NMR Restraints Grid

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

image mrblock_id pdb_id bmrb_id cing stage program type subtype item_count
655418 6y1q 34491 cing 4-filtered-FRED STAR entry full 120


data_FRED_restraints_with_modified_coordinates_PDB_code_6y1q

# This FRED archive file contains, for PDB entry <6y1q>:
# 
# - 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, WF Vranken, C Schulte, J Lin, JR Wedell, CJ Penkett, GW Vuister, 
# G Vriend, JL Markley, and EL Ulrich (2009). The NMR Restraints Grid at BMRB for 
# 5,266 Protein and Nucleic Acid PDB Entries. J Biomol. NMR 45, 389?396.




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.PDB_coordinate_file_version  .
    _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_6y1q
    _Assembly.Sf_category           assembly
    _Assembly.Entry_ID              1
    _Assembly.ID                    1
    _Assembly.Name                  6y1q
    _Assembly.Number_of_components  2
    _Assembly.Organic_ligands       .
    _Assembly.Metal_ions            .
    _Assembly.Paramagnetic          .
    _Assembly.Thiol_state           "all disulfide bound"
    _Assembly.Molecular_mass        1905.33

    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 $Analog_5                      A . 1 1 
       2 . 2 $OCTANOIC_ACID__CAPRYLIC_ACID_ B . 1 1 
    stop_

    loop_
       _PDBX_nonpoly_scheme.Entity_assembly_ID
       _PDBX_nonpoly_scheme.Entity_ID
       _PDBX_nonpoly_scheme.Mon_ID
       _PDBX_nonpoly_scheme.Comp_index_ID
       _PDBX_nonpoly_scheme.Comp_ID
       _PDBX_nonpoly_scheme.Entry_ID
       _PDBX_nonpoly_scheme.Assembly_ID

       2 2 . 1 . 1 1 
    stop_

save_


save_Analog_5
    _Entity.Sf_category                  entity
    _Entity.Entry_ID                     1
    _Entity.ID                           1
    _Entity.Name                         "Analog 5"
    _Entity.Type                         polymer
    _Entity.Polymer_type                 polypeptide(L)
    _Entity.Polymer_seq_one_letter_code  PCKNXFXKTFTSCK
    _Entity.Number_of_monomers           14

    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 PRO    . 1 1 
        2 CYS    . 1 1 
        3 LYS    . 1 1 
        4 ASN    . 1 1 
        5 .     $. 1 1 
        6 PHE    . 1 1 
        7 DTR $DTR 1 1 
        8 LYS    . 1 1 
        9 THR    . 1 1 
       10 PHE    . 1 1 
       11 THR    . 1 1 
       12 SER    . 1 1 
       13 CYS    . 1 1 
       14 LYS    . 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

       PRO  1  1 1 1 
       CYS  2  2 1 1 
       LYS  3  3 1 1 
       ASN  4  4 1 1 
       .    5  5 1 1 
       PHE  6  6 1 1 
       DTR  7  7 1 1 
       LYS  8  8 1 1 
       THR  9  9 1 1 
       PHE 10 10 1 1 
       THR 11 11 1 1 
       SER 12 12 1 1 
       CYS 13 13 1 1 
       LYS 14 14 1 1 
    stop_

save_


save_OCTANOIC_ACID__CAPRYLIC_ACID_
    _Entity.Sf_category  entity
    _Entity.Entry_ID     1
    _Entity.ID           2
    _Entity.Name         "OCTANOIC ACID  CAPRYLIC ACID "
    _Entity.Type         non-polymer

