 1 1 2 HYP O    O 18.555 20.734 20.620 1.00 . A A . 3 HYP O    1 1 
       12 1312 1 1 2 HYP OD1  O 16.416 17.464 17.821 1.00 . A A . 3 HYP OD1  1 1 
       12 1313 1 1 3 DTR C    C 22.426 22.472 20.337 1.00 . A A . 4 DTR C    1 1 
       12 1314 1 1 3 DTR CA   C 21.132 21.908 20.950 1.00 . A A . 4 DTR CA   1 1 
       12 1315 1 1 3 DTR CB   C 20.050 23.044 20.893 1.00 . A A . 4 DTR CB   1 1 
       12 1316 1 1 3 DTR CD1  C 18.886 22.869 18.628 1.00 . A A . 4 DTR CD1  1 1 
       12 1317 1 1 3 DTR CD2  C 20.115 24.652 18.862 1.00 . A A . 4 DTR CD2  1 1 
       12 1318 1 1 3 DTR CE2  C 19.580 24.739 17.585 1.00 . A A . 4 DTR CE2  1 1 
       12 1319 1 1 3 DTR CE3  C 20.953 25.648 19.339 1.00 . A A . 4 DTR CE3  1 1 
       12 1320 1 1 3 DTR CG   C 19.692 23.526 19.474 1.00 . A A . 4 DTR CG   1 1 
       12 1321 1 1 3 DTR CH2  C 20.727 26.831 17.249 1.00 . A A . 4 DTR CH2  1 1 
       12 1322 1 1 3 DTR CZ2  C 19.884 25.827 16.773 1.00 . A A . 4 DTR CZ2  1 1 
       12 1323 1 1 3 DTR CZ3  C 21.261 26.744 18.536 1.00 . A A . 4 DTR CZ3  1 1 
       12 1324 1 1 3 DTR H    H 21.444 20.217 19.699 1.00 . A A . 4 DTR H    1 1 
       12 1325 1 1 3 DTR HA   H 21.270 21.686 21.982 1.00 . A A . 4 DTR HA   1 1 
       12 1326 1 1 3 DTR HB2  H 20.471 23.873 21.410 1.00 . A A . 4 DTR HB2  1 1 
       12 1327 1 1 3 DTR HB3  H 19.147 22.764 21.411 1.00 . A A . 4 DTR HB3  1 1 
       12 1328 1 1 3 DTR HD1  H 18.384 21.946 18.832 1.00 . A A . 4 DTR HD1  1 1 
       12 1329 1 1 3 DTR HE1  H 18.343 23.376 16.757 1.00 . A A . 4 DTR HE1  1 1 
       12 1330 1 1 3 DTR HE3  H 21.356 25.529 20.337 1.00 . A A . 4 DTR HE3  1 1 
       12 1331 1 1 3 DTR HH2  H 20.966 27.675 16.617 1.00 . A A . 4 DTR HH2  1 1 
       12 1332 1 1 3 DTR HZ2  H 19.465 25.881 15.779 1.00 . A A . 4 DTR HZ2  1 1 
       12 1333 1 1 3 DTR HZ3  H 21.915 27.519 18.911 1.00 . A A . 4 DTR HZ3  1 1 
       12 1334 1 1 3 DTR N    N 20.730 20.686 20.167 1.00 . A A . 4 DTR N    1 1 
       12 1335 1 1 3 DTR NE1  N 18.866 23.629 17.553 1.00 . A A . 4 DTR NE1  1 1 
       12 1336 1 1 3 DTR O    O 22.504 23.505 19.705 1.00 . A A . 4 DTR O    1 1 
       12 1337 1 1 4 GLN C    C 25.099 21.287 18.845 1.00 . A A . 5 GLN C    1 1 
       12 1338 1 1 4 GLN CA   C 24.792 22.218 19.996 1.00 . A A . 5 GLN CA   1 1 
       12 1339 1 1 4 GLN CB   C 25.922 22.104 20.988 1.00 . A A . 5 GLN CB   1 1 
       12 1340 1 1 4 GLN CD   C 24.683 23.534 22.749 1.00 . A A . 5 GLN CD   1 1 
       12 1341 1 1 4 GLN CG   C 25.958 23.305 21.921 1.00 . A A . 5 GLN CG   1 1 
       12 1342 1 1 4 GLN H    H 23.437 20.914 21.069 1.00 . A A . 5 GLN H    1 1 
       12 1343 1 1 4 GLN HA   H 24.719 23.243 19.686 1.00 . A A . 5 GLN HA   1 1 
       12 1344 1 1 4 GLN HB2  H 25.978 21.168 21.490 1.00 . A A . 5 GLN HB2  1 1 
       12 1345 1 1 4 GLN HB3  H 26.812 22.178 20.385 1.00 . A A . 5 GLN HB3  1 1 
       12 1346 1 1 4 GLN HE21 H 23.649 24.404 21.290 1.00 . A A . 5 GLN HE21 1 1 
       12 1347 1 1 4 GLN HE22 H 22.852 24.272 22.783 1.00 . A A . 5 GLN HE22 1 1 
       12 1348 1 1 4 GLN HG2  H 26.787 23.218 22.611 1.00 . A A . 5 GLN HG2  1 1 
       12 1349 1 1 4 GLN HG3  H 26.138 24.140 21.262 1.00 . A A . 5 GLN HG3  1 1 
       12 1350 1 1 4 GLN N    N 23.491 21.748 20.554 1.00 . A A . 5 GLN N    1 1 
       12 1351 1 1 4 GLN NE2  N 23.647 24.115 22.230 1.00 . A A . 5 GLN NE2  1 1 
       12 1352 1 1 4 GLN O    O 25.408 20.138 19.072 1.00 . A A . 5 GLN O    1 1 
       12 1353 1 1 4 GLN OE1  O 24.617 23.181 23.908 1.00 . A A . 5 GLN OE1  1 1 
       12 1354 1 1 5 PRO C    C 26.394 20.294 16.217 1.00 . A A . 6 PRO C    1 1 
       12 1355 1 1 5 PRO CA   C 25.004 20.876 16.469 1.00 . A A . 6 PRO CA   1 1 
       12 1356 1 1 5 PRO CB   C 24.479 21.747 15.327 1.00 . A A . 6 PRO CB   1 1 
       12 1357 1 1 5 PRO CD   C 24.947 23.214 17.302 1.00 . A A . 6 PRO CD   1 1 
       12 1358 1 1 5 PRO CG   C 24.524 23.233 15.819 1.00 . A A . 6 PRO CG   1 1 
       12 1359 1 1 5 PRO HA   H 24.335 20.049 16.672 1.00 . A A . 6 PRO HA   1 1 
       12 1360 1 1 5 PRO HB2  H 25.060 21.592 14.426 1.00 . A A . 6 PRO HB2  1 1 
       12 1361 1 1 5 PRO HB3  H 23.456 21.452 15.146 1.00 . A A . 6 PRO HB3  1 1 
       12 1362 1 1 5 PRO HD2  H 25.919 23.673 17.432 1.00 . A A . 6 PRO HD2  1 1 
       12 1363 1 1 5 PRO HD3  H 24.232 23.682 17.955 1.00 . A A . 6 PRO HD3  1 1 
       12 1364 1 1 5 PRO HG2  H 25.248 23.794 15.241 1.00 . A A . 6 PRO HG2  1 1 
       12 1365 1 1 5 PRO HG3  H 23.554 23.698 15.718 1.00 . A A . 6 PRO HG3  1 1 
       12 1366 1 1 5 PRO N    N 25.022 21.771 17.639 1.00 . A A . 6 PRO N    1 1 
       12 1367 1 1 5 PRO O    O 26.615 19.604 15.243 1.00 . A A . 6 PRO O    1 1 
       12 1368 1 1 6 TRP C    C 28.847 18.896 17.892 1.00 . A A . 7 TRP C    1 1 
       12 1369 1 1 6 TRP CA   C 28.683 20.063 16.942 1.00 . A A . 7 TRP CA   1 1 
       12 1370 1 1 6 TRP CB   C 29.708 21.151 17.301 1.00 . A A . 7 TRP CB   1 1 
       12 1371 1 1 6 TRP CD1  C 30.597 20.556 19.641 1.00 . A A . 7 TRP CD1  1 1 
       12 1372 1 1 6 TRP CD2  C 29.416 22.376 19.550 1.00 . A A . 7 TRP CD2  1 1 
       12 1373 1 1 6 TRP CE2  C 29.810 22.280 20.870 1.00 . A A . 7 TRP CE2  1 1 
       12 1374 1 1 6 TRP CE3  C 28.638 23.416 19.117 1.00 . A A . 7 TRP CE3  1 1 
       12 1375 1 1 6 TRP CG   C 29.886 21.359 18.822 1.00 . A A . 7 TRP CG   1 1 
       12 1376 1 1 6 TRP CH2  C 28.641 24.340 21.335 1.00 . A A . 7 TRP CH2  1 1 
       12 1377 1 1 6 TRP CZ2  C 29.422 23.273 21.769 1.00 . A A . 7 TRP CZ2  1 1 
       12 1378 1 1 6 TRP CZ3  C 28.246 24.412 20.002 1.00 . A A . 7 TRP CZ3  1 1 
       12 1379 1 1 6 TRP H    H 27.083 21.159 17.888 1.00 . A A . 7 TRP H    1 1 
       12 1380 1 1 6 TRP HA   H 28.828 19.714 15.931 1.00 . A A . 7 TRP HA   1 1 
       12 1381 1 1 6 TRP HB2  H 30.669 20.877 16.898 1.00 . A A . 7 TRP HB2  1 1 
       12 1382 1 1 6 TRP HB3  H 29.438 22.089 16.862 1.00 . A A . 7 TRP HB3  1 1 
       12 1383 1 1 6 TRP HD1  H 31.096 19.648 19.356 1.00 . A A . 7 TRP HD1  1 1 
       12 1384 1 1 6 TRP HE1  H 30.921 20.790 21.625 1.00 . A A . 7 TRP HE1  1 1 
       12 1385 1 1 6 TRP HE3  H 28.334 23.406 18.089 1.00 . A A . 7 TRP HE3  1 1 
       12 1386 1 1 6 TRP HH2  H 28.347 25.112 22.034 1.00 . A A . 7 TRP HH2  1 1 
       12 1387 1 1 6 TRP HZ2  H 29.724 23.215 22.807 1.00 . A A . 7 TRP HZ2  1 1 
       12 1388 1 1 6 TRP HZ3  H 27.628 25.229 19.662 1.00 . A A . 7 TRP HZ3  1 1 
       12 1389 1 1 6 TRP N    N 27.301 20.593 17.109 1.00 . A A . 7 TRP N    1 1 
       12 1390 1 1 6 TRP NE1  N 30.506 21.158 20.817 1.00 . A A . 7 TRP NE1  1 1 
       12 1391 1 1 6 TRP O    O 29.878 18.246 17.867 1.00 . A A . 7 TRP O    1 1 
       12 1392 1 1 7 .   C    C 28.582 16.358 19.256 1.00 . A A . 8 CY3 C    1 1 
       12 1393 1 1 7 .   CA   C 27.806 17.617 19.691 1.00 . A A . 8 CY3 CA   1 1 
       12 1394 1 1 7 .   CB   C 26.310 17.241 20.026 1.00 . A A . 8 CY3 CB   1 1 
       12 1395 1 1 7 .   H    H 27.039 19.273 18.610 1.00 . A A . 8 CY3 H    1 1 
       12 1396 1 1 7 .   HA   H 28.287 18.102 20.528 1.00 . A A . 8 CY3 HA   1 1 
       12 1397 1 1 7 .   HB2  H 25.801 18.142 20.339 1.00 . A A . 8 CY3 HB2  1 1 
       12 1398 1 1 7 .   HB3  H 26.339 16.594 20.893 1.00 . A A . 8 CY3 HB3  1 1 
       12 1399 1 1 7 .   HN11 H 29.708 16.291 20.878 1.00 . A A . 8 CY3 HN11 1 1 
       12 1400 1 1 7 .   HN12 H 30.006 15.076 19.744 1.00 . A A . 8 CY3 HN12 1 1 
       12 1401 1 1 7 .   N    N 27.825 18.697 18.683 1.00 . A A . 8 CY3 N    1 1 
       12 1402 1 1 7 .   N1   N 29.503 15.868 20.022 1.00 . A A . 8 CY3 N1   1 1 
       12 1403 1 1 7 .   O    O 28.361 15.798 18.196 1.00 . A A . 8 CY3 O    1 1 
       12 1404 1 1 7 .   SG   S 25.245 16.422 18.808 1.00 . A A . 8 CY3 SG   1 1 
       13 1405 1 1 1 CYS C    C 19.784 16.982 20.657 1.00 . A A . 2 CYS C    1 1 
       13 1406 1 1 1 CYS CA   C 21.180 17.431 21.153 1.00 . A A . 2 CYS CA   1 1 
       13 1407 1 1 1 CYS CB   C 22.274 17.124 20.106 1.00 . A A . 2 CYS CB   1 1 
       13 1408 1 1 1 CYS H1   H 21.133 15.749 22.452 1.00 . A A . 2 CYS H1   1 1 
       13 1409 1 1 1 CYS HA   H 21.152 18.479 21.404 1.00 . A A . 2 CYS HA   1 1 
       13 1410 1 1 1 CYS HB2  H 22.951 16.393 20.529 1.00 . A A . 2 CYS HB2  1 1 
       13 1411 1 1 1 CYS HB3  H 21.800 16.671 19.246 1.00 . A A . 2 CYS HB3  1 1 
       13 1412 1 1 1 CYS N    N 21.498 16.664 22.392 1.00 . A A . 2 CYS N    1 1 
       13 1413 1 1 1 CYS O    O 19.269 16.026 21.214 1.00 . A A . 2 CYS O    1 1 
       13 1414 1 1 1 CYS SG   S 23.286 18.490 19.494 1.00 . A A . 2 CYS SG   1 1 
       13 1415 1 1 2 HYP C    C 19.886 20.033 19.949 1.00 . A A . 3 HYP C    1 1 
       13 1416 1 1 2 HYP CA   C 19.780 18.837 18.969 1.00 . A A . 3 HYP CA   1 1 
       13 1417 1 1 2 HYP CB   C 18.817 19.118 17.785 1.00 . A A . 3 HYP CB   1 1 
       13 1418 1 1 2 HYP CD   C 17.900 17.191 19.123 1.00 . A A . 3 HYP CD   1 1 
       13 1419 1 1 2 HYP CG   C 17.643 18.112 17.895 1.00 . A A . 3 HYP CG   1 1 
       13 1420 1 1 2 HYP HA   H 20.760 18.594 18.576 1.00 . A A . 3 HYP HA   1 1 
       13 1421 1 1 2 HYP HB2  H 19.344 19.060 16.845 1.00 . A A . 3 HYP HB2  1 1 
       13 1422 1 1 2 HYP HB3  H 18.411 20.111 17.868 1.00 . A A . 3 HYP HB3  1 1 
       13 1423 1 1 2 HYP HD1  H 16.936 16.754 16.700 1.00 . A A . 3 HYP HD1  1 1 
       13 1424 1 1 2 HYP HD22 H 17.942 16.139 18.873 1.00 . A A . 3 HYP HD22 1 1 
       13 1425 1 1 2 HYP HD23 H 17.147 17.340 19.884 1.00 . A A . 3 HYP HD23 1 1 
       13 1426 1 1 2 HYP HG   H 16.679 18.601 17.964 1.00 . A A . 3 HYP HG   1 1 
       13 1427 1 1 2 HYP N    N 19.216 17.630 19.662 1.00 . A A . 3 HYP N    1 1 
       13 1428 1 1 2 HYP O    O 18.876 20.412 20.500 1.00 . A A . 3 HYP O    1 1 
       13 1429 1 1 2 HYP OD1  O 17.725 17.310 16.726 1.00 . A A . 3 HYP OD1  1 1 
       13 1430 1 1 3 DTR C    C 22.624 22.465 20.538 1.00 . A A . 4 DTR C    1 1 
       13 1431 1 1 3 DTR CA   C 21.366 21.735 21.059 1.00 . A A . 4 DTR CA   1 1 
       13 1432 1 1 3 DTR CB   C 20.176 22.775 21.099 1.00 . A A . 4 DTR CB   1 1 
       13 1433 1 1 3 DTR CD1  C 19.232 22.824 18.734 1.00 . A A . 4 DTR CD1  1 1 
       13 1434 1 1 3 DTR CD2  C 20.195 24.674 19.361 1.00 . A A . 4 DTR CD2  1 1 
       13 1435 1 1 3 DTR CE2  C 19.762 24.901 18.061 1.00 . A A . 4 DTR CE2  1 1 
       13 1436 1 1 3 DTR CE3  C 20.857 25.664 20.077 1.00 . A A . 4 DTR CE3  1 1 
       13 1437 1 1 3 DTR CG   C 19.869 23.428 19.743 1.00 . A A . 4 DTR CG   1 1 
       13 1438 1 1 3 DTR CH2  C 20.667 27.140 18.189 1.00 . A A . 4 DTR CH2  1 1 
       13 1439 1 1 3 DTR CZ2  C 20.001 26.140 17.477 1.00 . A A . 4 DTR CZ2  1 1 