    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 . $. 1 2 
    stop_

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_.
    _Chem_comp.Sf_category  chem_comp
    _Chem_comp.Entry_ID     1
    _Chem_comp.ID           .
    _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 
        87 1 . . . 1 1 
        88 1 . . . 1 1 
        89 1 . . . 1 1 
        90 1 . . . 1 1 
        91 1 . . . 1 1 
        92 1 . . . 1 1 
        93 1 . . . 1 1 
        94 1 . . . 1 1 
        95 1 . . . 1 1 
        96 1 . . . 1 1 
        97 1 . . . 1 1 
        98 1 . . . 1 1 
        99 1 . . . 1 1 
       100 1 . . . 1 1 
       101 1 . . . 1 1 
       102 1 . . . 1 1 
       103 1 . . . 1 1 
       104 1 . . . 1 1 
       105 1 . . . 1 1 
       106 1 . . . 1 1 
       107 1 . . . 1 1 
       108 1 . . . 1 1 
       109 1 . . . 1 1 
       110 1 . . . 1 1 
       111 1 . . . 1 1 
       112 1 . . . 1 1 
       113 1 . . . 1 1 
       114 1 . . . 1 1 
       115 1 . . . 1 1 
       116 1 . . . 1 1 
       117 1 . . . 1 1 
       118 1 . . . 1 1 
       119 1 . . . 1 1 
       120 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 PRO HA   .  2 . HA   1 1 
         1 1 2 1 1  2 CYS H    .  3 . HN   1 1 
         2 1 1 1 1  1 PRO HB2  .  2 . HB2  1 1 
         2 1 2 1 1  2 CYS H    .  3 . HN   1 1 
         3 1 1 1 1  1 PRO HB3  .  2 . HB1  1 1 
         3 1 2 1 1  2 CYS H    .  3 . HN   1 1 
         4 1 1 1 1  2 CYS HA   .  3 . HA   1 1 
         4 1 2 1 1  3 LYS H    .  4 . HN   1 1 
         5 1 1 1 1  2 CYS HB2  .  3 . HB2  1 1 
         5 1 2 1 1  3 LYS H    .  4 . HN   1 1 
         6 1 1 1 1  2 CYS HB2  .  3 . HB2  1 1 
         6 1 2 1 1 13 CYS H    . 14 . HN   1 1 
         7 1 1 1 1  2 CYS HB3  .  3 . HB1  1 1 
         7 1 2 1 1  3 LYS H    .  4 . HN   1 1 
         8 1 1 1 1  2 CYS HB3  .  3 . HB1  1 1 
         8 1 2 1 1 13 CYS H    . 14 . HN   1 1 
         9 1 1 1 1  3 LYS HA   .  4 . HA   1 1 
         9 1 2 1 1  4 ASN H    .  5 . HN   1 1 
        10 1 1 1 1  3 LYS HB2  .  4 . HB2  1 1 
        10 1 2 1 1  4 ASN H    .  5 . HN   1 1 
        11 1 1 1 1  3 LYS HB2  .  4 . HB2  1 1 
        11 1 2 1 1  6 PHE QD   .  7 . HD+  1 1 
        12 1 1 1 1  3 LYS HB2  .  4 . HB2  1 1 
        12 1 2 1 1  6 PHE QE   .  7 . HE+  1 1 
        13 1 1 1 1  3 LYS HB2  .  4 . HB2  1 1 
        13 1 2 1 1 10 PHE QD   . 11 . HD+  1 1 
        14 1 1 1 1  3 LYS HB2  .  4 . HB2  1 1 
        14 1 2 1 1 10 PHE QE   . 11 . HE+  1 1 
        15 1 1 1 1  3 LYS HB2  .  4 . HB2  1 1 
        15 1 2 1 1 10 PHE HZ   . 11 . HZ   1 1 
        16 1 1 1 1  3 LYS HB2  .  4 . HB2  1 1 
        16 1 2 1 1 12 SER HB2  . 13 . HB2  1 1 
        17 1 1 1 1  3 LYS HB3  .  4 . HB1  1 1 
        17 1 2 1 1  4 ASN H    .  5 . HN   1 1 
        18 1 1 1 1  3 LYS HB3  .  4 . HB1  1 1 
        18 1 2 1 1  6 PHE QD   .  7 . HD+  1 1 
        19 1 1 1 1  3 LYS HB3  .  4 . HB1  1 1 
        19 1 2 1 1  6 PHE QE   .  7 . HE+  1 1 
        20 1 1 1 1  3 LYS HB3  .  4 . HB1  1 1 
        20 1 2 1 1  6 PHE HZ   .  7 . HZ   1 1 
        21 1 1 1 1  3 LYS HB3  .  4 . HB1  1 1 
        21 1 2 1 1 10 PHE QD   . 11 . HD+  1 1 
        22 1 1 1 1  3 LYS HB3  .  4 . HB1  1 1 
        22 1 2 1 1 10 PHE QE   . 11 . HE+  1 1 
        23 1 1 1 1  3 LYS HB3  .  4 . HB1  1 1 
        23 1 2 1 1 10 PHE HZ   . 11 . HZ   1 1 
        24 1 1 1 1  3 LYS HD2  .  4 . HD2  1 1 
        24 1 2 1 1  4 ASN H    .  5 . HN   1 1 
        25 1 1 1 1  3 LYS HG2  .  4 . HG2  1 1 
        25 1 2 1 1  4 ASN H    .  5 . HN   1 1 
        26 1 1 1 1  3 LYS HG2  .  4 . HG2  1 1 
        26 1 2 1 1 10 PHE QE   . 11 . HE+  1 1 
        27 1 1 1 1  3 LYS HG2  .  4 . HG2  1 1 
        27 1 2 1 1 10 PHE HZ   . 11 . HZ   1 1 
        28 1 1 1 1  3 LYS HG2  .  4 . HG2  1 1 
        28 1 2 1 1 12 SER HB2  . 13 . HB2  1 1 
        29 1 1 1 1  3 LYS HG3  .  4 . HG1  1 1 
        29 1 2 1 1  4 ASN H    .  5 . HN   1 1 
        30 1 1 1 1  3 LYS HG3  .  4 . HG1  1 1 
        30 1 2 1 1  6 PHE QE   .  7 . HE+  1 1 
        31 1 1 1 1  3 LYS HG3  .  4 . HG1  1 1 
        31 1 2 1 1  6 PHE HZ   .  7 . HZ   1 1 
        32 1 1 1 1  3 LYS HG3  .  4 . HG1  1 1 
        32 1 2 1 1 10 PHE QD   . 11 . HD+  1 1 
        33 1 1 1 1  3 LYS HG3  .  4 . HG1  1 1 
        33 1 2 1 1 10 PHE QE   . 11 . HE+  1 1 
        34 1 1 1 1  3 LYS HG3  .  4 . HG1  1 1 
        34 1 2 1 1 10 PHE HZ   . 11 . HZ   1 1 
        35 1 1 1 1  3 LYS HG3  .  4 . HG1  1 1 
        35 1 2 1 1 12 SER HB2  . 13 . HB2  1 1 
        36 1 1 1 1  4 ASN H    .  5 . HN   1 1 
        36 1 2 1 1 10 PHE QD   . 11 . HD+  1 1 
        37 1 1 1 1  4 ASN H    .  5 . HN   1 1 
        37 1 2 1 1 11 THR MG   . 12 . HG2+ 1 1 
        38 1 1 1 1  4 ASN H    .  5 . HN   1 1 
        38 1 2 1 1 12 SER QB   . 13 . HB+  1 1 
        39 1 1 1 1  4 ASN HA   .  5 . HA   1 1 
        39 1 2 1 1 10 PHE QE   . 11 . HE+  1 1 
        40 1 1 1 1  4 ASN HB2  .  5 . HB2  1 1 
        40 1 2 1 1  6 PHE QD   .  7 . HD+  1 1 
        41 1 1 1 1  4 ASN HB2  .  5 . HB2  1 1 
        41 1 2 1 1  6 PHE QE   .  7 . HE+  1 1 
        42 1 1 1 1  4 ASN HB2  .  5 . HB2  1 1 
        42 1 2 1 1  6 PHE HZ   .  7 . HZ   1 1 
        43 1 1 1 1  4 ASN HB2  .  5 . HB2  1 1 
        43 1 2 1 1 10 PHE QD   . 11 . HD+  1 1 
        44 1 1 1 1  4 ASN HB2  .  5 . HB2  1 1 
        44 1 2 1 1 10 PHE QE   . 11 . HE+  1 1 
        45 1 1 1 1  4 ASN HB2  .  5 . HB2  1 1 
        45 1 2 1 1 10 PHE HZ   . 11 . HZ   1 1 
        46 1 1 1 1  4 ASN HB2  .  5 . HB2  1 1 
        46 1 2 1 1 11 THR H    . 12 . HN   1 1 
        47 1 1 1 1  4 ASN HD21 .  5 . HD21 1 1 
        47 1 2 1 1 10 PHE H    . 11 . HN   1 1 
        48 1 1 1 1  4 ASN HD21 .  5 . HD21 1 1 
        48 1 2 1 1 11 THR MG   . 12 . HG2+ 1 1 
        49 1 1 1 1  4 ASN HD21 .  5 . HD21 1 1 
        49 1 2 1 1 12 SER HA   . 13 . HA   1 1 
        50 1 1 1 1  4 ASN HD21 .  5 . HD21 1 1 
        50 1 2 1 1 13 CYS H    . 14 . HN   1 1 
        51 1 1 1 1  4 ASN HD22 .  5 . HD22 1 1 
        51 1 2 1 1 11 THR MG   . 12 . HG2+ 1 1 
        52 1 1 1 1  4 ASN HD22 .  5 . HD22 1 1 
        52 1 2 1 1 12 SER HA   . 13 . HA   1 1 
        53 1 1 1 1  4 ASN HD22 .  5 . HD22 1 1 
        53 1 2 1 1 12 SER QB   . 13 . HB+  1 1 
        54 1 1 1 1  4 ASN HD22 .  5 . HD22 1 1 
        54 1 2 1 1 13 CYS H    . 14 . HN   1 1 
        55 1 1 1 1  6 PHE HA   .  7 . HA   1 1 
        55 1 2 1 1  7 DTR HD1  .  8 . HD1  1 1 
        56 1 1 1 1  6 PHE QD   .  7 . HD+  1 1 
        56 1 2 1 1  7 DTR HA   .  8 . HA   1 1 
        57 1 1 1 1  6 PHE QD   .  7 . HD+  1 1 
        57 1 2 1 1  9 THR HB   . 10 . HB   1 1 
        58 1 1 1 1  6 PHE QD   .  7 . HD+  1 1 
        58 1 2 1 1 12 SER HA   . 13 . HA   1 1 
        59 1 1 1 1  6 PHE QE   .  7 . HE+  1 1 
        59 1 2 1 1  7 DTR HA   .  8 . HA   1 1 
        60 1 1 1 1  6 PHE QE   .  7 . HE+  1 1 
        60 1 2 1 1  8 LYS HA   .  9 . HA   1 1 
        61 1 1 1 1  6 PHE QE   .  7 . HE+  1 1 
        61 1 2 1 1  9 THR MG   . 10 . HG2+ 1 1 
        62 1 1 1 1  6 PHE HZ   .  7 . HZ   1 1 
        62 1 2 1 1  9 THR MG   . 10 . HG2+ 1 1 
        63 1 1 1 1  7 DTR HA   .  8 . HA   1 1 
        63 1 2 1 1  8 LYS H    .  9 . HN   1 1 
        64 1 1 1 1  7 DTR HA   .  8 . HA   1 1 
        64 1 2 1 1  9 THR H    . 10 . HN   1 1 
        65 1 1 1 1  7 DTR HB2  .  8 . HB2  1 1 
        65 1 2 1 1  8 LYS H    .  9 . HN   1 1 
        66 1 1 1 1  7 DTR HD1  .  8 . HD1  1 1 
        66 1 2 1 1  8 LYS H    .  9 . HN   1 1 
        67 1 1 1 1  7 DTR HD1  .  8 . HD1  1 1 
        67 1 2 1 1  8 LYS HA   .  9 . HA   1 1 
        68 1 1 1 1  7 DTR HD1  .  8 . HD1  1 1 
        68 1 2 1 1  8 LYS HB2  .  9 . HB2  1 1 
        69 1 1 1 1  7 DTR HD1  .  8 . HD1  1 1 
        69 1 2 1 1  8 LYS HB3  .  9 . HB1  1 1 
        70 1 1 1 1  7 DTR HD1  .  8 . HD1  1 1 
        70 1 2 1 1  8 LYS HD2  .  9 . HD2  1 1 
        71 1 1 1 1  7 DTR HD1  .  8 . HD1  1 1 
        71 1 2 1 1  8 LYS HG2  .  9 . HG2  1 1 
        72 1 1 1 1  7 DTR HD1  .  8 . HD1  1 1 
        72 1 2 1 1  8 LYS HG3  .  9 . HG1  1 1 
        73 1 1 1 1  7 DTR HE1  .  8 . HE1  1 1 
        73 1 2 1 1  8 LYS H    .  9 . HN   1 1 
        74 1 1 1 1  7 DTR HE1  .  8 . HE1  1 1 
        74 1 2 1 1  8 LYS HA   .  9 . HA   1 1 
        75 1 1 1 1  7 DTR HE1  .  8 . HE1  1 1 
        75 1 2 1 1  8 LYS HB2  .  9 . HB2  1 1 
        76 1 1 1 1  7 DTR HE1  .  8 . HE1  1 1 
        76 1 2 1 1  8 LYS HB3  .  9 . HB1  1 1 
        77 1 1 1 1  7 DTR HE1  .  8 . HE1  1 1 
        77 1 2 1 1  8 LYS HD2  .  9 . HD2  1 1 
        78 1 1 1 1  7 DTR HE1  .  8 . HE1  1 1 
        78 1 2 1 1  8 LYS HE2  .  9 . HE2  1 1 
        79 1 1 1 1  7 DTR HE1  .  8 . HE1  1 1 
        79 1 2 1 1  8 LYS HE3  .  9 . HE1  1 1 
        80 1 1 1 1  7 DTR HE1  .  8 . HE1  1 1 
        80 1 2 1 1  8 LYS HG2  .  9 . HG2  1 1 
        81 1 1 1 1  7 DTR HE1  .  8 . HE1  1 1 
        81 1 2 1 1  8 LYS HG3  .  9 . HG1  1 1 
        82 1 1 1 1  7 DTR HH2  .  8 . HH2  1 1 
        82 1 2 1 1  8 LYS HE2  .  9 . HE2  1 1 
        83 1 1 1 1  7 DTR HH2  .  8 . HH2  1 1 
        83 1 2 1 1  8 LYS HE3  .  9 . HE1  1 1 
        84 1 1 1 1  7 DTR HH2  .  8 . HH2  1 1 
        84 1 2 1 1  8 LYS HG2  .  9 . HG2  1 1 
        85 1 1 1 1  7 DTR HZ2  .  8 . HZ2  1 1 
        85 1 2 1 1  8 LYS HB2  .  9 . HB2  1 1 
        86 1 1 1 1  7 DTR HZ2  .  8 . HZ2  1 1 
        86 1 2 1 1  8 LYS HB3  .  9 . HB1  1 1 
        87 1 1 1 1  7 DTR HZ2  .  8 . HZ2  1 1 
        87 1 2 1 1  8 LYS HE2  .  9 . HE2  1 1 
        88 1 1 1 1  7 DTR HZ2  .  8 . HZ2  1 1 
        88 1 2 1 1  8 LYS HE3  .  9 . HE1  1 1 
        89 1 1 1 1  7 DTR HZ2  .  8 . HZ2  1 1 
        89 1 2 1 1  8 LYS HG2  .  9 . HG2  1 1 
        90 1 1 1 1  7 DTR HZ2  .  8 . HZ2  1 1 
        90 1 2 1 1  8 LYS HG3  .  9 . HG1  1 1 
        91 1 1 1 1  8 LYS H    .  9 . HN   1 1 
        91 1 2 1 1  9 THR H    . 10 . HN   1 1 
        92 1 1 1 1  8 LYS HA   .  9 . HA   1 1 
        92 1 2 1 1  9 THR H    . 10 . HN   1 1 
        93 1 1 1 1  8 LYS HB2  .  9 . HB2  1 1 
        93 1 2 1 1  9 THR H    . 10 . HN   1 1 
        94 1 1 1 1  8 LYS HB3  .  9 . HB1  1 1 
        94 1 2 1 1  9 THR H    . 10 . HN   1 1 
        95 1 1 1 1  8 LYS HD2  .  9 . HD2  1 1 
        95 1 2 1 1  9 THR H    . 10 . HN   1 1 
        96 1 1 1 1  8 LYS HG2  .  9 . HG2  1 1 