       13 1440 1 1 3 DTR CZ3  C 21.093 26.903 19.496 1.00 . A A . 4 DTR CZ3  1 1 
       13 1441 1 1 3 DTR H    H 21.834 20.177 19.672 1.00 . A A . 4 DTR H    1 1 
       13 1442 1 1 3 DTR HA   H 21.522 21.399 22.056 1.00 . A A . 4 DTR HA   1 1 
       13 1443 1 1 3 DTR HB2  H 20.511 23.538 21.764 1.00 . A A . 4 DTR HB2  1 1 
       13 1444 1 1 3 DTR HB3  H 19.273 22.349 21.514 1.00 . A A . 4 DTR HB3  1 1 
       13 1445 1 1 3 DTR HD1  H 18.852 21.827 18.756 1.00 . A A . 4 DTR HD1  1 1 
       13 1446 1 1 3 DTR HE1  H 18.784 23.551 16.913 1.00 . A A . 4 DTR HE1  1 1 
       13 1447 1 1 3 DTR HE3  H 21.177 25.438 21.085 1.00 . A A . 4 DTR HE3  1 1 
       13 1448 1 1 3 DTR HH2  H 20.846 28.107 17.737 1.00 . A A . 4 DTR HH2  1 1 
       13 1449 1 1 3 DTR HZ2  H 19.689 26.342 16.466 1.00 . A A . 4 DTR HZ2  1 1 
       13 1450 1 1 3 DTR HZ3  H 21.608 27.669 20.063 1.00 . A A . 4 DTR HZ3  1 1 
       13 1451 1 1 3 DTR N    N 21.074 20.560 20.151 1.00 . A A . 4 DTR N    1 1 
       13 1452 1 1 3 DTR NE1  N 19.202 23.737 17.786 1.00 . A A . 4 DTR NE1  1 1 
       13 1453 1 1 3 DTR O    O 22.648 23.639 20.244 1.00 . A A . 4 DTR O    1 1 
       13 1454 1 1 4 GLN C    C 25.176 21.518 18.719 1.00 . A A . 5 GLN C    1 1 
       13 1455 1 1 4 GLN CA   C 24.961 22.368 19.930 1.00 . A A . 5 GLN CA   1 1 
       13 1456 1 1 4 GLN CB   C 26.189 22.168 20.811 1.00 . A A . 5 GLN CB   1 1 
       13 1457 1 1 4 GLN CD   C 25.157 23.362 22.784 1.00 . A A . 5 GLN CD   1 1 
       13 1458 1 1 4 GLN CG   C 26.324 23.302 21.787 1.00 . A A . 5 GLN CG   1 1 
       13 1459 1 1 4 GLN H    H 23.702 20.795 20.683 1.00 . A A . 5 GLN H    1 1 
       13 1460 1 1 4 GLN HA   H 24.807 23.402 19.687 1.00 . A A . 5 GLN HA   1 1 
       13 1461 1 1 4 GLN HB2  H 26.259 21.208 21.262 1.00 . A A . 5 GLN HB2  1 1 
       13 1462 1 1 4 GLN HB3  H 27.039 22.249 20.159 1.00 . A A . 5 GLN HB3  1 1 
       13 1463 1 1 4 GLN HE21 H 23.975 24.475 21.635 1.00 . A A . 5 GLN HE21 1 1 
       13 1464 1 1 4 GLN HE22 H 23.356 24.069 23.163 1.00 . A A . 5 GLN HE22 1 1 
       13 1465 1 1 4 GLN HG2  H 27.241 23.218 22.351 1.00 . A A . 5 GLN HG2  1 1 
       13 1466 1 1 4 GLN HG3  H 26.380 24.176 21.150 1.00 . A A . 5 GLN HG3  1 1 
       13 1467 1 1 4 GLN N    N 23.704 21.744 20.438 1.00 . A A . 5 GLN N    1 1 
       13 1468 1 1 4 GLN NE2  N 24.081 24.023 22.501 1.00 . A A . 5 GLN NE2  1 1 
       13 1469 1 1 4 GLN O    O 25.436 20.353 18.895 1.00 . A A . 5 GLN O    1 1 
       13 1470 1 1 4 GLN OE1  O 25.211 22.796 23.858 1.00 . A A . 5 GLN OE1  1 1 
       13 1471 1 1 5 PRO C    C 26.275 20.398 16.080 1.00 . A A . 6 PRO C    1 1 
       13 1472 1 1 5 PRO CA   C 24.962 21.131 16.366 1.00 . A A . 6 PRO CA   1 1 
       13 1473 1 1 5 PRO CB   C 24.476 22.057 15.234 1.00 . A A . 6 PRO CB   1 1 
       13 1474 1 1 5 PRO CD   C 25.092 23.478 17.217 1.00 . A A . 6 PRO CD   1 1 
       13 1475 1 1 5 PRO CG   C 24.575 23.538 15.760 1.00 . A A . 6 PRO CG   1 1 
       13 1476 1 1 5 PRO HA   H 24.241 20.366 16.619 1.00 . A A . 6 PRO HA   1 1 
       13 1477 1 1 5 PRO HB2  H 25.051 21.902 14.332 1.00 . A A . 6 PRO HB2  1 1 
       13 1478 1 1 5 PRO HB3  H 23.437 21.801 15.061 1.00 . A A . 6 PRO HB3  1 1 
       13 1479 1 1 5 PRO HD2  H 26.096 23.870 17.300 1.00 . A A . 6 PRO HD2  1 1 
       13 1480 1 1 5 PRO HD3  H 24.462 23.983 17.931 1.00 . A A . 6 PRO HD3  1 1 
       13 1481 1 1 5 PRO HG2  H 25.252 24.129 15.163 1.00 . A A . 6 PRO HG2  1 1 
       13 1482 1 1 5 PRO HG3  H 23.602 24.012 15.752 1.00 . A A . 6 PRO HG3  1 1 
       13 1483 1 1 5 PRO N    N 25.086 22.028 17.529 1.00 . A A . 6 PRO N    1 1 
       13 1484 1 1 5 PRO O    O 26.383 19.682 15.099 1.00 . A A . 6 PRO O    1 1 
       13 1485 1 1 6 TRP C    C 28.691 18.873 17.879 1.00 . A A . 7 TRP C    1 1 
       13 1486 1 1 6 TRP CA   C 28.566 19.955 16.809 1.00 . A A . 7 TRP CA   1 1 
       13 1487 1 1 6 TRP CB   C 29.638 21.028 17.007 1.00 . A A . 7 TRP CB   1 1 
       13 1488 1 1 6 TRP CD1  C 30.703 20.616 19.292 1.00 . A A . 7 TRP CD1  1 1 
       13 1489 1 1 6 TRP CD2  C 29.513 22.434 19.186 1.00 . A A . 7 TRP CD2  1 1 
       13 1490 1 1 6 TRP CE2  C 30.026 22.420 20.463 1.00 . A A . 7 TRP CE2  1 1 
       13 1491 1 1 6 TRP CE3  C 28.697 23.455 18.776 1.00 . A A . 7 TRP CE3  1 1 
       13 1492 1 1 6 TRP CG   C 29.922 21.364 18.490 1.00 . A A . 7 TRP CG   1 1 
       13 1493 1 1 6 TRP CH2  C 28.907 24.492 20.925 1.00 . A A . 7 TRP CH2  1 1 
       13 1494 1 1 6 TRP CZ2  C 29.731 23.454 21.341 1.00 . A A . 7 TRP CZ2  1 1 
       13 1495 1 1 6 TRP CZ3  C 28.381 24.497 19.637 1.00 . A A . 7 TRP CZ3  1 1 
       13 1496 1 1 6 TRP H    H 27.087 21.197 17.737 1.00 . A A . 7 TRP H    1 1 
       13 1497 1 1 6 TRP HA   H 28.645 19.500 15.834 1.00 . A A . 7 TRP HA   1 1 
       13 1498 1 1 6 TRP HB2  H 30.558 20.699 16.556 1.00 . A A . 7 TRP HB2  1 1 
       13 1499 1 1 6 TRP HB3  H 29.369 21.939 16.512 1.00 . A A . 7 TRP HB3  1 1 
       13 1500 1 1 6 TRP HD1  H 31.172 19.683 19.035 1.00 . A A . 7 TRP HD1  1 1 
       13 1501 1 1 6 TRP HE1  H 31.216 21.003 21.214 1.00 . A A . 7 TRP HE1  1 1 
       13 1502 1 1 6 TRP HE3  H 28.303 23.411 17.784 1.00 . A A . 7 TRP HE3  1 1 
       13 1503 1 1 6 TRP HH2  H 28.679 25.302 21.599 1.00 . A A . 7 TRP HH2  1 1 
       13 1504 1 1 6 TRP HZ2  H 30.135 23.467 22.345 1.00 . A A . 7 TRP HZ2  1 1 
       13 1505 1 1 6 TRP HZ3  H 27.719 25.293 19.313 1.00 . A A . 7 TRP HZ3  1 1 
       13 1506 1 1 6 TRP N    N 27.230 20.605 16.956 1.00 . A A . 7 TRP N    1 1 
       13 1507 1 1 6 TRP NE1  N 30.716 21.299 20.423 1.00 . A A . 7 TRP NE1  1 1 
       13 1508 1 1 6 TRP O    O 29.671 18.156 17.915 1.00 . A A . 7 TRP O    1 1 
       13 1509 1 1 7 .   C    C 28.314 16.529 19.575 1.00 . A A . 8 CY3 C    1 1 
       13 1510 1 1 7 .   CA   C 27.587 17.852 19.822 1.00 . A A . 8 CY3 CA   1 1 
       13 1511 1 1 7 .   CB   C 26.089 17.572 20.123 1.00 . A A . 8 CY3 CB   1 1 
       13 1512 1 1 7 .   H    H 26.931 19.430 18.552 1.00 . A A . 8 CY3 H    1 1 
       13 1513 1 1 7 .   HA   H 28.070 18.385 20.631 1.00 . A A . 8 CY3 HA   1 1 
       13 1514 1 1 7 .   HB2  H 25.748 18.334 20.817 1.00 . A A . 8 CY3 HB2  1 1 
       13 1515 1 1 7 .   HB3  H 26.007 16.627 20.632 1.00 . A A . 8 CY3 HB3  1 1 
       13 1516 1 1 7 .   HN11 H 27.038 16.047 18.166 1.00 . A A . 8 CY3 HN11 1 1 
       13 1517 1 1 7 .   HN12 H 28.254 14.892 18.466 1.00 . A A . 8 CY3 HN12 1 1 
       13 1518 1 1 7 .   N    N 27.676 18.817 18.696 1.00 . A A . 8 CY3 N    1 1 
       13 1519 1 1 7 .   N1   N 27.834 15.750 18.658 1.00 . A A . 8 CY3 N1   1 1 
       13 1520 1 1 7 .   O    O 29.306 16.188 20.197 1.00 . A A . 8 CY3 O    1 1 
       13 1521 1 1 7 .   SG   S 24.916 17.559 18.743 1.00 . A A . 8 CY3 SG   1 1 
       14 1522 1 1 1 CYS C    C 20.177 17.138 20.404 1.00 . A A . 2 CYS C    1 1 
       14 1523 1 1 1 CYS CA   C 21.597 17.694 20.091 1.00 . A A . 2 CYS CA   1 1 
       14 1524 1 1 1 CYS CB   C 22.454 16.641 19.331 1.00 . A A . 2 CYS CB   1 1 
       14 1525 1 1 1 CYS H1   H 22.162 17.462 22.130 1.00 . A A . 2 CYS H1   1 1 
       14 1526 1 1 1 CYS HA   H 21.533 18.558 19.469 1.00 . A A . 2 CYS HA   1 1 
       14 1527 1 1 1 CYS HB2  H 21.769 15.931 18.893 1.00 . A A . 2 CYS HB2  1 1 
       14 1528 1 1 1 CYS HB3  H 22.933 17.153 18.507 1.00 . A A . 2 CYS HB3  1 1 
       14 1529 1 1 1 CYS N    N 22.305 18.048 21.354 1.00 . A A . 2 CYS N    1 1 
       14 1530 1 1 1 CYS O    O 20.088 16.122 21.071 1.00 . A A . 2 CYS O    1 1 
       14 1531 1 1 1 CYS SG   S 23.750 15.705 20.185 1.00 . A A . 2 CYS SG   1 1 
       14 1532 1 1 2 HYP C    C 19.498 20.180 20.433 1.00 . A A . 3 HYP C    1 1 
       14 1533 1 1 2 HYP CA   C 19.115 19.151 19.357 1.00 . A A . 3 HYP CA   1 1 
       14 1534 1 1 2 HYP CB   C 17.688 19.397 18.821 1.00 . A A . 3 HYP CB   1 1 
       14 1535 1 1 2 HYP CD   C 17.756 17.183 20.027 1.00 . A A . 3 HYP CD   1 1 
       14 1536 1 1 2 HYP CG   C 16.812 18.242 19.362 1.00 . A A . 3 HYP CG   1 1 
       14 1537 1 1 2 HYP HA   H 19.835 19.193 18.555 1.00 . A A . 3 HYP HA   1 1 
       14 1538 1 1 2 HYP HB2  H 17.701 19.479 17.747 1.00 . A A . 3 HYP HB2  1 1 
       14 1539 1 1 2 HYP HB3  H 17.306 20.324 19.222 1.00 . A A . 3 HYP HB3  1 1 
       14 1540 1 1 2 HYP HD1  H 16.856 17.066 17.820 1.00 . A A . 3 HYP HD1  1 1 
       14 1541 1 1 2 HYP HD22 H 17.764 16.236 19.506 1.00 . A A . 3 HYP HD22 1 1 
       14 1542 1 1 2 HYP HD23 H 17.505 17.013 21.067 1.00 . A A . 3 HYP HD23 1 1 
       14 1543 1 1 2 HYP HG   H 16.082 18.621 20.068 1.00 . A A . 3 HYP HG   1 1 
       14 1544 1 1 2 HYP N    N 19.113 17.787 19.961 1.00 . A A . 3 HYP N    1 1 
       14 1545 1 1 2 HYP O    O 18.685 20.511 21.270 1.00 . A A . 3 HYP O    1 1 
       14 1546 1 1 2 HYP OD1  O 16.197 17.636 18.229 1.00 . A A . 3 HYP OD1  1 1 
       14 1547 1 1 3 DTR C    C 22.440 22.288 20.562 1.00 . A A . 4 DTR C    1 1 
       14 1548 1 1 3 DTR CA   C 21.297 21.629 21.335 1.00 . A A . 4 DTR CA   1 1 
       14 1549 1 1 3 DTR CB   C 20.268 22.746 21.758 1.00 . A A . 4 DTR CB   1 1 
       14 1550 1 1 3 DTR CD1  C 18.503 23.053 19.935 1.00 . A A . 4 DTR CD1  1 1 
       14 1551 1 1 3 DTR CD2  C 19.854 24.741 20.180 1.00 . A A . 4 DTR CD2  1 1 
       14 1552 1 1 3 DTR CE2  C 18.979 25.116 19.171 1.00 . A A . 4 DTR CE2  1 1 
       14 1553 1 1 3 DTR CE3  C 20.862 25.589 20.607 1.00 . A A . 4 DTR CE3  1 1 
       14 1554 1 1 3 DTR CG   C 19.560 23.515 20.627 1.00 . A A . 4 DTR CG   1 1 
       14 1555 1 1 3 DTR CH2  C 20.129 27.236 19.005 1.00 . A A . 4 DTR CH2  1 1 
       14 1556 1 1 3 DTR CZ2  C 19.116 26.371 18.576 1.00 . A A . 4 DTR CZ2  1 1 
       14 1557 1 1 3 DTR CZ3  C 21.005 26.845 20.022 1.00 . A A . 4 DTR CZ3  1 1 
       14 1558 1 1 3 DTR H    H 21.316 20.283 19.699 1.00 . A A . 4 DTR H    1 1 
       14 1559 1 1 3 DTR HA   H 21.635 21.170 22.231 1.00 . A A . 4 DTR HA   1 1 
       14 1560 1 1 3 DTR HB2  H 20.821 23.456 22.328 1.00 . A A . 4 DTR HB2  1 1 
       14 1561 1 1 3 DTR HB3  H 19.516 22.321 22.405 1.00 . A A . 4 DTR HB3  1 1 
       14 1562 1 1 3 DTR HD1  H 18.046 22.094 20.068 1.00 . A A . 4 DTR HD1  1 1 
       14 1563 1 1 3 DTR HE1  H 17.467 23.980 18.456 1.00 . A A . 4 DTR HE1  1 1 
       14 1564 1 1 3 DTR HE3  H 21.534 25.240 21.382 1.00 . A A . 4 DTR HE3  1 1 
       14 1565 1 1 3 DTR HH2  H 20.230 28.208 18.546 1.00 . A A . 4 DTR HH2  1 1 
       14 1566 1 1 3 DTR HZ2  H 18.439 26.676 17.784 1.00 . A A . 4 DTR HZ2  1 1 
       14 1567 1 1 3 DTR HZ3  H 21.785 27.518 20.354 1.00 . A A . 4 DTR HZ3  1 1 
       14 1568 1 1 3 DTR N    N 20.722 20.617 20.396 1.00 . A A . 4 DTR N    1 1 