        96 1 2 1 1  9 THR H    . 10 . HN   1 1 
        97 1 1 1 1  8 LYS HG3  .  9 . HG1  1 1 
        97 1 2 1 1  9 THR H    . 10 . HN   1 1 
        98 1 1 1 1  9 THR H    . 10 . HN   1 1 
        98 1 2 1 1 10 PHE H    . 11 . HN   1 1 
        99 1 1 1 1  9 THR HA   . 10 . HA   1 1 
        99 1 2 1 1 10 PHE H    . 11 . HN   1 1 
       100 1 1 1 1  9 THR HA   . 10 . HA   1 1 
       100 1 2 1 1 10 PHE QD   . 11 . HD+  1 1 
       101 1 1 1 1  9 THR HA   . 10 . HA   1 1 
       101 1 2 1 1 10 PHE QE   . 11 . HE+  1 1 
       102 1 1 1 1  9 THR HB   . 10 . HB   1 1 
       102 1 2 1 1 10 PHE H    . 11 . HN   1 1 
       103 1 1 1 1  9 THR MG   . 10 . HG2+ 1 1 
       103 1 2 1 1 10 PHE H    . 11 . HN   1 1 
       104 1 1 1 1  9 THR MG   . 10 . HG2+ 1 1 
       104 1 2 1 1 10 PHE QD   . 11 . HD+  1 1 
       105 1 1 1 1  9 THR MG   . 10 . HG2+ 1 1 
       105 1 2 1 1 10 PHE QE   . 11 . HE+  1 1 
       106 1 1 1 1  9 THR MG   . 10 . HG2+ 1 1 
       106 1 2 1 1 10 PHE HZ   . 11 . HZ   1 1 
       107 1 1 1 1 10 PHE HA   . 11 . HA   1 1 
       107 1 2 1 1 11 THR H    . 12 . HN   1 1 
       108 1 1 1 1 10 PHE HB2  . 11 . HB2  1 1 
       108 1 2 1 1 11 THR H    . 12 . HN   1 1 
       109 1 1 1 1 10 PHE QD   . 11 . HD+  1 1 
       109 1 2 1 1 11 THR MG   . 12 . HG2+ 1 1 
       110 1 1 1 1 10 PHE QD   . 11 . HD+  1 1 
       110 1 2 1 1 12 SER HA   . 13 . HA   1 1 
       111 1 1 1 1 10 PHE QE   . 11 . HE+  1 1 
       111 1 2 1 1 12 SER HA   . 13 . HA   1 1 
       112 1 1 1 1 10 PHE QE   . 11 . HE+  1 1 
       112 1 2 1 1 13 CYS H    . 14 . HN   1 1 
       113 1 1 1 1 10 PHE HZ   . 11 . HZ   1 1 
       113 1 2 1 1 12 SER HA   . 13 . HA   1 1 
       114 1 1 1 1 11 THR HA   . 12 . HA   1 1 
       114 1 2 1 1 12 SER H    . 13 . HN   1 1 
       115 1 1 1 1 11 THR HB   . 12 . HB   1 1 
       115 1 2 1 1 12 SER H    . 13 . HN   1 1 
       116 1 1 1 1 11 THR MG   . 12 . HG2+ 1 1 
       116 1 2 1 1 12 SER HB2  . 13 . HB2  1 1 
       117 1 1 1 1 11 THR MG   . 12 . HG2+ 1 1 
       117 1 2 1 1 13 CYS H    . 14 . HN   1 1 
       118 1 1 1 1 12 SER HA   . 13 . HA   1 1 
       118 1 2 1 1 13 CYS H    . 14 . HN   1 1 
       119 1 1 1 1 12 SER QB   . 13 . HB+  1 1 
       119 1 2 1 1 13 CYS H    . 14 . HN   1 1 
       120 1 1 1 1 13 CYS HA   . 14 . HA   1 1 
       120 1 2 1 1 14 LYS H    . 15 . HN   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 . . . . . 6.4116 2.6334462  10.189754 1 1 
         2 1 . . . . . 6.1079 2.5633616   9.652438 1 1 
         3 1 . . . . . 6.3175 2.6117308   10.02327 1 1 
         4 1 . . . . . 4.4146    2.1726     6.6566 1 1 
         5 1 . . . . . 5.7024 2.4697845   8.935016 1 1 
         6 1 . . . . . 4.6935 2.2369616  7.1500382 1 1 
         7 1 . . . . . 5.1583  2.344223   7.972377 1 1 
         8 1 . . . . .  4.272 2.1396923   6.404308 1 1 
         9 1 . . . . . 3.9781 2.0718691  5.8843307 1 1 
        10 1 . . . . . 4.3233 2.1515307   6.495069 1 1 
        11 1 . . . . . 6.4175 2.6348076  10.200192 1 1 
        12 1 . . . . . 6.3666 2.6230617  10.110139 1 1 
        13 1 . . . . . 6.6234  2.682323  10.564477 1 1 
        14 1 . . . . . 6.9255 2.7520385  11.098962 1 1 
        15 1 . . . . . 6.4116 2.6334462  10.189754 1 1 
        16 1 . . . . . 6.3071 2.6093307  10.004869 1 1 
        17 1 . . . . . 5.7225 2.4744232   8.970577 1 1 
        18 1 . . . . .   6.52 2.6584616  10.381538 1 1 
        19 1 . . . . . 6.5663  2.669146  10.463454 1 1 
        20 1 . . . . . 6.3161 2.6114078  10.020792 1 1 
        21 1 . . . . . 6.7928 2.7214153  10.864184 1 1 
        22 1 . . . . . 6.6481  2.688023  10.608177 1 1 
        23 1 . . . . . 6.3541  2.620177  10.088023 1 1 
        24 1 . . . . . 5.4432 2.4099693   8.476431 1 1 
        25 1 . . . . . 5.4593 2.4136846   8.504915 1 1 
        26 1 . . . . . 6.5451  2.664254  10.425946 1 1 
        27 1 . . . . . 6.2982  2.607277   9.989123 1 1 
        28 1 . . . . . 6.1339 2.5693614   9.698439 1 1 
        29 1 . . . . . 5.3088  2.378954  8.2386465 1 1 
        30 1 . . . . . 6.1805 2.5801153   9.780885 1 1 
        31 1 . . . . . 5.8999 2.5153615   9.284438 1 1 
        32 1 . . . . . 6.2964 2.6068616   9.985938 1 1 
        33 1 . . . . . 6.3086 2.6096768  10.007524 1 1 
        34 1 . . . . . 6.1026 2.5621386   9.643062 1 1 
        35 1 . . . . .  6.514 2.6570768  10.370923 1 1 
        36 1 . . . . . 6.1841 2.6308846   9.787253 1 1 
        37 1 . . . . . 6.3116 2.6103692  10.012831 1 1 
        38 1 . . . . . 6.2294    2.5914     9.8674 1 1 
        39 1 . . . . . 6.4593 2.6444538  10.274146 1 1 
        40 1 . . . . . 6.4527 2.6429307  10.262469 1 1 
        41 1 . . . . . 6.5568 2.6669538  10.446646 1 1 
        42 1 . . . . . 6.4571 2.6439462  10.270254 1 1 
        43 1 . . . . . 6.1123 2.5643768   9.660223 1 1 
        44 1 . . . . . 6.5467  2.664623  10.428777 1 1 
        45 1 . . . . . 6.4783 2.6488385  10.307761 1 1 
        46 1 . . . . . 6.4776 2.6486769  10.306523 1 1 
        47 1 . . . . . 5.6716  2.462677   8.880523 1 1 
        48 1 . . . . . 5.9054  2.516631   9.294169 1 1 
        49 1 . . . . . 6.2821 2.6035616   9.960638 1 1 
        50 1 . . . . . 5.7172    2.4732     8.9612 1 1 
        51 1 . . . . . 6.5781 2.6718693  10.484331 1 1 
        52 1 . . . . . 6.6219  2.681977  10.561823 1 1 
        53 1 . . . . . 6.7167 2.7038538  10.729547 1 1 
        54 1 . . . . . 6.0109  2.540977  9.4808235 1 1 
        55 1 . . . . . 6.4721 2.6474078  10.296792 1 1 
        56 1 . . . . .  6.713     2.703     10.723 1 1 
        57 1 . . . . . 6.1289 2.5682077   9.689592 1 1 
        58 1 . . . . . 6.7281 2.7064846  10.749716 1 1 
        59 1 . . . . . 6.7584  2.713477  10.803323 1 1 
        60 1 . . . . . 6.2567    2.5977     9.9157 1 1 
        61 1 . . . . . 6.4241 2.6363308  10.211869 1 1 
        62 1 . . . . . 6.5177 2.6579309  10.377469 1 1 
        63 1 . . . . . 4.8674 2.2770922   7.457708 1 1 
        64 1 . . . . .  5.019 2.3120768   7.725923 1 1 
        65 1 . . . . .  4.911  2.287154  7.5348463 1 1 
        66 1 . . . . . 6.1141 2.5647924   9.663407 1 1 
        67 1 . . . . . 6.0291  2.545177   9.513023 1 1 
        68 1 . . . . . 6.1975 2.5840385   9.810962 1 1 
        69 1 . . . . .  6.109 2.5636153   9.654385 1 1 
        70 1 . . . . . 6.1509 2.5732846   9.728516 1 1 
        71 1 . . . . .  6.392 2.6289232  10.155077 1 1 
        72 1 . . . . .   6.75 2.7115386  10.788462 1 1 
        73 1 . . . . . 5.7304  2.476246   8.984554 1 1 
        74 1 . . . . . 6.2569 2.5977461   9.916054 1 1 
        75 1 . . . . .  6.392 2.6289232  10.155077 1 1 
        76 1 . . . . . 6.3075 2.6094232   9.859615 1 1 
        77 1 . . . . . 6.2356 2.5928307  7.7506924 1 1 
        78 1 . . . . .  6.297     2.607      9.987 1 1 
        79 1 . . . . . 6.5493 2.6652231  10.433377 1 1 
        80 1 . . . . . 6.1299 2.5684385   9.360692 1 1 
        81 1 . . . . . 6.3819 2.6360538  10.137208 1 1 
        82 1 . . . . . 6.4527 2.6429307  10.262469 1 1 
        83 1 . . . . . 6.3428 2.6175692   10.06803 1 1 
        84 1 . . . . . 6.2425  2.594423   9.890577 1 1 
        85 1 . . . . . 5.1866 2.3507538   8.022446 1 1 
        86 1 . . . . .  3.957     2.067      5.847 1 1 
        87 1 . . . . . 3.2962 1.9145077   4.677892 1 1 
        88 1 . . . . .   3.25 1.9038461  4.5961537 1 1 
        89 1 . . . . . 4.5204 2.1970153   6.843785 1 1 
        90 1 . . . . . 4.6318  2.222723   7.040877 1 1 
        91 1 . . . . . 4.8065 2.2630384  7.3499618 1 1 
        92 1 . . . . . 4.7406 2.2478309  7.2333694 1 1 
        93 1 . . . . . 6.1866 2.5815232  9.7916765 1 1 
        94 1 . . . . . 5.4667 2.4153924   8.518007 1 1 
        95 1 . . . . . 5.6077 2.4479308   8.767469 1 1 
        96 1 . . . . . 6.4354 2.6389384  10.231861 1 1 
        97 1 . . . . . 6.5252 2.6596615 10.3907385 1 1 
        98 1 . . . . . 5.7005  2.469346   8.931654 1 1 
        99 1 . . . . . 5.5488 2.4343386   8.663261 1 1 
       100 1 . . . . . 6.2889 2.6051307    9.97267 1 1 
       101 1 . . . . . 6.4492  2.642123  10.256277 1 1 
       102 1 . . . . . 5.7525 2.4813461   9.023654 1 1 
       103 1 . . . . . 6.2077 2.5863924   9.829008 1 1 
       104 1 . . . . .   6.75 2.7115386  10.788462 1 1 
       105 1 . . . . . 6.7987  2.722777  10.874623 1 1 
       106 1 . . . . . 6.4464 2.6414769  10.251323 1 1 
       107 1 . . . . .  5.879 2.5105386   9.247461 1 1 
       108 1 . . . . . 6.3581    2.6211    10.0951 1 1 
       109 1 . . . . . 6.7748 2.7172616  10.832338 1 1 
       110 1 . . . . . 6.3767 2.6253922  10.128008 1 1 
       111 1 . . . . . 6.5224 2.6590154  10.385784 1 1 
       112 1 . . . . . 6.3345 2.6156538  10.053346 1 1 
       113 1 . . . . . 6.3607    2.6217    10.0997 1 1 
       114 1 . . . . . 3.3279  1.921823   4.733977 1 1 
       115 1 . . . . . 4.3507 2.1578538   6.543546 1 1 
       116 1 . . . . . 4.8163    2.2653     7.3673 1 1 
       117 1 . . . . . 6.8775 2.7409616  11.014038 1 1 
       118 1 . . . . . 4.5713 2.2087615  6.9338384 1 1 
       119 1 . . . . .  5.972     2.532      9.412 1 1 
       120 1 . . . . . 4.1757 2.1174693  6.2339306 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 PRO C    C   7.354  0.280   0.259 1.00 . A A .   2 PRO C    1 1 
        1    2 1 1  1 PRO CA   C   8.811 -0.096   0.542 1.00 . A A .   2 PRO CA   1 1 
        1    3 1 1  1 PRO CB   C   9.743  1.036   0.122 1.00 . A A .   2 PRO CB   1 1 
        1    4 1 1  1 PRO CD   C   9.719 -0.676  -1.605 1.00 . A A .   2 PRO CD   1 1 
        1    5 1 1  1 PRO CG   C  10.039  0.780  -1.327 1.00 . A A .   2 PRO CG   1 1 
        1    6 1 1  1 PRO HA   H   8.941 -0.308   1.592 1.00 . A A .   2 PRO HA   1 1 
        1    7 1 1  1 PRO HB2  H   9.243  1.985   0.263 1.00 . A A .   2 PRO HB2  1 1 
        1    8 1 1  1 PRO HB3  H  10.642  1.006   0.719 1.00 . A A .   2 PRO HB3  1 1 
        1    9 1 1  1 PRO HD2  H   8.924 -0.755  -2.333 1.00 . A A .   2 PRO HD2  1 1 
        1   10 1 1  1 PRO HD3  H  10.601 -1.196  -1.952 1.00 . A A .   2 PRO HD3  1 1 
        1   11 1 1  1 PRO HG2  H   9.420  1.418  -1.941 1.00 . A A .   2 PRO HG2  1 1 
        1   12 1 1  1 PRO HG3  H  11.082  0.976  -1.524 1.00 . A A .   2 PRO HG3  1 1 
        1   13 1 1  1 PRO N    N   9.284 -1.192  -0.298 1.00 . A A .   2 PRO N    1 1 