       14 1569 1 1 3 DTR NE1  N 18.214 24.038 19.100 1.00 . A A . 4 DTR NE1  1 1 
       14 1570 1 1 3 DTR O    O 22.398 23.362 19.998 1.00 . A A . 4 DTR O    1 1 
       14 1571 1 1 4 GLN C    C 24.937 21.081 18.670 1.00 . A A . 5 GLN C    1 1 
       14 1572 1 1 4 GLN CA   C 24.744 21.963 19.875 1.00 . A A . 5 GLN CA   1 1 
       14 1573 1 1 4 GLN CB   C 25.985 21.795 20.738 1.00 . A A . 5 GLN CB   1 1 
       14 1574 1 1 4 GLN CD   C 24.872 22.592 22.853 1.00 . A A . 5 GLN CD   1 1 
       14 1575 1 1 4 GLN CG   C 26.002 22.803 21.845 1.00 . A A . 5 GLN CG   1 1 
       14 1576 1 1 4 GLN H    H 23.469 20.660 21.019 1.00 . A A . 5 GLN H    1 1 
       14 1577 1 1 4 GLN HA   H 24.657 22.999 19.605 1.00 . A A . 5 GLN HA   1 1 
       14 1578 1 1 4 GLN HB2  H 26.121 20.799 21.084 1.00 . A A . 5 GLN HB2  1 1 
       14 1579 1 1 4 GLN HB3  H 26.808 22.008 20.084 1.00 . A A . 5 GLN HB3  1 1 
       14 1580 1 1 4 GLN HE21 H 25.384 20.708 23.246 1.00 . A A . 5 GLN HE21 1 1 
       14 1581 1 1 4 GLN HE22 H 24.030 21.286 24.079 1.00 . A A . 5 GLN HE22 1 1 
       14 1582 1 1 4 GLN HG2  H 26.942 22.780 22.375 1.00 . A A . 5 GLN HG2  1 1 
       14 1583 1 1 4 GLN HG3  H 25.897 23.742 21.331 1.00 . A A . 5 GLN HG3  1 1 
       14 1584 1 1 4 GLN N    N 23.500 21.528 20.563 1.00 . A A . 5 GLN N    1 1 
       14 1585 1 1 4 GLN NE2  N 24.755 21.437 23.434 1.00 . A A . 5 GLN NE2  1 1 
       14 1586 1 1 4 GLN O    O 25.138 19.894 18.831 1.00 . A A . 5 GLN O    1 1 
       14 1587 1 1 4 GLN OE1  O 24.083 23.479 23.119 1.00 . A A . 5 GLN OE1  1 1 
       14 1588 1 1 5 PRO C    C 26.402 20.284 16.049 1.00 . A A . 6 PRO C    1 1 
       14 1589 1 1 5 PRO CA   C 24.966 20.765 16.294 1.00 . A A . 6 PRO CA   1 1 
       14 1590 1 1 5 PRO CB   C 24.370 21.647 15.187 1.00 . A A . 6 PRO CB   1 1 
       14 1591 1 1 5 PRO CD   C 24.783 23.069 17.212 1.00 . A A . 6 PRO CD   1 1 
       14 1592 1 1 5 PRO CG   C 24.390 23.127 15.713 1.00 . A A . 6 PRO CG   1 1 
       14 1593 1 1 5 PRO HA   H 24.373 19.881 16.483 1.00 . A A . 6 PRO HA   1 1 
       14 1594 1 1 5 PRO HB2  H 24.900 21.528 14.251 1.00 . A A . 6 PRO HB2  1 1 
       14 1595 1 1 5 PRO HB3  H 23.340 21.328 15.077 1.00 . A A . 6 PRO HB3  1 1 
       14 1596 1 1 5 PRO HD2  H 25.735 23.554 17.386 1.00 . A A . 6 PRO HD2  1 1 
       14 1597 1 1 5 PRO HD3  H 24.038 23.478 17.880 1.00 . A A . 6 PRO HD3  1 1 
       14 1598 1 1 5 PRO HG2  H 25.101 23.717 15.156 1.00 . A A . 6 PRO HG2  1 1 
       14 1599 1 1 5 PRO HG3  H 23.411 23.572 15.608 1.00 . A A . 6 PRO HG3  1 1 
       14 1600 1 1 5 PRO N    N 24.899 21.618 17.491 1.00 . A A . 6 PRO N    1 1 
       14 1601 1 1 5 PRO O    O 26.750 19.814 14.981 1.00 . A A . 6 PRO O    1 1 
       14 1602 1 1 6 TRP C    C 28.835 18.931 18.042 1.00 . A A . 7 TRP C    1 1 
       14 1603 1 1 6 TRP CA   C 28.630 19.996 16.964 1.00 . A A . 7 TRP CA   1 1 
       14 1604 1 1 6 TRP CB   C 29.549 21.208 17.210 1.00 . A A . 7 TRP CB   1 1 
       14 1605 1 1 6 TRP CD1  C 30.600 20.861 19.504 1.00 . A A . 7 TRP CD1  1 1 
       14 1606 1 1 6 TRP CD2  C 29.222 22.535 19.399 1.00 . A A . 7 TRP CD2  1 1 
       14 1607 1 1 6 TRP CE2  C 29.703 22.543 20.699 1.00 . A A . 7 TRP CE2  1 1 
       14 1608 1 1 6 TRP CE3  C 28.312 23.473 18.985 1.00 . A A . 7 TRP CE3  1 1 
       14 1609 1 1 6 TRP CG   C 29.765 21.535 18.696 1.00 . A A . 7 TRP CG   1 1 
       14 1610 1 1 6 TRP CH2  C 28.352 24.479 21.173 1.00 . A A . 7 TRP CH2  1 1 
       14 1611 1 1 6 TRP CZ2  C 29.272 23.519 21.587 1.00 . A A . 7 TRP CZ2  1 1 
       14 1612 1 1 6 TRP CZ3  C 27.868 24.454 19.869 1.00 . A A . 7 TRP CZ3  1 1 
       14 1613 1 1 6 TRP H    H 26.915 20.848 17.905 1.00 . A A . 7 TRP H    1 1 
       14 1614 1 1 6 TRP HA   H 28.834 19.555 15.998 1.00 . A A . 7 TRP HA   1 1 
       14 1615 1 1 6 TRP HB2  H 30.517 20.996 16.789 1.00 . A A . 7 TRP HB2  1 1 
       14 1616 1 1 6 TRP HB3  H 29.167 22.089 16.717 1.00 . A A . 7 TRP HB3  1 1 
       14 1617 1 1 6 TRP HD1  H 31.173 19.997 19.243 1.00 . A A . 7 TRP HD1  1 1 
       14 1618 1 1 6 TRP HE1  H 31.026 21.206 21.440 1.00 . A A . 7 TRP HE1  1 1 
       14 1619 1 1 6 TRP HE3  H 27.948 23.400 17.979 1.00 . A A . 7 TRP HE3  1 1 
       14 1620 1 1 6 TRP HH2  H 28.021 25.237 21.868 1.00 . A A . 7 TRP HH2  1 1 
       14 1621 1 1 6 TRP HZ2  H 29.650 23.528 22.598 1.00 . A A . 7 TRP HZ2  1 1 
       14 1622 1 1 6 TRP HZ3  H 27.140 25.183 19.549 1.00 . A A . 7 TRP HZ3  1 1 
       14 1623 1 1 6 TRP N    N 27.212 20.437 17.058 1.00 . A A . 7 TRP N    1 1 
       14 1624 1 1 6 TRP NE1  N 30.512 21.502 20.651 1.00 . A A . 7 TRP NE1  1 1 
       14 1625 1 1 6 TRP O    O 29.892 18.336 18.141 1.00 . A A . 7 TRP O    1 1 
       14 1626 1 1 7 .   C    C 28.660 16.512 19.676 1.00 . A A . 8 CY3 C    1 1 
       14 1627 1 1 7 .   CA   C 27.795 17.765 19.937 1.00 . A A . 8 CY3 CA   1 1 
       14 1628 1 1 7 .   CB   C 26.304 17.351 20.249 1.00 . A A . 8 CY3 CB   1 1 
       14 1629 1 1 7 .   H    H 26.969 19.251 18.648 1.00 . A A . 8 CY3 H    1 1 
       14 1630 1 1 7 .   HA   H 28.217 18.334 20.761 1.00 . A A . 8 CY3 HA   1 1 
       14 1631 1 1 7 .   HB2  H 25.694 18.239 20.272 1.00 . A A . 8 CY3 HB2  1 1 
       14 1632 1 1 7 .   HB3  H 26.306 16.951 21.255 1.00 . A A . 8 CY3 HB3  1 1 
       14 1633 1 1 7 .   HN11 H 30.227 17.142 20.715 1.00 . A A . 8 CY3 HN11 1 1 
       14 1634 1 1 7 .   HN12 H 30.374 15.612 19.990 1.00 . A A . 8 CY3 HN12 1 1 
       14 1635 1 1 7 .   N    N 27.793 18.744 18.816 1.00 . A A . 8 CY3 N    1 1 
       14 1636 1 1 7 .   N1   N 29.852 16.419 20.168 1.00 . A A . 8 CY3 N1   1 1 
       14 1637 1 1 7 .   O    O 28.257 15.580 19.007 1.00 . A A . 8 CY3 O    1 1 
       14 1638 1 1 7 .   SG   S 25.457 16.140 19.195 1.00 . A A . 8 CY3 SG   1 1 
       15 1639 1 1 1 CYS C    C 20.145 17.097 20.418 1.00 . A A . 2 CYS C    1 1 
       15 1640 1 1 1 CYS CA   C 21.625 17.545 20.516 1.00 . A A . 2 CYS CA   1 1 
       15 1641 1 1 1 CYS CB   C 22.513 16.600 19.662 1.00 . A A . 2 CYS CB   1 1 
       15 1642 1 1 1 CYS H1   H 21.972 16.714 22.467 1.00 . A A . 2 CYS H1   1 1 
       15 1643 1 1 1 CYS HA   H 21.738 18.541 20.144 1.00 . A A . 2 CYS HA   1 1 
       15 1644 1 1 1 CYS HB2  H 21.870 15.907 19.131 1.00 . A A . 2 CYS HB2  1 1 
       15 1645 1 1 1 CYS HB3  H 23.001 17.203 18.907 1.00 . A A . 2 CYS HB3  1 1 
       15 1646 1 1 1 CYS N    N 22.105 17.520 21.925 1.00 . A A . 2 CYS N    1 1 
       15 1647 1 1 1 CYS O    O 19.794 16.125 21.069 1.00 . A A . 2 CYS O    1 1 
       15 1648 1 1 1 CYS SG   S 23.801 15.610 20.460 1.00 . A A . 2 CYS SG   1 1 
       15 1649 1 1 2 HYP C    C 19.708 20.209 20.124 1.00 . A A . 3 HYP C    1 1 
       15 1650 1 1 2 HYP CA   C 19.611 19.112 19.039 1.00 . A A . 3 HYP CA   1 1 
       15 1651 1 1 2 HYP CB   C 18.465 19.395 18.059 1.00 . A A . 3 HYP CB   1 1 
       15 1652 1 1 2 HYP CD   C 17.976 17.268 19.288 1.00 . A A . 3 HYP CD   1 1 
       15 1653 1 1 2 HYP CG   C 17.582 18.123 18.046 1.00 . A A . 3 HYP CG   1 1 
       15 1654 1 1 2 HYP HA   H 20.534 19.051 18.480 1.00 . A A . 3 HYP HA   1 1 
       15 1655 1 1 2 HYP HB2  H 18.860 19.649 17.087 1.00 . A A . 3 HYP HB2  1 1 
       15 1656 1 1 2 HYP HB3  H 17.869 20.224 18.412 1.00 . A A . 3 HYP HB3  1 1 
       15 1657 1 1 2 HYP HD1  H 17.308 16.860 16.615 1.00 . A A . 3 HYP HD1  1 1 
       15 1658 1 1 2 HYP HD22 H 18.033 16.213 19.063 1.00 . A A . 3 HYP HD22 1 1 
       15 1659 1 1 2 HYP HD23 H 17.305 17.427 20.118 1.00 . A A . 3 HYP HD23 1 1 
       15 1660 1 1 2 HYP HG   H 16.523 18.334 17.979 1.00 . A A . 3 HYP HG   1 1 
       15 1661 1 1 2 HYP N    N 19.321 17.781 19.653 1.00 . A A . 3 HYP N    1 1 
       15 1662 1 1 2 HYP O    O 18.718 20.524 20.750 1.00 . A A . 3 HYP O    1 1 
       15 1663 1 1 2 HYP OD1  O 18.041 17.411 16.909 1.00 . A A . 3 HYP OD1  1 1 
       15 1664 1 1 3 DTR C    C 22.481 22.447 20.642 1.00 . A A . 4 DTR C    1 1 
       15 1665 1 1 3 DTR CA   C 21.264 21.790 21.292 1.00 . A A . 4 DTR CA   1 1 
       15 1666 1 1 3 DTR CB   C 20.133 22.865 21.486 1.00 . A A . 4 DTR CB   1 1 
       15 1667 1 1 3 DTR CD1  C 18.854 23.105 19.303 1.00 . A A . 4 DTR CD1  1 1 
       15 1668 1 1 3 DTR CD2  C 20.000 24.872 19.873 1.00 . A A . 4 DTR CD2  1 1 
       15 1669 1 1 3 DTR CE2  C 19.375 25.210 18.681 1.00 . A A . 4 DTR CE2  1 1 
       15 1670 1 1 3 DTR CE3  C 20.821 25.779 20.521 1.00 . A A . 4 DTR CE3  1 1 
       15 1671 1 1 3 DTR CG   C 19.679 23.614 20.229 1.00 . A A . 4 DTR CG   1 1 
       15 1672 1 1 3 DTR CH2  C 20.388 27.392 18.777 1.00 . A A . 4 DTR CH2  1 1 
       15 1673 1 1 3 DTR CZ2  C 19.568 26.474 18.132 1.00 . A A . 4 DTR CZ2  1 1 
       15 1674 1 1 3 DTR CZ3  C 21.016 27.047 19.973 1.00 . A A . 4 DTR CZ3  1 1 
       15 1675 1 1 3 DTR H    H 21.622 20.377 19.761 1.00 . A A . 4 DTR H    1 1 
       15 1676 1 1 3 DTR HA   H 21.488 21.387 22.250 1.00 . A A . 4 DTR HA   1 1 
       15 1677 1 1 3 DTR HB2  H 20.536 23.585 22.163 1.00 . A A . 4 DTR HB2  1 1 
       15 1678 1 1 3 DTR HB3  H 19.271 22.421 21.960 1.00 . A A . 4 DTR HB3  1 1 
       15 1679 1 1 3 DTR HD1  H 18.430 22.120 19.322 1.00 . A A . 4 DTR HD1  1 1 
       15 1680 1 1 3 DTR HE1  H 18.155 23.991 17.631 1.00 . A A . 4 DTR HE1  1 1 
       15 1681 1 1 3 DTR HE3  H 21.302 25.468 21.444 1.00 . A A . 4 DTR HE3  1 1 
       15 1682 1 1 3 DTR HH2  H 20.537 28.372 18.349 1.00 . A A . 4 DTR HH2  1 1 
       15 1683 1 1 3 DTR HZ2  H 19.082 26.739 17.206 1.00 . A A . 4 DTR HZ2  1 1 
       15 1684 1 1 3 DTR HZ3  H 21.652 27.764 20.466 1.00 . A A . 4 DTR HZ3  1 1 
       15 1685 1 1 3 DTR N    N 20.893 20.714 20.313 1.00 . A A . 4 DTR N    1 1 
       15 1686 1 1 3 DTR NE1  N 18.718 24.090 18.430 1.00 . A A . 4 DTR NE1  1 1 
       15 1687 1 1 3 DTR O    O 22.551 23.592 20.246 1.00 . A A . 4 DTR O    1 1 
       15 1688 1 1 4 GLN C    C 24.914 21.162 18.736 1.00 . A A . 5 GLN C    1 1 
       15 1689 1 1 4 GLN CA   C 24.767 22.050 19.948 1.00 . A A . 5 GLN CA   1 1 
       15 1690 1 1 4 GLN CB   C 25.970 21.788 20.825 1.00 . A A . 5 GLN CB   1 1 
       15 1691 1 1 4 GLN CD   C 24.893 22.647 22.972 1.00 . A A . 5 GLN CD   1 1 
       15 1692 1 1 4 GLN CG   C 26.034 22.785 21.956 1.00 . A A . 5 GLN CG   1 1 
       15 1693 1 1 4 GLN H    H 23.395 20.701 20.895 1.00 . A A . 5 GLN H    1 1 
       15 1694 1 1 4 GLN HA   H 24.721 23.088 19.680 1.00 . A A . 5 GLN HA   1 1 
       15 1695 1 1 4 GLN HB2  H 26.056 20.771 21.132 1.00 . A A . 5 GLN HB2  1 1 
       15 1696 1 1 4 GLN HB3  H 26.811 21.981 20.185 1.00 . A A . 5 GLN HB3  1 1 
       15 1697 1 1 4 GLN HE21 H 24.830 20.667 22.892 1.00 . A A . 5 GLN HE21 1 1 
       15 1698 1 1 4 GLN HE22 H 23.717 21.389 23.943 1.00 . A A . 5 GLN HE22 1 1 
       15 1699 1 1 4 GLN HG2  H 26.970 22.692 22.489 1.00 . A A . 5 GLN HG2  1 1 
       15 1700 1 1 4 GLN HG3  H 26.009 23.734 21.445 1.00 . A A . 5 GLN HG3  1 1 
       15 1701 1 1 4 GLN N    N 23.485 21.616 20.555 1.00 . A A . 5 GLN N    1 1 
       15 1702 1 1 4 GLN NE2  N 24.445 21.472 23.292 1.00 . A A . 5 GLN NE2  1 1 
       15 1703 1 1 4 GLN O    O 25.076 19.972 18.902 1.00 . A A . 5 GLN O    1 1 
       15 1704 1 1 4 GLN OE1  O 24.387 23.617 23.498 1.00 . A A . 5 GLN OE1  1 1 
       15 1705 1 1 5 PRO C    C 26.258 20.257 16.100 1.00 . A A . 6 PRO C    1 1 
       15 1706 1 1 5 PRO CA   C 24.865 20.828 16.356 1.00 . A A . 6 PRO CA   1 1 
       15 1707 1 1 5 PRO CB   C 24.334 21.734 15.236 1.00 . A A . 6 PRO CB   1 1 
       15 1708 1 1 5 PRO CD   C 24.808 23.144 17.261 1.00 . A A . 6 PRO CD   1 1 
       15 1709 1 1 5 PRO CG   C 24.364 23.208 15.784 1.00 . A A . 6 PRO CG   1 1 
       15 1710 1 1 5 PRO HA   H 24.220 19.986 16.564 1.00 . A A . 6 PRO HA   1 1 
       15 1711 1 1 5 PRO HB2  H 24.921 21.621 14.335 1.00 . A A . 6 PRO HB2  1 1 
       15 1712 1 1 5 PRO HB3  H 23.311 21.437 15.034 1.00 . A A . 6 PRO HB3  1 1 
       15 1713 1 1 5 PRO HD2  H 25.787 23.578 17.396 1.00 . A A . 6 PRO HD2  1 1 
       15 1714 1 1 5 PRO HD3  H 24.116 23.593 17.956 1.00 . A A . 6 PRO HD3  1 1 
       15 1715 1 1 5 PRO HG2  H 25.063 23.801 15.215 1.00 . A A . 6 PRO HG2  1 1 
       15 1716 1 1 5 PRO HG3  H 23.385 23.659 15.711 1.00 . A A . 6 PRO HG3  1 1 
       15 1717 1 1 5 PRO N    N 24.868 21.692 17.551 1.00 . A A . 6 PRO N    1 1 
       15 1718 1 1 5 PRO O    O 26.514 19.632 15.086 1.00 . A A . 6 PRO O    1 1 
       15 1719 1 1 6 TRP C    C 28.706 18.902 17.962 1.00 . A A . 7 TRP C    1 1 
       15 1720 1 1 6 TRP CA   C 28.516 19.991 16.915 1.00 . A A . 7 TRP CA   1 1 
       15 1721 1 1 6 TRP CB   C 29.507 21.152 17.175 1.00 . A A . 7 TRP CB   1 1 
       15 1722 1 1 6 TRP CD1  C 30.566 20.626 19.441 1.00 . A A . 7 TRP CD1  1 1 
       15 1723 1 1 6 TRP CD2  C 29.280 22.387 19.428 1.00 . A A . 7 TRP CD2  1 1 
       15 1724 1 1 6 TRP CE2  C 29.767 22.300 20.724 1.00 . A A . 7 TRP CE2  1 1 
       15 1725 1 1 6 TRP CE3  C 28.415 23.394 19.068 1.00 . A A . 7 TRP CE3  1 1 
       15 1726 1 1 6 TRP CG   C 29.765 21.395 18.673 1.00 . A A . 7 TRP CG   1 1 
       15 1727 1 1 6 TRP CH2  C 28.521 24.273 21.302 1.00 . A A . 7 TRP CH2  1 1 
       15 1728 1 1 6 TRP CZ2  C 29.390 23.248 21.664 1.00 . A A . 7 TRP CZ2  1 1 
       15 1729 1 1 6 TRP CZ3  C 28.024 24.347 20.000 1.00 . A A . 7 TRP CZ3  1 1 
       15 1730 1 1 6 TRP H    H 26.900 21.013 17.852 1.00 . A A . 7 TRP H    1 1 
       15 1731 1 1 6 TRP HA   H 28.668 19.578 15.930 1.00 . A A . 7 TRP HA   1 1 
       15 1732 1 1 6 TRP HB2  H 30.452 20.911 16.721 1.00 . A A . 7 TRP HB2  1 1 
       15 1733 1 1 6 TRP HB3  H 29.163 22.063 16.729 1.00 . A A . 7 TRP HB3  1 1 
       15 1734 1 1 6 TRP HD1  H 31.093 19.744 19.120 1.00 . A A . 7 TRP HD1  1 1 
       15 1735 1 1 6 TRP HE1  H 30.998 20.876 21.402 1.00 . A A . 7 TRP HE1  1 1 
       15 1736 1 1 6 TRP HE3  H 28.042 23.399 18.064 1.00 . A A . 7 TRP HE3  1 1 
       15 1737 1 1 6 TRP HH2  H 28.226 25.016 22.030 1.00 . A A . 7 TRP HH2  1 1 
       15 1738 1 1 6 TRP HZ2  H 29.766 23.197 22.675 1.00 . A A . 7 TRP HZ2  1 1 
       15 1739 1 1 6 TRP HZ3  H 27.326 25.129 19.724 1.00 . A A . 7 TRP HZ3  1 1 
       15 1740 1 1 6 TRP N    N 27.129 20.498 17.045 1.00 . A A . 7 TRP N    1 1 
       15 1741 1 1 6 TRP NE1  N 30.517 21.218 20.620 1.00 . A A . 7 TRP NE1  1 1 
       15 1742 1 1 6 TRP O    O 29.751 18.280 17.977 1.00 . A A . 7 TRP O    1 1 
       15 1743 1 1 7 .   C    C 28.563 16.480 19.595 1.00 . A A . 8 CY3 C    1 1 
       15 1744 1 1 7 .   CA   C 27.718 17.728 19.869 1.00 . A A . 8 CY3 CA   1 1 
       15 1745 1 1 7 .   CB   C 26.253 17.295 20.216 1.00 . A A . 8 CY3 CB   1 1 
       15 1746 1 1 7 .   H    H 26.883 19.280 18.651 1.00 . A A . 8 CY3 H    1 1 
       15 1747 1 1 7 .   HA   H 28.143 18.265 20.705 1.00 . A A . 8 CY3 HA   1 1 
       15 1748 1 1 7 .   HB2  H 25.605 18.156 20.172 1.00 . A A . 8 CY3 HB2  1 1 
       15 1749 1 1 7 .   HB3  H 26.266 16.981 21.251 1.00 . A A . 8 CY3 HB3  1 1 
       15 1750 1 1 7 .   HN11 H 29.265 16.394 21.440 1.00 . A A . 8 CY3 HN11 1 1 
       15 1751 1 1 7 .   HN12 H 29.825 15.189 20.388 1.00 . A A . 8 CY3 HN12 1 1 
       15 1752 1 1 7 .   N    N 27.692 18.737 18.775 1.00 . A A . 8 CY3 N    1 1 
       15 1753 1 1 7 .   N1   N 29.274 15.978 20.553 1.00 . A A . 8 CY3 N1   1 1 
       15 1754 1 1 7 .   O    O 28.597 15.938 18.508 1.00 . A A . 8 CY3 O    1 1 
       15 1755 1 1 7 .   SG   S 25.426 15.964 19.311 1.00 . A A . 8 CY3 SG   1 1 
       16 1756 1 1 1 CYS C    C 20.348 17.110 20.566 1.00 . A A . 2 CYS C    1 1 
       16 1757 1 1 1 CYS CA   C 21.767 17.680 20.276 1.00 . A A . 2 CYS CA   1 1 
       16 1758 1 1 1 CYS CB   C 22.716 16.531 19.890 1.00 . A A . 2 CYS CB   1 1 
       16 1759 1 1 1 CYS H1   H 22.298 17.931 22.338 1.00 . A A . 2 CYS H1   1 1 
       16 1760 1 1 1 CYS HA   H 21.738 18.356 19.448 1.00 . A A . 2 CYS HA   1 1 
       16 1761 1 1 1 CYS HB2  H 22.107 15.744 19.476 1.00 . A A . 2 CYS HB2  1 1 
       16 1762 1 1 1 CYS HB3  H 23.343 16.890 19.090 1.00 . A A . 2 CYS HB3  1 1 
       16 1763 1 1 1 CYS N    N 22.325 18.392 21.467 1.00 . A A . 2 CYS N    1 1 
       16 1764 1 1 1 CYS O    O 20.242 16.194 21.361 1.00 . A A . 2 CYS O    1 1 
       16 1765 1 1 1 CYS SG   S 23.806 15.830 21.157 1.00 . A A . 2 CYS SG   1 1 
       16 1766 1 1 2 HYP C    C 19.561 20.146 20.122 1.00 . A A . 3 HYP C    1 1 
       16 1767 1 1 2 HYP CA   C 19.350 18.919 19.192 1.00 . A A . 3 HYP CA   1 1 
       16 1768 1 1 2 HYP CB   C 18.011 19.007 18.451 1.00 . A A . 3 HYP CB   1 1 
       16 1769 1 1 2 HYP CD   C 17.968 17.012 19.986 1.00 . A A . 3 HYP CD   1 1 
       16 1770 1 1 2 HYP CG   C 17.188 17.745 18.851 1.00 . A A . 3 HYP CG   1 1 
       16 1771 1 1 2 HYP HA   H 20.138 18.865 18.454 1.00 . A A . 3 HYP HA   1 1 
       16 1772 1 1 2 HYP HB2  H 18.186 19.104 17.392 1.00 . A A . 3 HYP HB2  1 1 
       16 1773 1 1 2 HYP HB3  H 17.456 19.881 18.771 1.00 . A A . 3 HYP HB3  1 1 
       16 1774 1 1 2 HYP HD1  H 16.492 17.222 17.109 1.00 . A A . 3 HYP HD1  1 1 
       16 1775 1 1 2 HYP HD22 H 18.064 15.949 19.822 1.00 . A A . 3 HYP HD22 1 1 
       16 1776 1 1 2 HYP HD23 H 17.509 17.186 20.949 1.00 . A A . 3 HYP HD23 1 1 
       16 1777 1 1 2 HYP HG   H 16.177 18.002 19.142 1.00 . A A . 3 HYP HG   1 1 
       16 1778 1 1 2 HYP N    N 19.315 17.648 19.964 1.00 . A A . 3 HYP N    1 1 
       16 1779 1 1 2 HYP O    O 18.602 20.619 20.696 1.00 . A A . 3 HYP O    1 1 
       16 1780 1 1 2 HYP OD1  O 17.192 16.914 17.697 1.00 . A A . 3 HYP OD1  1 1 
       16 1781 1 1 3 DTR C    C 22.458 22.361 20.512 1.00 . A A . 4 DTR C    1 1 
       16 1782 1 1 3 DTR CA   C 21.176 21.775 21.117 1.00 . A A . 4 DTR CA   1 1 
       16 1783 1 1 3 DTR CB   C 20.083 22.906 21.131 1.00 . A A . 4 DTR CB   1 1 
       16 1784 1 1 3 DTR CD1  C 18.947 22.894 18.842 1.00 . A A . 4 DTR CD1  1 1 
       16 1785 1 1 3 DTR CD2  C 20.081 24.704 19.288 1.00 . A A . 4 DTR CD2  1 1 
       16 1786 1 1 3 DTR CE2  C 19.544 24.907 18.027 1.00 . A A . 4 DTR CE2  1 1 
       16 1787 1 1 3 DTR CE3  C 20.867 25.677 19.885 1.00 . A A . 4 DTR CE3  1 1 
       16 1788 1 1 3 DTR CG   C 19.715 23.500 19.762 1.00 . A A . 4 DTR CG   1 1 
       16 1789 1 1 3 DTR CH2  C 20.582 27.081 17.937 1.00 . A A . 4 DTR CH2  1 1 
       16 1790 1 1 3 DTR CZ2  C 19.794 26.096 17.347 1.00 . A A . 4 DTR CZ2  1 1 
       16 1791 1 1 3 DTR CZ3  C 21.119 26.873 19.205 1.00 . A A . 4 DTR CZ3  1 1 
       16 1792 1 1 3 DTR H    H 21.494 20.146 19.787 1.00 . A A . 4 DTR H    1 1 
       16 1793 1 1 3 DTR HA   H 21.329 21.488 22.129 1.00 . A A . 4 DTR HA   1 1 
       16 1794 1 1 3 DTR HB2  H 20.498 23.694 21.719 1.00 . A A . 4 DTR HB2  1 1 
       16 1795 1 1 3 DTR HB3  H 19.183 22.575 21.624 1.00 . A A . 4 DTR HB3  1 1 
       16 1796 1 1 3 DTR HD1  H 18.508 21.924 18.940 1.00 . A A . 4 DTR HD1  1 1 
       16 1797 1 1 3 DTR HE1  H 18.386 23.589 17.039 1.00 . A A . 4 DTR HE1  1 1 
       16 1798 1 1 3 DTR HE3  H 21.277 25.465 20.868 1.00 . A A . 4 DTR HE3  1 1 
       16 1799 1 1 3 DTR HH2  H 20.777 28.004 17.408 1.00 . A A . 4 DTR HH2  1 1 
       16 1800 1 1 3 DTR HZ2  H 19.377 26.255 16.365 1.00 . A A . 4 DTR HZ2  1 1 
       16 1801 1 1 3 DTR HZ3  H 21.723 27.643 19.657 1.00 . A A . 4 DTR HZ3  1 1 
       16 1802 1 1 3 DTR N    N 20.778 20.596 20.268 1.00 . A A . 4 DTR N    1 1 
       16 1803 1 1 3 DTR NE1  N 18.889 23.771 17.856 1.00 . A A . 4 DTR NE1  1 1 
       16 1804 1 1 3 DTR O    O 22.558 23.458 20.008 1.00 . A A . 4 DTR O    1 1 
       16 1805 1 1 4 GLN C    C 24.966 21.141 18.804 1.00 . A A . 5 GLN C    1 1 
       16 1806 1 1 4 GLN CA   C 24.794 21.979 20.044 1.00 . A A . 5 GLN CA   1 1 
       16 1807 1 1 4 GLN CB   C 25.980 21.656 20.934 1.00 . A A . 5 GLN CB   1 1 
       16 1808 1 1 4 GLN CD   C 24.854 22.536 23.053 1.00 . A A . 5 GLN CD   1 1 
       16 1809 1 1 4 GLN CG   C 26.062 22.608 22.110 1.00 . A A . 5 GLN CG   1 1 
       16 1810 1 1 4 GLN H    H 23.381 20.665 21.004 1.00 . A A . 5 GLN H    1 1 
       16 1811 1 1 4 GLN HA   H 24.785 23.030 19.821 1.00 . A A . 5 GLN HA   1 1 
       16 1812 1 1 4 GLN HB2  H 26.064 20.627 21.203 1.00 . A A . 5 GLN HB2  1 1 
       16 1813 1 1 4 GLN HB3  H 26.828 21.876 20.310 1.00 . A A . 5 GLN HB3  1 1 
       16 1814 1 1 4 GLN HE21 H 24.722 20.559 23.001 1.00 . A A . 5 GLN HE21 1 1 
       16 1815 1 1 4 GLN HE22 H 23.573 21.350 23.965 1.00 . A A . 5 GLN HE22 1 1 
       16 1816 1 1 4 GLN HG2  H 26.958 22.426 22.682 1.00 . A A . 5 GLN HG2  1 1 
       16 1817 1 1 4 GLN HG3  H 26.149 23.571 21.631 1.00 . A A . 5 GLN HG3  1 1 
       16 1818 1 1 4 GLN N    N 23.478 21.550 20.594 1.00 . A A . 5 GLN N    1 1 
       16 1819 1 1 4 GLN NE2  N 24.344 21.386 23.362 1.00 . A A . 5 GLN NE2  1 1 
       16 1820 1 1 4 GLN O    O 25.177 19.954 18.926 1.00 . A A . 5 GLN O    1 1 
       16 1821 1 1 4 GLN OE1  O 24.350 23.533 23.536 1.00 . A A . 5 GLN OE1  1 1 
       16 1822 1 1 5 PRO C    C 26.298 20.353 16.140 1.00 . A A . 6 PRO C    1 1 
       16 1823 1 1 5 PRO CA   C 24.897 20.891 16.425 1.00 . A A . 6 PRO CA   1 1 
       16 1824 1 1 5 PRO CB   C 24.320 21.812 15.343 1.00 . A A . 6 PRO CB   1 1 
       16 1825 1 1 5 PRO CD   C 24.810 23.176 17.396 1.00 . A A . 6 PRO CD   1 1 