        1   14 1 1  1 PRO O    O   6.829  1.237   0.828 1.00 . A A .   2 PRO O    1 1 
        1   15 1 1  2 CYS C    C   4.429 -1.351  -0.521 1.00 . A A .   3 CYS C    1 1 
        1   16 1 1  2 CYS CA   C   5.329 -0.215  -0.998 1.00 . A A .   3 CYS CA   1 1 
        1   17 1 1  2 CYS CB   C   5.199 -0.056  -2.513 1.00 . A A .   3 CYS CB   1 1 
        1   18 1 1  2 CYS H    H   7.193 -1.208  -1.066 1.00 . A A .   3 CYS H    1 1 
        1   19 1 1  2 CYS HA   H   5.024  0.705  -0.522 1.00 . A A .   3 CYS HA   1 1 
        1   20 1 1  2 CYS HB2  H   5.574 -0.948  -2.993 1.00 . A A .   3 CYS HB2  1 1 
        1   21 1 1  2 CYS HB3  H   4.158  0.074  -2.768 1.00 . A A .   3 CYS HB3  1 1 
        1   22 1 1  2 CYS N    N   6.715 -0.468  -0.634 1.00 . A A .   3 CYS N    1 1 
        1   23 1 1  2 CYS O    O   4.608 -2.503  -0.921 1.00 . A A .   3 CYS O    1 1 
        1   24 1 1  2 CYS SG   S   6.119  1.361  -3.193 1.00 . A A .   3 CYS SG   1 1 
        1   25 1 1  3 LYS C    C   1.109 -1.645   0.501 1.00 . A A .   4 LYS C    1 1 
        1   26 1 1  3 LYS CA   C   2.541 -2.021   0.846 1.00 . A A .   4 LYS CA   1 1 
        1   27 1 1  3 LYS CB   C   2.696 -2.157   2.369 1.00 . A A .   4 LYS CB   1 1 
        1   28 1 1  3 LYS CD   C   1.516 -4.408   2.479 1.00 . A A .   4 LYS CD   1 1 
        1   29 1 1  3 LYS CE   C   2.746 -5.239   2.805 1.00 . A A .   4 LYS CE   1 1 
        1   30 1 1  3 LYS CG   C   1.611 -2.995   3.043 1.00 . A A .   4 LYS CG   1 1 
        1   31 1 1  3 LYS H    H   3.365 -0.092   0.614 1.00 . A A .   4 LYS H    1 1 
        1   32 1 1  3 LYS HA   H   2.776 -2.968   0.383 1.00 . A A .   4 LYS HA   1 1 
        1   33 1 1  3 LYS HB2  H   3.654 -2.609   2.583 1.00 . A A .   4 LYS HB2  1 1 
        1   34 1 1  3 LYS HB3  H   2.671 -1.169   2.806 1.00 . A A .   4 LYS HB3  1 1 
        1   35 1 1  3 LYS HD2  H   0.650 -4.893   2.901 1.00 . A A .   4 LYS HD2  1 1 
        1   36 1 1  3 LYS HD3  H   1.409 -4.350   1.405 1.00 . A A .   4 LYS HD3  1 1 
        1   37 1 1  3 LYS HE2  H   3.611 -4.775   2.356 1.00 . A A .   4 LYS HE2  1 1 
        1   38 1 1  3 LYS HE3  H   2.869 -5.273   3.877 1.00 . A A .   4 LYS HE3  1 1 
        1   39 1 1  3 LYS HG2  H   1.828 -3.059   4.098 1.00 . A A .   4 LYS HG2  1 1 
        1   40 1 1  3 LYS HG3  H   0.659 -2.501   2.905 1.00 . A A .   4 LYS HG3  1 1 
        1   41 1 1  3 LYS HZ1  H   3.491 -7.160   2.475 1.00 . A A .   4 LYS HZ1  1 1 
        1   42 1 1  3 LYS HZ2  H   2.442 -6.611   1.265 1.00 . A A .   4 LYS HZ2  1 1 
        1   43 1 1  3 LYS HZ3  H   1.819 -7.109   2.759 1.00 . A A .   4 LYS HZ3  1 1 
        1   44 1 1  3 LYS N    N   3.466 -1.028   0.330 1.00 . A A .   4 LYS N    1 1 
        1   45 1 1  3 LYS NZ   N   2.616 -6.624   2.289 1.00 . A A .   4 LYS NZ   1 1 
        1   46 1 1  3 LYS O    O   0.648 -0.550   0.832 1.00 . A A .   4 LYS O    1 1 
        1   47 1 1  4 ASN C    C  -1.759 -3.406   0.475 1.00 . A A .   5 ASN C    1 1 
        1   48 1 1  4 ASN CA   C  -1.015 -2.379  -0.381 1.00 . A A .   5 ASN CA   1 1 
        1   49 1 1  4 ASN CB   C  -1.370 -2.614  -1.855 1.00 . A A .   5 ASN CB   1 1 
        1   50 1 1  4 ASN CG   C  -0.634 -1.699  -2.820 1.00 . A A .   5 ASN CG   1 1 
        1   51 1 1  4 ASN H    H   0.857 -3.353  -0.507 1.00 . A A .   5 ASN H    1 1 
        1   52 1 1  4 ASN HA   H  -1.288 -1.375  -0.097 1.00 . A A .   5 ASN HA   1 1 
        1   53 1 1  4 ASN HB2  H  -1.129 -3.631  -2.109 1.00 . A A .   5 ASN HB2  1 1 
        1   54 1 1  4 ASN HB3  H  -2.432 -2.462  -1.986 1.00 . A A .   5 ASN HB3  1 1 
        1   55 1 1  4 ASN HD21 H  -2.131 -0.396  -2.766 1.00 . A A .   5 ASN HD21 1 1 
        1   56 1 1  4 ASN HD22 H  -0.803  0.024  -3.789 1.00 . A A .   5 ASN HD22 1 1 
        1   57 1 1  4 ASN N    N   0.408 -2.552  -0.161 1.00 . A A .   5 ASN N    1 1 
        1   58 1 1  4 ASN ND2  N  -1.246 -0.577  -3.156 1.00 . A A .   5 ASN ND2  1 1 
        1   59 1 1  4 ASN O    O  -1.682 -4.605   0.208 1.00 . A A .   5 ASN O    1 1 
        1   60 1 1  4 ASN OD1  O   0.470 -2.011  -3.274 1.00 . A A .   5 ASN OD1  1 1 
        1   61 1 1  5 .   C    C  -4.449 -4.383   1.681 1.00 . A A .   6 O6H C    1 1 
        1   62 1 1  5 .   CA   C  -3.208 -3.849   2.381 1.00 . A A .   6 O6H CA   1 1 
        1   63 1 1  5 .   CB   C  -3.599 -3.161   3.692 1.00 . A A .   6 O6H CB   1 1 
        1   64 1 1  5 .   CD1  C  -1.743 -3.632   5.343 1.00 . A A .   6 O6H CD1  1 1 
        1   65 1 1  5 .   CD2  C  -1.974 -1.416   4.504 1.00 . A A .   6 O6H CD2  1 1 
        1   66 1 1  5 .   CE1  C  -0.661 -3.234   6.109 1.00 . A A .   6 O6H CE1  1 1 
        1   67 1 1  5 .   CE2  C  -0.896 -1.006   5.263 1.00 . A A .   6 O6H CE2  1 1 
        1   68 1 1  5 .   CF1  C  -2.188 -5.063   5.403 1.00 . A A .   6 O6H CF1  1 1 
        1   69 1 1  5 .   CF2  C  -2.675 -0.416   3.640 1.00 . A A .   6 O6H CF2  1 1 
        1   70 1 1  5 .   CG   C  -2.418 -2.730   4.527 1.00 . A A .   6 O6H CG   1 1 
        1   71 1 1  5 .   CH   C   0.924 -1.476   6.888 1.00 . A A .   6 O6H CH   1 1 
        1   72 1 1  5 .   CZ   C  -0.245 -1.919   6.062 1.00 . A A .   6 O6H CZ   1 1 