       16 1826 1 1 5 PRO CG   C 24.286 23.266 15.941 1.00 . A A . 6 PRO CG   1 1 
       16 1827 1 1 5 PRO HA   H 24.283 20.032 16.623 1.00 . A A . 6 PRO HA   1 1 
       16 1828 1 1 5 PRO HB2  H 24.893 21.756 14.428 1.00 . A A . 6 PRO HB2  1 1 
       16 1829 1 1 5 PRO HB3  H 23.306 21.475 15.158 1.00 . A A . 6 PRO HB3  1 1 
       16 1830 1 1 5 PRO HD2  H 25.794 23.620 17.488 1.00 . A A . 6 PRO HD2  1 1 
       16 1831 1 1 5 PRO HD3  H 24.149 23.601 18.136 1.00 . A A . 6 PRO HD3  1 1 
       16 1832 1 1 5 PRO HG2  H 24.905 23.932 15.360 1.00 . A A . 6 PRO HG2  1 1 
       16 1833 1 1 5 PRO HG3  H 23.275 23.650 15.942 1.00 . A A . 6 PRO HG3  1 1 
       16 1834 1 1 5 PRO N    N 24.898 21.718 17.638 1.00 . A A . 6 PRO N    1 1 
       16 1835 1 1 5 PRO O    O 26.583 19.871 15.064 1.00 . A A . 6 PRO O    1 1 
       16 1836 1 1 6 TRP C    C 28.708 18.804 17.951 1.00 . A A . 7 TRP C    1 1 
       16 1837 1 1 6 TRP CA   C 28.543 19.956 16.951 1.00 . A A . 7 TRP CA   1 1 
       16 1838 1 1 6 TRP CB   C 29.571 21.065 17.276 1.00 . A A . 7 TRP CB   1 1 
       16 1839 1 1 6 TRP CD1  C 30.582 20.329 19.496 1.00 . A A . 7 TRP CD1  1 1 
       16 1840 1 1 6 TRP CD2  C 29.396 22.149 19.602 1.00 . A A . 7 TRP CD2  1 1 
       16 1841 1 1 6 TRP CE2  C 29.856 21.940 20.896 1.00 . A A . 7 TRP CE2  1 1 
       16 1842 1 1 6 TRP CE3  C 28.593 23.227 19.300 1.00 . A A . 7 TRP CE3  1 1 
       16 1843 1 1 6 TRP CG   C 29.836 21.192 18.783 1.00 . A A . 7 TRP CG   1 1 
       16 1844 1 1 6 TRP CH2  C 28.700 23.941 21.592 1.00 . A A . 7 TRP CH2  1 1 
       16 1845 1 1 6 TRP CZ2  C 29.506 22.847 21.894 1.00 . A A . 7 TRP CZ2  1 1 
       16 1846 1 1 6 TRP CZ3  C 28.240 24.130 20.291 1.00 . A A . 7 TRP CZ3  1 1 
       16 1847 1 1 6 TRP H    H 26.915 20.879 17.974 1.00 . A A . 7 TRP H    1 1 
       16 1848 1 1 6 TRP HA   H 28.678 19.592 15.944 1.00 . A A . 7 TRP HA   1 1 
       16 1849 1 1 6 TRP HB2  H 30.510 20.810 16.799 1.00 . A A . 7 TRP HB2  1 1 
       16 1850 1 1 6 TRP HB3  H 29.268 22.016 16.892 1.00 . A A . 7 TRP HB3  1 1 
       16 1851 1 1 6 TRP HD1  H 31.073 19.447 19.127 1.00 . A A . 7 TRP HD1  1 1 
       16 1852 1 1 6 TRP HE1  H 31.003 20.362 21.456 1.00 . A A . 7 TRP HE1  1 1 
       16 1853 1 1 6 TRP HE3  H 28.240 23.333 18.294 1.00 . A A . 7 TRP HE3  1 1 
       16 1854 1 1 6 TRP HH2  H 28.438 24.645 22.375 1.00 . A A . 7 TRP HH2  1 1 
       16 1855 1 1 6 TRP HZ2  H 29.855 22.706 22.908 1.00 . A A . 7 TRP HZ2  1 1 
       16 1856 1 1 6 TRP HZ3  H 27.603 24.971 20.072 1.00 . A A . 7 TRP HZ3  1 1 
       16 1857 1 1 6 TRP N    N 27.159 20.462 17.117 1.00 . A A . 7 TRP N    1 1 
       16 1858 1 1 6 TRP NE1  N 30.548 20.827 20.715 1.00 . A A . 7 TRP NE1  1 1 
       16 1859 1 1 6 TRP O    O 29.702 18.108 17.907 1.00 . A A . 7 TRP O    1 1 
       16 1860 1 1 7 .   C    C 28.434 16.358 19.529 1.00 . A A . 8 CY3 C    1 1 
       16 1861 1 1 7 .   CA   C 27.671 17.639 19.860 1.00 . A A . 8 CY3 CA   1 1 
       16 1862 1 1 7 .   CB   C 26.176 17.313 20.175 1.00 . A A . 8 CY3 CB   1 1 
       16 1863 1 1 7 .   H    H 26.942 19.276 18.707 1.00 . A A . 8 CY3 H    1 1 
       16 1864 1 1 7 .   HA   H 28.133 18.106 20.720 1.00 . A A . 8 CY3 HA   1 1 
       16 1865 1 1 7 .   HB2  H 25.554 17.837 19.465 1.00 . A A . 8 CY3 HB2  1 1 
       16 1866 1 1 7 .   HB3  H 25.952 17.723 21.149 1.00 . A A . 8 CY3 HB3  1 1 
       16 1867 1 1 7 .   HN11 H 29.400 16.310 21.263 1.00 . A A . 8 CY3 HN11 1 1 
       16 1868 1 1 7 .   HN12 H 29.746 15.056 20.169 1.00 . A A . 8 CY3 HN12 1 1 
       16 1869 1 1 7 .   N    N 27.712 18.676 18.792 1.00 . A A . 8 CY3 N    1 1 
       16 1870 1 1 7 .   N1   N 29.255 15.869 20.401 1.00 . A A . 8 CY3 N1   1 1 
       16 1871 1 1 7 .   O    O 28.289 15.776 18.477 1.00 . A A . 8 CY3 O    1 1 
       16 1872 1 1 7 .   SG   S 25.555 15.611 20.173 1.00 . A A . 8 CY3 SG   1 1 
       17 1873 1 1 1 CYS C    C 20.260 17.059 20.334 1.00 . A A . 2 CYS C    1 1 
       17 1874 1 1 1 CYS CA   C 21.641 17.654 19.949 1.00 . A A . 2 CYS CA   1 1 
       17 1875 1 1 1 CYS CB   C 22.464 16.619 19.140 1.00 . A A . 2 CYS CB   1 1 
       17 1876 1 1 1 CYS H1   H 22.196 17.529 22.010 1.00 . A A . 2 CYS H1   1 1 
       17 1877 1 1 1 CYS HA   H 21.526 18.523 19.335 1.00 . A A . 2 CYS HA   1 1 
       17 1878 1 1 1 CYS HB2  H 21.755 15.951 18.664 1.00 . A A . 2 CYS HB2  1 1 
       17 1879 1 1 1 CYS HB3  H 22.970 17.152 18.348 1.00 . A A . 2 CYS HB3  1 1 
       17 1880 1 1 1 CYS N    N 22.389 18.020 21.179 1.00 . A A . 2 CYS N    1 1 
       17 1881 1 1 1 CYS O    O 20.226 16.004 20.940 1.00 . A A . 2 CYS O    1 1 
       17 1882 1 1 1 CYS SG   S 23.723 15.607 19.954 1.00 . A A . 2 CYS SG   1 1 
       17 1883 1 1 2 HYP C    C 19.496 20.177 20.494 1.00 . A A . 3 HYP C    1 1 
       17 1884 1 1 2 HYP CA   C 19.100 19.105 19.465 1.00 . A A . 3 HYP CA   1 1 
       17 1885 1 1 2 HYP CB   C 17.658 19.319 18.984 1.00 . A A . 3 HYP CB   1 1 
       17 1886 1 1 2 HYP CD   C 17.824 17.081 20.125 1.00 . A A . 3 HYP CD   1 1 
       17 1887 1 1 2 HYP CG   C 16.827 18.179 19.642 1.00 . A A . 3 HYP CG   1 1 
       17 1888 1 1 2 HYP HA   H 19.775 19.183 18.625 1.00 . A A . 3 HYP HA   1 1 
       17 1889 1 1 2 HYP HB2  H 17.631 19.323 17.908 1.00 . A A . 3 HYP HB2  1 1 
       17 1890 1 1 2 HYP HB3  H 17.263 20.264 19.327 1.00 . A A . 3 HYP HB3  1 1 
       17 1891 1 1 2 HYP HD1  H 16.640 17.267 17.930 1.00 . A A . 3 HYP HD1  1 1 
       17 1892 1 1 2 HYP HD22 H 17.795 16.188 19.520 1.00 . A A . 3 HYP HD22 1 1 
       17 1893 1 1 2 HYP HD23 H 17.663 16.812 21.157 1.00 . A A . 3 HYP HD23 1 1 
       17 1894 1 1 2 HYP HG   H 16.197 18.540 20.448 1.00 . A A . 3 HYP HG   1 1 
       17 1895 1 1 2 HYP N    N 19.169 17.712 20.001 1.00 . A A . 3 HYP N    1 1 
       17 1896 1 1 2 HYP O    O 18.673 20.560 21.307 1.00 . A A . 3 HYP O    1 1 
       17 1897 1 1 2 HYP OD1  O 16.044 17.619 18.597 1.00 . A A . 3 HYP OD1  1 1 
       17 1898 1 1 3 DTR C    C 22.443 22.348 20.614 1.00 . A A . 4 DTR C    1 1 
       17 1899 1 1 3 DTR CA   C 21.288 21.663 21.350 1.00 . A A . 4 DTR CA   1 1 
       17 1900 1 1 3 DTR CB   C 20.223 22.754 21.719 1.00 . A A . 4 DTR CB   1 1 
       17 1901 1 1 3 DTR CD1  C 18.781 22.980 19.609 1.00 . A A . 4 DTR CD1  1 1 
       17 1902 1 1 3 DTR CD2  C 19.889 24.765 20.157 1.00 . A A . 4 DTR CD2  1 1 
       17 1903 1 1 3 DTR CE2  C 19.193 25.105 19.006 1.00 . A A . 4 DTR CE2  1 1 
       17 1904 1 1 3 DTR CE3  C 20.704 25.680 20.793 1.00 . A A . 4 DTR CE3  1 1 
       17 1905 1 1 3 DTR CG   C 19.637 23.496 20.505 1.00 . A A . 4 DTR CG   1 1 
       17 1906 1 1 3 DTR CH2  C 20.140 27.324 19.121 1.00 . A A . 4 DTR CH2  1 1 
       17 1907 1 1 3 DTR CZ2  C 19.320 26.392 18.487 1.00 . A A . 4 DTR CZ2  1 1 
       17 1908 1 1 3 DTR CZ3  C 20.834 26.965 20.276 1.00 . A A . 4 DTR CZ3  1 1 
       17 1909 1 1 3 DTR H    H 21.325 20.255 19.758 1.00 . A A . 4 DTR H    1 1 
       17 1910 1 1 3 DTR HA   H 21.634 21.242 22.269 1.00 . A A . 4 DTR HA   1 1 
       17 1911 1 1 3 DTR HB2  H 20.740 23.470 22.306 1.00 . A A . 4 DTR HB2  1 1 
       17 1912 1 1 3 DTR HB3  H 19.426 22.362 22.325 1.00 . A A . 4 DTR HB3  1 1 
       17 1913 1 1 3 DTR HD1  H 18.382 21.989 19.615 1.00 . A A . 4 DTR HD1  1 1 
       17 1914 1 1 3 DTR HE1  H 17.962 23.844 17.986 1.00 . A A . 4 DTR HE1  1 1 
       17 1915 1 1 3 DTR HE3  H 21.232 25.364 21.680 1.00 . A A . 4 DTR HE3  1 1 
       17 1916 1 1 3 DTR HH2  H 20.238 28.326 18.720 1.00 . A A . 4 DTR HH2  1 1 
       17 1917 1 1 3 DTR HZ2  H 18.779 26.665 17.594 1.00 . A A . 4 DTR HZ2  1 1 
       17 1918 1 1 3 DTR HZ3  H 21.468 27.691 20.768 1.00 . A A . 4 DTR HZ3  1 1 
       17 1919 1 1 3 DTR N    N 20.726 20.612 20.441 1.00 . A A . 4 DTR N    1 1 
       17 1920 1 1 3 DTR NE1  N 18.567 23.967 18.765 1.00 . A A . 4 DTR NE1  1 1 
       17 1921 1 1 3 DTR O    O 22.396 23.467 20.146 1.00 . A A . 4 DTR O    1 1 
       17 1922 1 1 4 GLN C    C 24.971 21.234 18.660 1.00 . A A . 5 GLN C    1 1 
       17 1923 1 1 4 GLN CA   C 24.716 22.155 19.833 1.00 . A A . 5 GLN CA   1 1 
       17 1924 1 1 4 GLN CB   C 25.963 22.131 20.699 1.00 . A A . 5 GLN CB   1 1 
       17 1925 1 1 4 GLN CD   C 24.960 23.495 22.618 1.00 . A A . 5 GLN CD   1 1 
       17 1926 1 1 4 GLN CG   C 26.056 23.369 21.562 1.00 . A A . 5 GLN CG   1 1 
       17 1927 1 1 4 GLN H    H 23.520 20.700 20.893 1.00 . A A . 5 GLN H    1 1 
       17 1928 1 1 4 GLN HA   H 24.533 23.161 19.511 1.00 . A A . 5 GLN HA   1 1 
       17 1929 1 1 4 GLN HB2  H 26.074 21.242 21.261 1.00 . A A . 5 GLN HB2  1 1 
       17 1930 1 1 4 GLN HB3  H 26.814 22.156 20.039 1.00 . A A . 5 GLN HB3  1 1 
       17 1931 1 1 4 GLN HE21 H 23.603 24.338 21.442 1.00 . A A . 5 GLN HE21 1 1 
       17 1932 1 1 4 GLN HE22 H 23.147 24.097 23.059 1.00 . A A . 5 GLN HE22 1 1 
       17 1933 1 1 4 GLN HG2  H 27.002 23.363 22.086 1.00 . A A . 5 GLN HG2  1 1 
       17 1934 1 1 4 GLN HG3  H 26.030 24.188 20.862 1.00 . A A . 5 GLN HG3  1 1 
       17 1935 1 1 4 GLN N    N 23.512 21.611 20.523 1.00 . A A . 5 GLN N    1 1 
       17 1936 1 1 4 GLN NE2  N 23.812 24.021 22.346 1.00 . A A . 5 GLN NE2  1 1 
       17 1937 1 1 4 GLN O    O 25.203 20.066 18.882 1.00 . A A . 5 GLN O    1 1 
       17 1938 1 1 4 GLN OE1  O 25.138 23.104 23.752 1.00 . A A . 5 GLN OE1  1 1 
       17 1939 1 1 5 PRO C    C 26.383 20.279 16.033 1.00 . A A . 6 PRO C    1 1 
       17 1940 1 1 5 PRO CA   C 24.968 20.826 16.285 1.00 . A A . 6 PRO CA   1 1 
       17 1941 1 1 5 PRO CB   C 24.382 21.692 15.174 1.00 . A A . 6 PRO CB   1 1 
       17 1942 1 1 5 PRO CD   C 24.883 23.171 17.111 1.00 . A A . 6 PRO CD   1 1 
       17 1943 1 1 5 PRO CG   C 24.495 23.187 15.622 1.00 . A A . 6 PRO CG   1 1 
       17 1944 1 1 5 PRO HA   H 24.319 19.984 16.492 1.00 . A A . 6 PRO HA   1 1 
       17 1945 1 1 5 PRO HB2  H 24.858 21.496 14.223 1.00 . A A . 6 PRO HB2  1 1 
       17 1946 1 1 5 PRO HB3  H 23.331 21.417 15.134 1.00 . A A . 6 PRO HB3  1 1 
       17 1947 1 1 5 PRO HD2  H 25.849 23.628 17.277 1.00 . A A . 6 PRO HD2  1 1 
       17 1948 1 1 5 PRO HD3  H 24.149 23.650 17.743 1.00 . A A . 6 PRO HD3  1 1 
       17 1949 1 1 5 PRO HG2  H 25.241 23.704 15.036 1.00 . A A . 6 PRO HG2  1 1 
       17 1950 1 1 5 PRO HG3  H 23.541 23.676 15.492 1.00 . A A . 6 PRO HG3  1 1 
       17 1951 1 1 5 PRO N    N 24.942 21.725 17.454 1.00 . A A . 6 PRO N    1 1 
       17 1952 1 1 5 PRO O    O 26.718 19.826 14.955 1.00 . A A . 6 PRO O    1 1 
       17 1953 1 1 6 TRP C    C 28.764 18.845 18.081 1.00 . A A . 7 TRP C    1 1 
       17 1954 1 1 6 TRP CA   C 28.590 19.850 16.952 1.00 . A A . 7 TRP CA   1 1 
       17 1955 1 1 6 TRP CB   C 29.592 20.993 17.133 1.00 . A A . 7 TRP CB   1 1 
       17 1956 1 1 6 TRP CD1  C 30.606 20.786 19.475 1.00 . A A . 7 TRP CD1  1 1 
       17 1957 1 1 6 TRP CD2  C 29.320 22.522 19.185 1.00 . A A . 7 TRP CD2  1 1 
       17 1958 1 1 6 TRP CE2  C 29.789 22.634 20.483 1.00 . A A . 7 TRP CE2  1 1 
       17 1959 1 1 6 TRP CE3  C 28.462 23.457 18.664 1.00 . A A . 7 TRP CE3  1 1 
       17 1960 1 1 6 TRP CG   C 29.813 21.430 18.592 1.00 . A A . 7 TRP CG   1 1 
       17 1961 1 1 6 TRP CH2  C 28.532 24.676 20.735 1.00 . A A . 7 TRP CH2  1 1 
       17 1962 1 1 6 TRP CZ2  C 29.398 23.716 21.264 1.00 . A A . 7 TRP CZ2  1 1 
       17 1963 1 1 6 TRP CZ3  C 28.060 24.538 19.430 1.00 . A A . 7 TRP CZ3  1 1 
       17 1964 1 1 6 TRP H    H 26.916 20.775 17.903 1.00 . A A . 7 TRP H    1 1 
       17 1965 1 1 6 TRP HA   H 28.735 19.330 16.017 1.00 . A A . 7 TRP HA   1 1 
       17 1966 1 1 6 TRP HB2  H 30.549 20.650 16.762 1.00 . A A . 7 TRP HB2  1 1 
       17 1967 1 1 6 TRP HB3  H 29.321 21.849 16.545 1.00 . A A . 7 TRP HB3  1 1 
       17 1968 1 1 6 TRP HD1  H 31.134 19.862 19.305 1.00 . A A . 7 TRP HD1  1 1 
       17 1969 1 1 6 TRP HE1  H 31.016 21.330 21.380 1.00 . A A . 7 TRP HE1  1 1 
       17 1970 1 1 6 TRP HE3  H 28.111 23.289 17.666 1.00 . A A . 7 TRP HE3  1 1 
       17 1971 1 1 6 TRP HH2  H 28.229 25.519 21.346 1.00 . A A . 7 TRP HH2  1 1 
       17 1972 1 1 6 TRP HZ2  H 29.759 23.818 22.279 1.00 . A A . 7 TRP HZ2  1 1 
       17 1973 1 1 6 TRP HZ3  H 27.379 25.263 19.024 1.00 . A A . 7 TRP HZ3  1 1 
       17 1974 1 1 6 TRP N    N 27.195 20.361 17.052 1.00 . A A . 7 TRP N    1 1 
       17 1975 1 1 6 TRP NE1  N 30.541 21.549 20.555 1.00 . A A . 7 TRP NE1  1 1 
       17 1976 1 1 6 TRP O    O 29.827 18.282 18.240 1.00 . A A . 7 TRP O    1 1 
       17 1977 1 1 7 .   C    C 28.673 16.528 19.835 1.00 . A A . 8 CY3 C    1 1 
       17 1978 1 1 7 .   CA   C 27.708 17.729 19.972 1.00 . A A . 8 CY3 CA   1 1 
       17 1979 1 1 7 .   CB   C 26.246 17.225 20.211 1.00 . A A . 8 CY3 CB   1 1 
       17 1980 1 1 7 .   H    H 26.872 19.136 18.615 1.00 . A A . 8 CY3 H    1 1 
       17 1981 1 1 7 .   HA   H 28.051 18.372 20.771 1.00 . A A . 8 CY3 HA   1 1 
       17 1982 1 1 7 .   HB2  H 25.603 18.079 20.339 1.00 . A A . 8 CY3 HB2  1 1 
       17 1983 1 1 7 .   HB3  H 26.249 16.707 21.159 1.00 . A A . 8 CY3 HB3  1 1 
       17 1984 1 1 7 .   HN11 H 29.845 17.133 21.300 1.00 . A A . 8 CY3 HN11 1 1 
       17 1985 1 1 7 .   HN12 H 30.318 15.702 20.526 1.00 . A A . 8 CY3 HN12 1 1 
       17 1986 1 1 7 .   N    N 27.703 18.660 18.821 1.00 . A A . 8 CY3 N    1 1 
       17 1987 1 1 7 .   N1   N 29.694 16.444 20.627 1.00 . A A . 8 CY3 N1   1 1 
       17 1988 1 1 7 .   O    O 28.506 15.656 19.001 1.00 . A A . 8 CY3 O    1 1 
       17 1989 1 1 7 .   SG   S 25.446 16.116 19.024 1.00 . A A . 8 CY3 SG   1 1 
       18 1990 1 1 1 CYS C    C 20.060 16.971 20.415 1.00 . A A . 2 CYS C    1 1 
       18 1991 1 1 1 CYS CA   C 21.494 17.536 20.554 1.00 . A A . 2 CYS CA   1 1 
       18 1992 1 1 1 CYS CB   C 22.325 17.311 19.265 1.00 . A A . 2 CYS CB   1 1 
       18 1993 1 1 1 CYS H1   H 21.649 16.164 22.189 1.00 . A A . 2 CYS H1   1 1 
       18 1994 1 1 1 CYS HA   H 21.451 18.570 20.830 1.00 . A A . 2 CYS HA   1 1 
       18 1995 1 1 1 CYS HB2  H 21.646 17.111 18.448 1.00 . A A . 2 CYS HB2  1 1 
       18 1996 1 1 1 CYS HB3  H 22.853 18.226 19.036 1.00 . A A . 2 CYS HB3  1 1 
       18 1997 1 1 1 CYS N    N 22.170 16.818 21.668 1.00 . A A . 2 CYS N    1 1 
       18 1998 1 1 1 CYS O    O 19.879 15.811 20.745 1.00 . A A . 2 CYS O    1 1 
       18 1999 1 1 1 CYS SG   S 23.557 15.981 19.256 1.00 . A A . 2 CYS SG   1 1 
       18 2000 1 1 2 HYP C    C 19.595 20.188 20.362 1.00 . A A . 3 HYP C    1 1 
       18 2001 1 1 2 HYP CA   C 19.256 19.100 19.335 1.00 . A A . 3 HYP CA   1 1 
       18 2002 1 1 2 HYP CB   C 17.912 19.399 18.625 1.00 . A A . 3 HYP CB   1 1 
       18 2003 1 1 2 HYP CD   C 17.673 17.300 19.983 1.00 . A A . 3 HYP CD   1 1 
       18 2004 1 1 2 HYP CG   C 16.878 18.500 19.369 1.00 . A A . 3 HYP CG   1 1 
       18 2005 1 1 2 HYP HA   H 20.074 19.071 18.630 1.00 . A A . 3 HYP HA   1 1 
       18 2006 1 1 2 HYP HB2  H 17.964 19.210 17.566 1.00 . A A . 3 HYP HB2  1 1 
       18 2007 1 1 2 HYP HB3  H 17.632 20.430 18.753 1.00 . A A . 3 HYP HB3  1 1 
       18 2008 1 1 2 HYP HD1  H 16.518 17.562 17.702 1.00 . A A . 3 HYP HD1  1 1 
       18 2009 1 1 2 HYP HD22 H 17.563 16.392 19.405 1.00 . A A . 3 HYP HD22 1 1 
       18 2010 1 1 2 HYP HD23 H 17.388 17.120 21.012 1.00 . A A . 3 HYP HD23 1 1 
       18 2011 1 1 2 HYP HG   H 16.347 19.059 20.130 1.00 . A A . 3 HYP HG   1 1 
       18 2012 1 1 2 HYP N    N 19.096 17.739 19.943 1.00 . A A . 3 HYP N    1 1 
       18 2013 1 1 2 HYP O    O 18.767 20.512 21.187 1.00 . A A . 3 HYP O    1 1 
       18 2014 1 1 2 HYP OD1  O 15.988 17.992 18.383 1.00 . A A . 3 HYP OD1  1 1 
       18 2015 1 1 3 DTR C    C 22.445 22.446 20.440 1.00 . A A . 4 DTR C    1 1 
       18 2016 1 1 3 DTR CA   C 21.318 21.751 21.213 1.00 . A A . 4 DTR CA   1 1 
       18 2017 1 1 3 DTR CB   C 20.229 22.839 21.570 1.00 . A A . 4 DTR CB   1 1 
       18 2018 1 1 3 DTR CD1  C 18.536 22.954 19.655 1.00 . A A . 4 DTR CD1  1 1 
       18 2019 1 1 3 DTR CD2  C 19.839 24.694 19.815 1.00 . A A . 4 DTR CD2  1 1 
       18 2020 1 1 3 DTR CE2  C 19.009 24.947 18.730 1.00 . A A . 4 DTR CE2  1 1 
       18 2021 1 1 3 DTR CE3  C 20.799 25.616 20.198 1.00 . A A . 4 DTR CE3  1 1 
       18 2022 1 1 3 DTR CG   C 19.545 23.501 20.356 1.00 . A A . 4 DTR CG   1 1 
       18 2023 1 1 3 DTR CH2  C 20.114 27.073 18.403 1.00 . A A . 4 DTR CH2  1 1 
       18 2024 1 1 3 DTR CZ2  C 19.151 26.140 18.024 1.00 . A A . 4 DTR CZ2  1 1 
       18 2025 1 1 3 DTR CZ3  C 20.943 26.809 19.495 1.00 . A A . 4 DTR CZ3  1 1 
       18 2026 1 1 3 DTR H    H 21.422 20.342 19.631 1.00 . A A . 4 DTR H    1 1 
       18 2027 1 1 3 DTR HA   H 21.657 21.347 22.134 1.00 . A A . 4 DTR HA   1 1 
       18 2028 1 1 3 DTR HB2  H 20.732 23.611 22.111 1.00 . A A . 4 DTR HB2  1 1 
       18 2029 1 1 3 DTR HB3  H 19.468 22.424 22.213 1.00 . A A . 4 DTR HB3  1 1 
       18 2030 1 1 3 DTR HD1  H 18.080 22.012 19.860 1.00 . A A . 4 DTR HD1  1 1 
       18 2031 1 1 3 DTR HE1  H 17.566 23.707 18.047 1.00 . A A . 4 DTR HE1  1 1 
       18 2032 1 1 3 DTR HE3  H 21.426 25.374 21.044 1.00 . A A . 4 DTR HE3  1 1 
       18 2033 1 1 3 DTR HH2  H 20.222 27.998 17.855 1.00 . A A . 4 DTR HH2  1 1 
       18 2034 1 1 3 DTR HZ2  H 18.509 26.339 17.180 1.00 . A A . 4 DTR HZ2  1 1 
       18 2035 1 1 3 DTR HZ3  H 21.691 27.526 19.796 1.00 . A A . 4 DTR HZ3  1 1 
       18 2036 1 1 3 DTR N    N 20.804 20.676 20.312 1.00 . A A . 4 DTR N    1 1 
       18 2037 1 1 3 DTR NE1  N 18.272 23.846 18.720 1.00 . A A . 4 DTR NE1  1 1 
       18 2038 1 1 3 DTR O    O 22.348 23.473 19.809 1.00 . A A . 4 DTR O    1 1 
       18 2039 1 1 4 GLN C    C 25.058 21.408 18.655 1.00 . A A . 5 GLN C    1 1 
       18 2040 1 1 4 GLN CA   C 24.770 22.337 19.812 1.00 . A A . 5 GLN CA   1 1 
       18 2041 1 1 4 GLN CB   C 25.994 22.360 20.722 1.00 . A A . 5 GLN CB   1 1 
       18 2042 1 1 4 GLN CD   C 24.892 24.029 22.376 1.00 . A A . 5 GLN CD   1 1 
       18 2043 1 1 4 GLN CG   C 26.090 23.679 21.478 1.00 . A A . 5 GLN CG   1 1 
       18 2044 1 1 4 GLN H    H 23.612 20.945 20.995 1.00 . A A . 5 GLN H    1 1 
       18 2045 1 1 4 GLN HA   H 24.565 23.337 19.482 1.00 . A A . 5 GLN HA   1 1 
       18 2046 1 1 4 GLN HB2  H 26.062 21.520 21.371 1.00 . A A . 5 GLN HB2  1 1 
       18 2047 1 1 4 GLN HB3  H 26.866 22.313 20.087 1.00 . A A . 5 GLN HB3  1 1 
       18 2048 1 1 4 GLN HE21 H 23.636 24.543 20.911 1.00 . A A . 5 GLN HE21 1 1 
       18 2049 1 1 4 GLN HE22 H 23.041 24.681 22.497 1.00 . A A . 5 GLN HE22 1 1 
       18 2050 1 1 4 GLN HG2  H 26.964 23.654 22.113 1.00 . A A . 5 GLN HG2  1 1 
       18 2051 1 1 4 GLN HG3  H 26.231 24.420 20.708 1.00 . A A . 5 GLN HG3  1 1 
       18 2052 1 1 4 GLN N    N 23.569 21.793 20.505 1.00 . A A . 5 GLN N    1 1 
       18 2053 1 1 4 GLN NE2  N 23.771 24.451 21.880 1.00 . A A . 5 GLN NE2  1 1 
       18 2054 1 1 4 GLN O    O 25.301 20.242 18.884 1.00 . A A . 5 GLN O    1 1 
       18 2055 1 1 4 GLN OE1  O 24.966 23.929 23.583 1.00 . A A . 5 GLN OE1  1 1 
       18 2056 1 1 5 PRO C    C 26.422 20.370 16.027 1.00 . A A . 6 PRO C    1 1 
       18 2057 1 1 5 PRO CA   C 25.036 20.997 16.276 1.00 . A A . 6 PRO CA   1 1 
       18 2058 1 1 5 PRO CB   C 24.510 21.887 15.143 1.00 . A A . 6 PRO CB   1 1 
       18 2059 1 1 5 PRO CD   C 25.045 23.345 17.104 1.00 . A A . 6 PRO CD   1 1 
       18 2060 1 1 5 PRO CG   C 24.677 23.372 15.605 1.00 . A A . 6 PRO CG   1 1 
       18 2061 1 1 5 PRO HA   H 24.346 20.187 16.475 1.00 . A A . 6 PRO HA   1 1 
       18 2062 1 1 5 PRO HB2  H 25.008 21.678 14.204 1.00 . A A . 6 PRO HB2  1 1 
       18 2063 1 1 5 PRO HB3  H 23.454 21.654 15.070 1.00 . A A . 6 PRO HB3  1 1 
       18 2064 1 1 5 PRO HD2  H 26.025 23.769 17.282 1.00 . A A . 6 PRO HD2  1 1 
       18 2065 1 1 5 PRO HD3  H 24.313 23.850 17.714 1.00 . A A . 6 PRO HD3  1 1 
       18 2066 1 1 5 PRO HG2  H 25.447 23.868 15.029 1.00 . A A . 6 PRO HG2  1 1 
       18 2067 1 1 5 PRO HG3  H 23.754 23.913 15.468 1.00 . A A . 6 PRO HG3  1 1 
       18 2068 1 1 5 PRO N    N 25.047 21.897 17.446 1.00 . A A . 6 PRO N    1 1 
       18 2069 1 1 5 PRO O    O 26.701 19.857 14.958 1.00 . A A . 6 PRO O    1 1 
       18 2070 1 1 6 TRP C    C 28.766 18.833 18.018 1.00 . A A . 7 TRP C    1 1 
       18 2071 1 1 6 TRP CA   C 28.630 19.858 16.902 1.00 . A A . 7 TRP CA   1 1 
       18 2072 1 1 6 TRP CB   C 29.716 20.928 17.096 1.00 . A A . 7 TRP CB   1 1 
       18 2073 1 1 6 TRP CD1  C 30.637 20.640 19.474 1.00 . A A . 7 TRP CD1  1 1 
       18 2074 1 1 6 TRP CD2  C 29.462 22.445 19.169 1.00 . A A . 7 TRP CD2  1 1 
       18 2075 1 1 6 TRP CE2  C 29.881 22.512 20.485 1.00 . A A . 7 TRP CE2  1 1 
       18 2076 1 1 6 TRP CE3  C 28.685 23.430 18.625 1.00 . A A . 7 TRP CE3  1 1 
       18 2077 1 1 6 TRP CG   C 29.917 21.338 18.572 1.00 . A A . 7 TRP CG   1 1 
       18 2078 1 1 6 TRP CH2  C 28.738 24.615 20.717 1.00 . A A . 7 TRP CH2  1 1 
       18 2079 1 1 6 TRP CZ2  C 29.519 23.605 21.262 1.00 . A A . 7 TRP CZ2  1 1 
       18 2080 1 1 6 TRP CZ3  C 28.316 24.526 19.392 1.00 . A A . 7 TRP CZ3  1 1 
       18 2081 1 1 6 TRP H    H 27.017 20.908 17.859 1.00 . A A . 7 TRP H    1 1 
       18 2082 1 1 6 TRP HA   H 28.738 19.346 15.965 1.00 . A A . 7 TRP HA   1 1 
       18 2083 1 1 6 TRP HB2  H 30.650 20.519 16.747 1.00 . A A . 7 TRP HB2  1 1 