        1   73 1 1  5 .   H1   H  -2.418 -1.997   1.741 1.00 . A A .   6 O6H H1   1 1 
        1   74 1 1  5 .   HA   H  -2.570 -4.688   2.616 1.00 . A A .   6 O6H HA   1 1 
        1   75 1 1  5 .   HB1  H  -4.194 -3.842   4.283 1.00 . A A .   6 O6H HB1  1 1 
        1   76 1 1  5 .   HB2  H  -4.185 -2.282   3.467 1.00 . A A .   6 O6H HB2  1 1 
        1   77 1 1  5 .   HE1  H  -0.147 -3.946   6.737 1.00 . A A .   6 O6H HE1  1 1 
        1   78 1 1  5 .   HE2  H  -0.566  0.023   5.229 1.00 . A A .   6 O6H HE2  1 1 
        1   79 1 1  5 .   HF11 H  -3.255 -5.175   5.527 1.00 . A A .   6 O6H HF11 1 1 
        1   80 1 1  5 .   HF12 H  -1.747 -5.615   6.220 1.00 . A A .   6 O6H HF12 1 1 
        1   81 1 1  5 .   HF13 H  -1.944 -5.625   4.514 1.00 . A A .   6 O6H HF13 1 1 
        1   82 1 1  5 .   HF21 H  -2.772  0.554   4.102 1.00 . A A .   6 O6H HF21 1 1 
        1   83 1 1  5 .   HF22 H  -2.174 -0.237   2.701 1.00 . A A .   6 O6H HF22 1 1 
        1   84 1 1  5 .   HF23 H  -3.681 -0.709   3.377 1.00 . A A .   6 O6H HF23 1 1 
        1   85 1 1  5 .   HH1  H   0.741 -1.528   7.950 1.00 . A A .   6 O6H HH1  1 1 
        1   86 1 1  5 .   HH2  H   1.219 -0.454   6.699 1.00 . A A .   6 O6H HH2  1 1 
        1   87 1 1  5 .   HH3  H   1.814 -2.065   6.722 1.00 . A A .   6 O6H HH3  1 1 
        1   88 1 1  5 .   N    N  -2.441 -2.950   1.525 1.00 . A A .   6 O6H N    1 1 
        1   89 1 1  5 .   O    O  -4.820 -5.543   1.847 1.00 . A A .   6 O6H O    1 1 
        1   90 1 1  6 PHE C    C  -6.381 -4.008  -1.129 1.00 . A A .   7 PHE C    1 1 
        1   91 1 1  6 PHE CA   C  -6.424 -3.835   0.384 1.00 . A A .   7 PHE CA   1 1 
        1   92 1 1  6 PHE CB   C  -7.423 -2.736   0.759 1.00 . A A .   7 PHE CB   1 1 
        1   93 1 1  6 PHE CD1  C  -7.625 -3.113   3.237 1.00 . A A .   7 PHE CD1  1 1 
        1   94 1 1  6 PHE CD2  C  -6.806 -1.007   2.471 1.00 . A A .   7 PHE CD2  1 1 
        1   95 1 1  6 PHE CE1  C  -7.483 -2.693   4.546 1.00 . A A .   7 PHE CE1  1 1 
        1   96 1 1  6 PHE CE2  C  -6.666 -0.582   3.777 1.00 . A A .   7 PHE CE2  1 1 
        1   97 1 1  6 PHE CG   C  -7.288 -2.275   2.185 1.00 . A A .   7 PHE CG   1 1 
        1   98 1 1  6 PHE CZ   C  -7.002 -1.426   4.815 1.00 . A A .   7 PHE CZ   1 1 
        1   99 1 1  6 PHE H    H  -4.711 -2.645   0.736 1.00 . A A .   7 PHE H    1 1 
        1  100 1 1  6 PHE HA   H  -6.746 -4.763   0.829 1.00 . A A .   7 PHE HA   1 1 
        1  101 1 1  6 PHE HB2  H  -7.268 -1.881   0.117 1.00 . A A .   7 PHE HB2  1 1 
        1  102 1 1  6 PHE HB3  H  -8.427 -3.108   0.623 1.00 . A A .   7 PHE HB3  1 1 
        1  103 1 1  6 PHE HD1  H  -8.000 -4.105   3.028 1.00 . A A .   7 PHE HD1  1 1 
        1  104 1 1  6 PHE HD2  H  -6.543 -0.344   1.661 1.00 . A A .   7 PHE HD2  1 1 
        1  105 1 1  6 PHE HE1  H  -7.748 -3.354   5.358 1.00 . A A .   7 PHE HE1  1 1 
        1  106 1 1  6 PHE HE2  H  -6.292  0.410   3.987 1.00 . A A .   7 PHE HE2  1 1 
        1  107 1 1  6 PHE HZ   H  -6.887 -1.096   5.836 1.00 . A A .   7 PHE HZ   1 1 
        1  108 1 1  6 PHE N    N  -5.111 -3.516   0.926 1.00 . A A .   7 PHE N    1 1 
        1  109 1 1  6 PHE O    O  -7.286 -4.596  -1.720 1.00 . A A .   7 PHE O    1 1 
        1  110 1 1  7 DTR C    C  -4.958 -2.149  -3.793 1.00 . A A .   8 DTR C    1 1 
        1  111 1 1  7 DTR CA   C  -5.250 -3.531  -3.208 1.00 . A A .   8 DTR CA   1 1 
        1  112 1 1  7 DTR CB   C  -4.179 -4.533  -3.655 1.00 . A A .   8 DTR CB   1 1 
        1  113 1 1  7 DTR CD1  C  -4.954 -5.712  -5.792 1.00 . A A .   8 DTR CD1  1 1 
        1  114 1 1  7 DTR CD2  C  -3.486 -4.055  -6.139 1.00 . A A .   8 DTR CD2  1 1 
        1  115 1 1  7 DTR CE2  C  -3.842 -4.610  -7.382 1.00 . A A .   8 DTR CE2  1 1 
        1  116 1 1  7 DTR CE3  C  -2.573 -2.994  -6.111 1.00 . A A .   8 DTR CE3  1 1 
        1  117 1 1  7 DTR CG   C  -4.209 -4.775  -5.133 1.00 . A A .   8 DTR CG   1 1 
        1  118 1 1  7 DTR CH2  C  -2.430 -3.101  -8.526 1.00 . A A .   8 DTR CH2  1 1 
        1  119 1 1  7 DTR CZ2  C  -3.319 -4.139  -8.583 1.00 . A A .   8 DTR CZ2  1 1 
        1  120 1 1  7 DTR CZ3  C  -2.055 -2.530  -7.304 1.00 . A A .   8 DTR CZ3  1 1 
        1  121 1 1  7 DTR H    H  -4.642 -3.037  -1.249 1.00 . A A .   8 DTR H    1 1 
        1  122 1 1  7 DTR HA   H  -6.187 -3.911  -3.589 1.00 . A A .   8 DTR HA   1 1 
        1  123 1 1  7 DTR HB2  H  -3.201 -4.152  -3.395 1.00 . A A .   8 DTR HB2  1 1 
        1  124 1 1  7 DTR HB3  H  -4.341 -5.476  -3.156 1.00 . A A .   8 DTR HB3  1 1 
        1  125 1 1  7 DTR HD1  H  -5.614 -6.416  -5.307 1.00 . A A .   8 DTR HD1  1 1 
        1  126 1 1  7 DTR HE1  H  -5.162 -6.188  -7.832 1.00 . A A .   8 DTR HE1  1 1 
        1  127 1 1  7 DTR HE3  H  -2.271 -2.541  -5.178 1.00 . A A .   8 DTR HE3  1 1 
        1  128 1 1  7 DTR HH2  H  -1.998 -2.708  -9.435 1.00 . A A .   8 DTR HH2  1 1 
        1  129 1 1  7 DTR HZ2  H  -3.602 -4.566  -9.532 1.00 . A A .   8 DTR HZ2  1 1 
        1  130 1 1  7 DTR HZ3  H  -1.348 -1.713  -7.302 1.00 . A A .   8 DTR HZ3  1 1 
        1  131 1 1  7 DTR N    N  -5.348 -3.474  -1.761 1.00 . A A .   8 DTR N    1 1 