       18 2084 1 1 6 TRP HB3  H 29.516 21.807 16.516 1.00 . A A . 7 TRP HB3  1 1 
       18 2085 1 1 6 TRP HD1  H 31.131 19.700 19.306 1.00 . A A . 7 TRP HD1  1 1 
       18 2086 1 1 6 TRP HE1  H 31.003 21.116 21.403 1.00 . A A . 7 TRP HE1  1 1 
       18 2087 1 1 6 TRP HE3  H 28.362 23.299 17.609 1.00 . A A . 7 TRP HE3  1 1 
       18 2088 1 1 6 TRP HH2  H 28.463 25.466 21.320 1.00 . A A . 7 TRP HH2  1 1 
       18 2089 1 1 6 TRP HZ2  H 29.843 23.675 22.293 1.00 . A A . 7 TRP HZ2  1 1 
       18 2090 1 1 6 TRP HZ3  H 27.693 25.299 18.973 1.00 . A A . 7 TRP HZ3  1 1 
       18 2091 1 1 6 TRP N    N 27.266 20.450 17.021 1.00 . A A . 7 TRP N    1 1 
       18 2092 1 1 6 TRP NE1  N 30.569 21.391 20.562 1.00 . A A . 7 TRP NE1  1 1 
       18 2093 1 1 6 TRP O    O 29.801 18.218 18.169 1.00 . A A . 7 TRP O    1 1 
       18 2094 1 1 7 .   C    C 28.527 16.529 19.784 1.00 . A A . 8 CY3 C    1 1 
       18 2095 1 1 7 .   CA   C 27.616 17.762 19.895 1.00 . A A . 8 CY3 CA   1 1 
       18 2096 1 1 7 .   CB   C 26.142 17.322 20.054 1.00 . A A . 8 CY3 CB   1 1 
       18 2097 1 1 7 .   H    H 26.885 19.209 18.536 1.00 . A A . 8 CY3 H    1 1 
       18 2098 1 1 7 .   HA   H 27.954 18.390 20.715 1.00 . A A . 8 CY3 HA   1 1 
       18 2099 1 1 7 .   HB2  H 25.593 18.130 20.512 1.00 . A A . 8 CY3 HB2  1 1 
       18 2100 1 1 7 .   HB3  H 26.111 16.482 20.733 1.00 . A A . 8 CY3 HB3  1 1 
       18 2101 1 1 7 .   HN11 H 27.770 16.019 18.037 1.00 . A A . 8 CY3 HN11 1 1 
       18 2102 1 1 7 .   HN12 H 28.992 14.998 18.618 1.00 . A A . 8 CY3 HN12 1 1 
       18 2103 1 1 7 .   N    N 27.691 18.695 18.746 1.00 . A A . 8 CY3 N    1 1 
       18 2104 1 1 7 .   N1   N 28.422 15.779 18.730 1.00 . A A . 8 CY3 N1   1 1 
       18 2105 1 1 7 .   O    O 29.337 16.227 20.644 1.00 . A A . 8 CY3 O    1 1 
       18 2106 1 1 7 .   SG   S 25.248 16.838 18.555 1.00 . A A . 8 CY3 SG   1 1 
       19 2107 1 1 1 CYS C    C 20.211 17.052 20.605 1.00 . A A . 2 CYS C    1 1 
       19 2108 1 1 1 CYS CA   C 21.674 17.527 20.414 1.00 . A A . 2 CYS CA   1 1 
       19 2109 1 1 1 CYS CB   C 22.188 17.231 18.977 1.00 . A A . 2 CYS CB   1 1 
       19 2110 1 1 1 CYS H1   H 22.111 16.209 22.037 1.00 . A A . 2 CYS H1   1 1 
       19 2111 1 1 1 CYS HA   H 21.739 18.571 20.654 1.00 . A A . 2 CYS HA   1 1 
       19 2112 1 1 1 CYS HB2  H 21.348 16.927 18.363 1.00 . A A . 2 CYS HB2  1 1 
       19 2113 1 1 1 CYS HB3  H 22.569 18.153 18.562 1.00 . A A . 2 CYS HB3  1 1 
       19 2114 1 1 1 CYS N    N 22.544 16.786 21.370 1.00 . A A . 2 CYS N    1 1 
       19 2115 1 1 1 CYS O    O 20.022 16.034 21.247 1.00 . A A . 2 CYS O    1 1 
       19 2116 1 1 1 CYS SG   S 23.482 15.982 18.756 1.00 . A A . 2 CYS SG   1 1 
       19 2117 1 1 2 HYP C    C 19.635 20.206 20.277 1.00 . A A . 3 HYP C    1 1 
       19 2118 1 1 2 HYP CA   C 19.366 19.036 19.316 1.00 . A A . 3 HYP CA   1 1 
       19 2119 1 1 2 HYP CB   C 18.042 19.226 18.555 1.00 . A A . 3 HYP CB   1 1 
       19 2120 1 1 2 HYP CD   C 17.820 17.300 20.186 1.00 . A A . 3 HYP CD   1 1 
       19 2121 1 1 2 HYP CG   C 17.037 18.244 19.222 1.00 . A A . 3 HYP CG   1 1 
       19 2122 1 1 2 HYP HA   H 20.185 18.957 18.616 1.00 . A A . 3 HYP HA   1 1 
       19 2123 1 1 2 HYP HB2  H 18.168 19.088 17.491 1.00 . A A . 3 HYP HB2  1 1 
       19 2124 1 1 2 HYP HB3  H 17.672 20.224 18.705 1.00 . A A . 3 HYP HB3  1 1 
       19 2125 1 1 2 HYP HD1  H 16.139 18.016 17.505 1.00 . A A . 3 HYP HD1  1 1 
       19 2126 1 1 2 HYP HD22 H 17.741 16.258 19.908 1.00 . A A . 3 HYP HD22 1 1 
       19 2127 1 1 2 HYP HD23 H 17.496 17.432 21.208 1.00 . A A . 3 HYP HD23 1 1 
       19 2128 1 1 2 HYP HG   H 16.240 18.776 19.733 1.00 . A A . 3 HYP HG   1 1 
       19 2129 1 1 2 HYP N    N 19.228 17.751 20.073 1.00 . A A . 3 HYP N    1 1 
       19 2130 1 1 2 HYP O    O 18.747 20.580 21.013 1.00 . A A . 3 HYP O    1 1 
       19 2131 1 1 2 HYP OD1  O 16.538 17.438 18.166 1.00 . A A . 3 HYP OD1  1 1 
       19 2132 1 1 3 DTR C    C 22.438 22.511 20.370 1.00 . A A . 4 DTR C    1 1 
       19 2133 1 1 3 DTR CA   C 21.280 21.860 21.124 1.00 . A A . 4 DTR CA   1 1 
       19 2134 1 1 3 DTR CB   C 20.159 22.945 21.335 1.00 . A A . 4 DTR CB   1 1 
       19 2135 1 1 3 DTR CD1  C 18.599 22.935 19.314 1.00 . A A . 4 DTR CD1  1 1 
       19 2136 1 1 3 DTR CD2  C 19.823 24.727 19.492 1.00 . A A . 4 DTR CD2  1 1 
       19 2137 1 1 3 DTR CE2  C 19.053 24.918 18.353 1.00 . A A . 4 DTR CE2  1 1 
       19 2138 1 1 3 DTR CE3  C 20.730 25.690 19.909 1.00 . A A . 4 DTR CE3  1 1 
       19 2139 1 1 3 DTR CG   C 19.542 23.538 20.056 1.00 . A A . 4 DTR CG   1 1 
       19 2140 1 1 3 DTR CH2  C 20.098 27.070 18.037 1.00 . A A . 4 DTR CH2  1 1 
       19 2141 1 1 3 DTR CZ2  C 19.190 26.093 17.623 1.00 . A A . 4 DTR CZ2  1 1 
       19 2142 1 1 3 DTR CZ3  C 20.870 26.871 19.180 1.00 . A A . 4 DTR CZ3  1 1 
       19 2143 1 1 3 DTR H    H 21.510 20.349 19.657 1.00 . A A . 4 DTR H    1 1 
       19 2144 1 1 3 DTR HA   H 21.578 21.536 22.089 1.00 . A A . 4 DTR HA   1 1 
       19 2145 1 1 3 DTR HB2  H 20.626 23.749 21.865 1.00 . A A . 4 DTR HB2  1 1 
       19 2146 1 1 3 DTR HB3  H 19.367 22.564 21.961 1.00 . A A . 4 DTR HB3  1 1 
       19 2147 1 1 3 DTR HD1  H 18.167 21.980 19.521 1.00 . A A . 4 DTR HD1  1 1 
       19 2148 1 1 3 DTR HE1  H 17.703 23.598 17.633 1.00 . A A . 4 DTR HE1  1 1 
       19 2149 1 1 3 DTR HE3  H 21.319 25.487 20.796 1.00 . A A . 4 DTR HE3  1 1 
       19 2150 1 1 3 DTR HH2  H 20.198 27.980 17.464 1.00 . A A . 4 DTR HH2  1 1 
       19 2151 1 1 3 DTR HZ2  H 18.591 26.246 16.737 1.00 . A A . 4 DTR HZ2  1 1 
       19 2152 1 1 3 DTR HZ3  H 21.570 27.633 19.489 1.00 . A A . 4 DTR HZ3  1 1 
       19 2153 1 1 3 DTR N    N 20.839 20.712 20.270 1.00 . A A . 4 DTR N    1 1 
       19 2154 1 1 3 DTR NE1  N 18.359 23.790 18.338 1.00 . A A . 4 DTR NE1  1 1 
       19 2155 1 1 3 DTR O    O 22.383 23.520 19.697 1.00 . A A . 4 DTR O    1 1 
       19 2156 1 1 4 GLN C    C 24.986 21.371 18.666 1.00 . A A . 5 GLN C    1 1 
       19 2157 1 1 4 GLN CA   C 24.783 22.293 19.855 1.00 . A A . 5 GLN CA   1 1 
       19 2158 1 1 4 GLN CB   C 25.988 22.135 20.755 1.00 . A A . 5 GLN CB   1 1 
       19 2159 1 1 4 GLN CD   C 24.805 23.381 22.619 1.00 . A A . 5 GLN CD   1 1 
       19 2160 1 1 4 GLN CG   C 26.056 23.268 21.755 1.00 . A A . 5 GLN CG   1 1 
       19 2161 1 1 4 GLN H    H 23.538 21.006 21.040 1.00 . A A . 5 GLN H    1 1 
       19 2162 1 1 4 GLN HA   H 24.676 23.324 19.560 1.00 . A A . 5 GLN HA   1 1 
       19 2163 1 1 4 GLN HB2  H 26.020 21.175 21.209 1.00 . A A . 5 GLN HB2  1 1 
       19 2164 1 1 4 GLN HB3  H 26.851 22.202 20.118 1.00 . A A . 5 GLN HB3  1 1 
       19 2165 1 1 4 GLN HE21 H 24.913 21.525 23.292 1.00 . A A . 5 GLN HE21 1 1 
       19 2166 1 1 4 GLN HE22 H 23.587 22.422 23.846 1.00 . A A . 5 GLN HE22 1 1 
       19 2167 1 1 4 GLN HG2  H 26.923 23.173 22.394 1.00 . A A . 5 GLN HG2  1 1 
       19 2168 1 1 4 GLN HG3  H 26.166 24.137 21.131 1.00 . A A . 5 GLN HG3  1 1 
       19 2169 1 1 4 GLN N    N 23.537 21.828 20.509 1.00 . A A . 5 GLN N    1 1 
       19 2170 1 1 4 GLN NE2  N 24.404 22.360 23.305 1.00 . A A . 5 GLN NE2  1 1 
       19 2171 1 1 4 GLN O    O 25.140 20.185 18.868 1.00 . A A . 5 GLN O    1 1 
       19 2172 1 1 4 GLN OE1  O 24.172 24.414 22.676 1.00 . A A . 5 GLN OE1  1 1 
       19 2173 1 1 5 PRO C    C 26.398 20.400 16.061 1.00 . A A . 6 PRO C    1 1 
       19 2174 1 1 5 PRO CA   C 25.001 21.018 16.288 1.00 . A A . 6 PRO CA   1 1 
       19 2175 1 1 5 PRO CB   C 24.495 21.930 15.166 1.00 . A A . 6 PRO CB   1 1 
       19 2176 1 1 5 PRO CD   C 24.999 23.346 17.165 1.00 . A A . 6 PRO CD   1 1 
       19 2177 1 1 5 PRO CG   C 24.646 23.414 15.663 1.00 . A A . 6 PRO CG   1 1 
       19 2178 1 1 5 PRO HA   H 24.304 20.207 16.460 1.00 . A A . 6 PRO HA   1 1 
       19 2179 1 1 5 PRO HB2  H 25.012 21.743 14.235 1.00 . A A . 6 PRO HB2  1 1 
       19 2180 1 1 5 PRO HB3  H 23.443 21.698 15.061 1.00 . A A . 6 PRO HB3  1 1 
       19 2181 1 1 5 PRO HD2  H 25.976 23.760 17.357 1.00 . A A . 6 PRO HD2  1 1 
       19 2182 1 1 5 PRO HD3  H 24.274 23.831 17.799 1.00 . A A . 6 PRO HD3  1 1 
       19 2183 1 1 5 PRO HG2  H 25.419 23.925 15.104 1.00 . A A . 6 PRO HG2  1 1 
       19 2184 1 1 5 PRO HG3  H 23.718 23.947 15.524 1.00 . A A . 6 PRO HG3  1 1 
       19 2185 1 1 5 PRO N    N 24.996 21.894 17.466 1.00 . A A . 6 PRO N    1 1 
       19 2186 1 1 5 PRO O    O 26.717 19.917 14.989 1.00 . A A . 6 PRO O    1 1 
       19 2187 1 1 6 TRP C    C 28.665 18.803 18.086 1.00 . A A . 7 TRP C    1 1 
       19 2188 1 1 6 TRP CA   C 28.567 19.877 17.014 1.00 . A A . 7 TRP CA   1 1 
       19 2189 1 1 6 TRP CB   C 29.619 20.965 17.279 1.00 . A A . 7 TRP CB   1 1 
       19 2190 1 1 6 TRP CD1  C 30.525 20.529 19.625 1.00 . A A . 7 TRP CD1  1 1 
       19 2191 1 1 6 TRP CD2  C 29.392 22.370 19.429 1.00 . A A . 7 TRP CD2  1 1 
       19 2192 1 1 6 TRP CE2  C 29.820 22.347 20.746 1.00 . A A . 7 TRP CE2  1 1 
       19 2193 1 1 6 TRP CE3  C 28.625 23.406 18.950 1.00 . A A . 7 TRP CE3  1 1 
       19 2194 1 1 6 TRP CG   C 29.820 21.291 18.766 1.00 . A A . 7 TRP CG   1 1 
       19 2195 1 1 6 TRP CH2  C 28.709 24.450 21.119 1.00 . A A . 7 TRP CH2  1 1 
       19 2196 1 1 6 TRP CZ2  C 29.481 23.392 21.600 1.00 . A A . 7 TRP CZ2  1 1 
       19 2197 1 1 6 TRP CZ3  C 28.279 24.455 19.793 1.00 . A A . 7 TRP CZ3  1 1 
       19 2198 1 1 6 TRP H    H 26.922 20.893 17.935 1.00 . A A . 7 TRP H    1 1 
       19 2199 1 1 6 TRP HA   H 28.717 19.405 16.056 1.00 . A A . 7 TRP HA   1 1 
       19 2200 1 1 6 TRP HB2  H 30.570 20.618 16.901 1.00 . A A . 7 TRP HB2  1 1 
       19 2201 1 1 6 TRP HB3  H 29.391 21.868 16.756 1.00 . A A . 7 TRP HB3  1 1 
       19 2202 1 1 6 TRP HD1  H 30.990 19.584 19.413 1.00 . A A . 7 TRP HD1  1 1 
       19 2203 1 1 6 TRP HE1  H 30.924 20.874 21.560 1.00 . A A . 7 TRP HE1  1 1 
       19 2204 1 1 6 TRP HE3  H 28.288 23.356 17.931 1.00 . A A . 7 TRP HE3  1 1 
       19 2205 1 1 6 TRP HH2  H 28.449 25.265 21.782 1.00 . A A . 7 TRP HH2  1 1 
       19 2206 1 1 6 TRP HZ2  H 29.812 23.391 22.633 1.00 . A A . 7 TRP HZ2  1 1 
       19 2207 1 1 6 TRP HZ3  H 27.669 25.268 19.432 1.00 . A A . 7 TRP HZ3  1 1 
       19 2208 1 1 6 TRP N    N 27.199 20.459 17.092 1.00 . A A . 7 TRP N    1 1 
       19 2209 1 1 6 TRP NE1  N 30.482 21.209 20.751 1.00 . A A . 7 TRP NE1  1 1 
       19 2210 1 1 6 TRP O    O 29.687 18.167 18.231 1.00 . A A . 7 TRP O    1 1 
       19 2211 1 1 7 .   C    C 28.291 16.428 19.816 1.00 . A A . 8 CY3 C    1 1 
       19 2212 1 1 7 .   CA   C 27.426 17.691 19.882 1.00 . A A . 8 CY3 CA   1 1 
       19 2213 1 1 7 .   CB   C 25.937 17.310 19.938 1.00 . A A . 8 CY3 CB   1 1 
       19 2214 1 1 7 .   H    H 26.790 19.197 18.551 1.00 . A A . 8 CY3 H    1 1 
       19 2215 1 1 7 .   HA   H 27.742 18.283 20.730 1.00 . A A . 8 CY3 HA   1 1 
       19 2216 1 1 7 .   HB2  H 25.391 18.084 20.456 1.00 . A A . 8 CY3 HB2  1 1 
       19 2217 1 1 7 .   HB3  H 25.831 16.399 20.514 1.00 . A A . 8 CY3 HB3  1 1 
       19 2218 1 1 7 .   HN11 H 27.526 15.851 18.102 1.00 . A A . 8 CY3 HN11 1 1 
       19 2219 1 1 7 .   HN12 H 28.669 14.800 18.767 1.00 . A A . 8 CY3 HN12 1 1 
       19 2220 1 1 7 .   N    N 27.571 18.653 18.773 1.00 . A A . 8 CY3 N    1 1 
       19 2221 1 1 7 .   N1   N 28.162 15.632 18.806 1.00 . A A . 8 CY3 N1   1 1 
       19 2222 1 1 7 .   O    O 29.089 16.140 20.686 1.00 . A A . 8 CY3 O    1 1 
       19 2223 1 1 7 .   SG   S 25.145 17.043 18.330 1.00 . A A . 8 CY3 SG   1 1 
       20 2224 1 1 1 CYS C    C 20.235 17.048 20.306 1.00 . A A . 2 CYS C    1 1 
       20 2225 1 1 1 CYS CA   C 21.630 17.640 19.961 1.00 . A A . 2 CYS CA   1 1 
       20 2226 1 1 1 CYS CB   C 22.455 16.627 19.121 1.00 . A A . 2 CYS CB   1 1 
       20 2227 1 1 1 CYS H1   H 22.608 17.236 21.817 1.00 . A A . 2 CYS H1   1 1 
       20 2228 1 1 1 CYS HA   H 21.533 18.530 19.369 1.00 . A A . 2 CYS HA   1 1 
       20 2229 1 1 1 CYS HB2  H 21.766 15.930 18.660 1.00 . A A . 2 CYS HB2  1 1 
       20 2230 1 1 1 CYS HB3  H 22.932 17.176 18.323 1.00 . A A . 2 CYS HB3  1 1 
       20 2231 1 1 1 CYS N    N 22.400 17.963 21.191 1.00 . A A . 2 CYS N    1 1 
       20 2232 1 1 1 CYS O    O 20.199 15.960 20.857 1.00 . A A . 2 CYS O    1 1 
       20 2233 1 1 1 CYS SG   S 23.745 15.640 19.919 1.00 . A A . 2 CYS SG   1 1 
       20 2234 1 1 2 HYP C    C 19.509 20.194 20.500 1.00 . A A . 3 HYP C    1 1 
       20 2235 1 1 2 HYP CA   C 19.130 19.136 19.453 1.00 . A A . 3 HYP CA   1 1 
       20 2236 1 1 2 HYP CB   C 17.701 19.379 18.934 1.00 . A A . 3 HYP CB   1 1 
       20 2237 1 1 2 HYP CD   C 17.780 17.172 20.145 1.00 . A A . 3 HYP CD   1 1 
       20 2238 1 1 2 HYP CG   C 16.823 18.296 19.612 1.00 . A A . 3 HYP CG   1 1 
       20 2239 1 1 2 HYP HA   H 19.825 19.216 18.630 1.00 . A A . 3 HYP HA   1 1 
       20 2240 1 1 2 HYP HB2  H 17.688 19.361 17.854 1.00 . A A . 3 HYP HB2  1 1 
       20 2241 1 1 2 HYP HB3  H 17.341 20.349 19.249 1.00 . A A . 3 HYP HB3  1 1 
       20 2242 1 1 2 HYP HD1  H 16.576 17.379 17.915 1.00 . A A . 3 HYP HD1  1 1 
       20 2243 1 1 2 HYP HD22 H 17.703 16.256 19.584 1.00 . A A . 3 HYP HD22 1 1 
       20 2244 1 1 2 HYP HD23 H 17.604 16.974 21.198 1.00 . A A . 3 HYP HD23 1 1 
       20 2245 1 1 2 HYP HG   H 16.231 18.727 20.415 1.00 . A A . 3 HYP HG   1 1 
       20 2246 1 1 2 HYP N    N 19.152 17.739 19.992 1.00 . A A . 3 HYP N    1 1 
       20 2247 1 1 2 HYP O    O 18.693 20.548 21.325 1.00 . A A . 3 HYP O    1 1 
       20 2248 1 1 2 HYP OD1  O 15.999 17.768 18.579 1.00 . A A . 3 HYP OD1  1 1 
       20 2249 1 1 3 DTR C    C 22.450 22.323 20.583 1.00 . A A . 4 DTR C    1 1 
       20 2250 1 1 3 DTR CA   C 21.304 21.664 21.357 1.00 . A A . 4 DTR CA   1 1 
       20 2251 1 1 3 DTR CB   C 20.262 22.788 21.737 1.00 . A A . 4 DTR CB   1 1 
       20 2252 1 1 3 DTR CD1  C 18.653 23.030 19.765 1.00 . A A . 4 DTR CD1  1 1 
       20 2253 1 1 3 DTR CD2  C 19.981 24.737 20.059 1.00 . A A . 4 DTR CD2  1 1 
       20 2254 1 1 3 DTR CE2  C 19.204 25.056 18.957 1.00 . A A . 4 DTR CE2  1 1 
       20 2255 1 1 3 DTR CE3  C 20.944 25.615 20.528 1.00 . A A . 4 DTR CE3  1 1 
       20 2256 1 1 3 DTR CG   C 19.642 23.522 20.531 1.00 . A A . 4 DTR CG   1 1 
       20 2257 1 1 3 DTR CH2  C 20.365 27.168 18.779 1.00 . A A . 4 DTR CH2  1 1 
       20 2258 1 1 3 DTR CZ2  C 19.399 26.275 18.317 1.00 . A A . 4 DTR CZ2  1 1 
       20 2259 1 1 3 DTR CZ3  C 21.141 26.836 19.890 1.00 . A A . 4 DTR CZ3  1 1 
       20 2260 1 1 3 DTR H    H 21.341 20.276 19.761 1.00 . A A . 4 DTR H    1 1 
       20 2261 1 1 3 DTR HA   H 21.649 21.235 22.267 1.00 . A A . 4 DTR HA   1 1 
       20 2262 1 1 3 DTR HB2  H 20.795 23.515 22.309 1.00 . A A . 4 DTR HB2  1 1 
       20 2263 1 1 3 DTR HB3  H 19.472 22.397 22.359 1.00 . A A . 4 DTR HB3  1 1 
       20 2264 1 1 3 DTR HD1  H 18.174 22.085 19.901 1.00 . A A . 4 DTR HD1  1 1 
       20 2265 1 1 3 DTR HE1  H 17.768 23.879 18.161 1.00 . A A . 4 DTR HE1  1 1 
       20 2266 1 1 3 DTR HE3  H 21.526 25.315 21.389 1.00 . A A . 4 DTR HE3  1 1 
       20 2267 1 1 3 DTR HH2  H 20.508 28.113 18.275 1.00 . A A . 4 DTR HH2  1 1 
       20 2268 1 1 3 DTR HZ2  H 18.797 26.527 17.458 1.00 . A A . 4 DTR HZ2  1 1 
       20 2269 1 1 3 DTR HZ3  H 21.889 27.524 20.251 1.00 . A A . 4 DTR HZ3  1 1 
       20 2270 1 1 3 DTR N    N 20.740 20.626 20.445 1.00 . A A . 4 DTR N    1 1 
       20 2271 1 1 3 DTR NE1  N 18.449 23.974 18.868 1.00 . A A . 4 DTR NE1  1 1 
       20 2272 1 1 3 DTR O    O 22.402 23.403 20.039 1.00 . A A . 4 DTR O    1 1 
       20 2273 1 1 4 GLN C    C 24.966 21.196 18.667 1.00 . A A . 5 GLN C    1 1 
       20 2274 1 1 4 GLN CA   C 24.727 22.120 19.832 1.00 . A A . 5 GLN CA   1 1 
       20 2275 1 1 4 GLN CB   C 25.969 22.105 20.705 1.00 . A A . 5 GLN CB   1 1 
       20 2276 1 1 4 GLN CD   C 24.867 23.472 22.567 1.00 . A A . 5 GLN CD   1 1 
       20 2277 1 1 4 GLN CG   C 26.019 23.345 21.572 1.00 . A A . 5 GLN CG   1 1 
       20 2278 1 1 4 GLN H    H 23.540 20.716 20.978 1.00 . A A . 5 GLN H    1 1 
       20 2279 1 1 4 GLN HA   H 24.546 23.128 19.516 1.00 . A A . 5 GLN HA   1 1 
       20 2280 1 1 4 GLN HB2  H 26.072 21.215 21.271 1.00 . A A . 5 GLN HB2  1 1 
       20 2281 1 1 4 GLN HB3  H 26.823 22.138 20.050 1.00 . A A . 5 GLN HB3  1 1 
       20 2282 1 1 4 GLN HE21 H 23.607 24.381 21.324 1.00 . A A . 5 GLN HE21 1 1 
       20 2283 1 1 4 GLN HE22 H 23.044 24.124 22.909 1.00 . A A . 5 GLN HE22 1 1 
       20 2284 1 1 4 GLN HG2  H 26.940 23.340 22.144 1.00 . A A . 5 GLN HG2  1 1 
       20 2285 1 1 4 GLN HG3  H 26.029 24.161 20.877 1.00 . A A . 5 GLN HG3  1 1 
       20 2286 1 1 4 GLN N    N 23.530 21.598 20.548 1.00 . A A . 5 GLN N    1 1 
       20 2287 1 1 4 GLN NE2  N 23.752 24.041 22.237 1.00 . A A . 5 GLN NE2  1 1 
       20 2288 1 1 4 GLN O    O 25.189 20.024 18.869 1.00 . A A . 5 GLN O    1 1 
       20 2289 1 1 4 GLN OE1  O 24.967 23.050 23.699 1.00 . A A . 5 GLN OE1  1 1 
       20 2290 1 1 5 PRO C    C 26.371 20.265 16.036 1.00 . A A . 6 PRO C    1 1 
       20 2291 1 1 5 PRO CA   C 24.961 20.808 16.291 1.00 . A A . 6 PRO CA   1 1 
       20 2292 1 1 5 PRO CB   C 24.373 21.673 15.175 1.00 . A A . 6 PRO CB   1 1 
       20 2293 1 1 5 PRO CD   C 24.877 23.144 17.130 1.00 . A A . 6 PRO CD   1 1 
       20 2294 1 1 5 PRO CG   C 24.480 23.170 15.641 1.00 . A A . 6 PRO CG   1 1 
       20 2295 1 1 5 PRO HA   H 24.329 19.960 16.498 1.00 . A A . 6 PRO HA   1 1 
       20 2296 1 1 5 PRO HB2  H 24.853 21.496 14.220 1.00 . A A . 6 PRO HB2  1 1 
       20 2297 1 1 5 PRO HB3  H 23.323 21.409 15.124 1.00 . A A . 6 PRO HB3  1 1 
       20 2298 1 1 5 PRO HD2  H 25.843 23.603 17.286 1.00 . A A . 6 PRO HD2  1 1 
       20 2299 1 1 5 PRO HD3  H 24.149 23.621 17.759 1.00 . A A . 6 PRO HD3  1 1 
       20 2300 1 1 5 PRO HG2  H 25.219 23.706 15.057 1.00 . A A . 6 PRO HG2  1 1 
       20 2301 1 1 5 PRO HG3  H 23.526 23.667 15.529 1.00 . A A . 6 PRO HG3  1 1 
       20 2302 1 1 5 PRO N    N 24.938 21.700 17.461 1.00 . A A . 6 PRO N    1 1 
       20 2303 1 1 5 PRO O    O 26.696 19.797 14.956 1.00 . A A . 6 PRO O    1 1 
       20 2304 1 1 6 TRP C    C 28.764 18.855 18.075 1.00 . A A . 7 TRP C    1 1 
       20 2305 1 1 6 TRP CA   C 28.588 19.853 16.940 1.00 . A A . 7 TRP CA   1 1 
       20 2306 1 1 6 TRP CB   C 29.595 21.005 17.110 1.00 . A A . 7 TRP CB   1 1 
       20 2307 1 1 6 TRP CD1  C 30.607 20.783 19.445 1.00 . A A . 7 TRP CD1  1 1 
       20 2308 1 1 6 TRP CD2  C 29.317 22.516 19.179 1.00 . A A . 7 TRP CD2  1 1 
       20 2309 1 1 6 TRP CE2  C 29.785 22.607 20.479 1.00 . A A . 7 TRP CE2  1 1 
       20 2310 1 1 6 TRP CE3  C 28.453 23.454 18.668 1.00 . A A . 7 TRP CE3  1 1 
       20 2311 1 1 6 TRP CG   C 29.814 21.433 18.572 1.00 . A A . 7 TRP CG   1 1 
       20 2312 1 1 6 TRP CH2  C 28.517 24.636 20.762 1.00 . A A . 7 TRP CH2  1 1 
       20 2313 1 1 6 TRP CZ2  C 29.387 23.672 21.279 1.00 . A A . 7 TRP CZ2  1 1 
       20 2314 1 1 6 TRP CZ3  C 28.045 24.521 19.453 1.00 . A A . 7 TRP CZ3  1 1 
       20 2315 1 1 6 TRP H    H 26.914 20.783 17.891 1.00 . A A . 7 TRP H    1 1 
       20 2316 1 1 6 TRP HA   H 28.727 19.319 16.015 1.00 . A A . 7 TRP HA   1 1 
       20 2317 1 1 6 TRP HB2  H 30.547 20.675 16.728 1.00 . A A . 7 TRP HB2  1 1 
       20 2318 1 1 6 TRP HB3  H 29.300 21.864 16.541 1.00 . A A . 7 TRP HB3  1 1 
       20 2319 1 1 6 TRP HD1  H 31.135 19.866 19.259 1.00 . A A . 7 TRP HD1  1 1 
       20 2320 1 1 6 TRP HE1  H 31.015 21.278 21.348 1.00 . A A . 7 TRP HE1  1 1 
       20 2321 1 1 6 TRP HE3  H 28.104 23.303 17.666 1.00 . A A . 7 TRP HE3  1 1 
       20 2322 1 1 6 TRP HH2  H 28.216 25.472 21.383 1.00 . A A . 7 TRP HH2  1 1 
       20 2323 1 1 6 TRP HZ2  H 29.748 23.766 22.298 1.00 . A A . 7 TRP HZ2  1 1 
       20 2324 1 1 6 TRP HZ3  H 27.356 25.249 19.061 1.00 . A A . 7 TRP HZ3  1 1 
       20 2325 1 1 6 TRP N    N 27.193 20.363 17.042 1.00 . A A . 7 TRP N    1 1 
       20 2326 1 1 6 TRP NE1  N 30.539 21.526 20.531 1.00 . A A . 7 TRP NE1  1 1 
       20 2327 1 1 6 TRP O    O 29.817 18.266 18.222 1.00 . A A . 7 TRP O    1 1 
       20 2328 1 1 7 .   C    C 28.633 16.580 19.819 1.00 . A A . 8 CY3 C    1 1 
       20 2329 1 1 7 .   CA   C 27.702 17.784 19.997 1.00 . A A . 8 CY3 CA   1 1 
       20 2330 1 1 7 .   CB   C 26.244 17.297 20.244 1.00 . A A . 8 CY3 CB   1 1 
       20 2331 1 1 7 .   H    H 26.891 19.199 18.639 1.00 . A A . 8 CY3 H    1 1 
       20 2332 1 1 7 .   HA   H 28.076 18.413 20.797 1.00 . A A . 8 CY3 HA   1 1 
       20 2333 1 1 7 .   HB2  H 25.607 18.156 20.396 1.00 . A A . 8 CY3 HB2  1 1 
       20 2334 1 1 7 .   HB3  H 26.254 16.741 21.172 1.00 . A A . 8 CY3 HB3  1 1 
       20 2335 1 1 7 .   HN11 H 27.666 15.954 18.224 1.00 . A A . 8 CY3 HN11 1 1 
       20 2336 1 1 7 .   HN12 H 29.011 15.021 18.660 1.00 . A A . 8 CY3 HN12 1 1 
       20 2337 1 1 7 .   N    N 27.713 18.703 18.835 1.00 . A A . 8 CY3 N    1 1 
       20 2338 1 1 7 .   N1   N 28.415 15.777 18.827 1.00 . A A . 8 CY3 N1   1 1 
       20 2339 1 1 7 .   O    O 29.563 16.357 20.567 1.00 . A A . 8 CY3 O    1 1 
       20 2340 1 1 7 .   SG   S 25.450 16.233 19.010 1.00 . A A . 8 CY3 SG   1 1 
    stop_

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