        1  132 1 1  7 DTR NE1  N  -4.739 -5.617  -7.144 1.00 . A A .   8 DTR NE1  1 1 
        1  133 1 1  7 DTR O    O  -4.059 -1.459  -3.316 1.00 . A A .   8 DTR O    1 1 
        1  134 1 1  8 LYS C    C  -6.149  0.692  -4.828 1.00 . A A .   9 LYS C    1 1 
        1  135 1 1  8 LYS CA   C  -5.432 -0.473  -5.495 1.00 . A A .   9 LYS CA   1 1 
        1  136 1 1  8 LYS CB   C  -5.814 -0.557  -6.983 1.00 . A A .   9 LYS CB   1 1 
        1  137 1 1  8 LYS CD   C  -7.779 -2.153  -7.057 1.00 . A A .   9 LYS CD   1 1 
        1  138 1 1  8 LYS CE   C  -7.213 -3.085  -8.116 1.00 . A A .   9 LYS CE   1 1 
        1  139 1 1  8 LYS CG   C  -7.308 -0.717  -7.250 1.00 . A A .   9 LYS CG   1 1 
        1  140 1 1  8 LYS H    H  -6.506 -2.250  -5.080 1.00 . A A .   9 LYS H    1 1 
        1  141 1 1  8 LYS HA   H  -4.368 -0.305  -5.420 1.00 . A A .   9 LYS HA   1 1 
        1  142 1 1  8 LYS HB2  H  -5.483  0.346  -7.474 1.00 . A A .   9 LYS HB2  1 1 
        1  143 1 1  8 LYS HB3  H  -5.301 -1.400  -7.423 1.00 . A A .   9 LYS HB3  1 1 
        1  144 1 1  8 LYS HD2  H  -7.458 -2.498  -6.085 1.00 . A A .   9 LYS HD2  1 1 
        1  145 1 1  8 LYS HD3  H  -8.857 -2.178  -7.110 1.00 . A A .   9 LYS HD3  1 1 
        1  146 1 1  8 LYS HE2  H  -6.136 -3.000  -8.114 1.00 . A A .   9 LYS HE2  1 1 
        1  147 1 1  8 LYS HE3  H  -7.492 -4.099  -7.870 1.00 . A A .   9 LYS HE3  1 1 
        1  148 1 1  8 LYS HG2  H  -7.849 -0.082  -6.571 1.00 . A A .   9 LYS HG2  1 1 
        1  149 1 1  8 LYS HG3  H  -7.512 -0.414  -8.267 1.00 . A A .   9 LYS HG3  1 1 
        1  150 1 1  8 LYS HZ1  H  -8.766 -2.768  -9.480 1.00 . A A .   9 LYS HZ1  1 1 
        1  151 1 1  8 LYS HZ2  H  -7.380 -3.461 -10.164 1.00 . A A .   9 LYS HZ2  1 1 
        1  152 1 1  8 LYS HZ3  H  -7.392 -1.813  -9.770 1.00 . A A .   9 LYS HZ3  1 1 
        1  153 1 1  8 LYS N    N  -5.725 -1.723  -4.802 1.00 . A A .   9 LYS N    1 1 
        1  154 1 1  8 LYS NZ   N  -7.722 -2.758  -9.475 1.00 . A A .   9 LYS NZ   1 1 
        1  155 1 1  8 LYS O    O  -6.025  1.842  -5.251 1.00 . A A .   9 LYS O    1 1 
        1  156 1 1  9 THR C    C  -6.662  2.138  -2.061 1.00 . A A .  10 THR C    1 1 
        1  157 1 1  9 THR CA   C  -7.602  1.402  -3.023 1.00 . A A .  10 THR CA   1 1 
        1  158 1 1  9 THR CB   C  -8.753  0.762  -2.225 1.00 . A A .  10 THR CB   1 1 
        1  159 1 1  9 THR CG2  C  -9.760  1.810  -1.772 1.00 . A A .  10 THR CG2  1 1 
        1  160 1 1  9 THR H    H  -6.985 -0.556  -3.517 1.00 . A A .  10 THR H    1 1 
        1  161 1 1  9 THR HA   H  -8.022  2.110  -3.724 1.00 . A A .  10 THR HA   1 1 
        1  162 1 1  9 THR HB   H  -8.342  0.275  -1.351 1.00 . A A .  10 THR HB   1 1 
        1  163 1 1  9 THR HG1  H  -9.928  0.228  -3.731 1.00 . A A .  10 THR HG1  1 1 
        1  164 1 1  9 THR HG21 H -10.180  2.303  -2.638 1.00 . A A .  10 THR HG21 1 1 
        1  165 1 1  9 THR HG22 H  -9.264  2.540  -1.149 1.00 . A A .  10 THR HG22 1 1 
        1  166 1 1  9 THR HG23 H -10.549  1.334  -1.210 1.00 . A A .  10 THR HG23 1 1 
        1  167 1 1  9 THR N    N  -6.886  0.386  -3.773 1.00 . A A .  10 THR N    1 1 
        1  168 1 1  9 THR O    O  -6.862  3.315  -1.763 1.00 . A A .  10 THR O    1 1 
        1  169 1 1  9 THR OG1  O  -9.413 -0.218  -3.041 1.00 . A A .  10 THR OG1  1 1 
        1  170 1 1 10 PHE C    C  -3.226  1.793  -1.176 1.00 . A A .  11 PHE C    1 1 
        1  171 1 1 10 PHE CA   C  -4.673  2.034  -0.667 1.00 . A A .  11 PHE CA   1 1 
        1  172 1 1 10 PHE CB   C  -4.831  1.380   0.712 1.00 . A A .  11 PHE CB   1 1 
        1  173 1 1 10 PHE CD1  C  -2.784  2.376   1.790 1.00 . A A .  11 PHE CD1  1 1 
        1  174 1 1 10 PHE CD2  C  -4.872  2.566   2.923 1.00 . A A .  11 PHE CD2  1 1 
        1  175 1 1 10 PHE CE1  C  -2.158  3.048   2.819 1.00 . A A .  11 PHE CE1  1 1 
        1  176 1 1 10 PHE CE2  C  -4.250  3.240   3.955 1.00 . A A .  11 PHE CE2  1 1 
        1  177 1 1 10 PHE CG   C  -4.148  2.126   1.828 1.00 . A A .  11 PHE CG   1 1 
        1  178 1 1 10 PHE CZ   C  -2.892  3.480   3.902 1.00 . A A .  11 PHE CZ   1 1 
        1  179 1 1 10 PHE H    H  -5.485  0.529  -1.897 1.00 . A A .  11 PHE H    1 1 
        1  180 1 1 10 PHE HA   H  -4.903  3.085  -0.572 1.00 . A A .  11 PHE HA   1 1 
        1  181 1 1 10 PHE HB2  H  -5.880  1.314   0.953 1.00 . A A .  11 PHE HB2  1 1 
        1  182 1 1 10 PHE HB3  H  -4.413  0.384   0.676 1.00 . A A .  11 PHE HB3  1 1 
        1  183 1 1 10 PHE HD1  H  -2.209  2.039   0.940 1.00 . A A .  11 PHE HD1  1 1 
        1  184 1 1 10 PHE HD2  H  -5.936  2.381   2.966 1.00 . A A .  11 PHE HD2  1 1 
        1  185 1 1 10 PHE HE1  H  -1.096  3.235   2.775 1.00 . A A .  11 PHE HE1  1 1 
        1  186 1 1 10 PHE HE2  H  -4.826  3.578   4.804 1.00 . A A .  11 PHE HE2  1 1 
        1  187 1 1 10 PHE HZ   H  -2.404  4.003   4.708 1.00 . A A .  11 PHE HZ   1 1 
        1  188 1 1 10 PHE N    N  -5.625  1.447  -1.596 1.00 . A A .  11 PHE N    1 1 
        1  189 1 1 10 PHE O    O  -2.785  0.643  -1.168 1.00 . A A .  11 PHE O    1 1 
        1  190 1 1 11 THR C    C  -0.205  3.407  -0.976 1.00 . A A .  12 THR C    1 1 
        1  191 1 1 11 THR CA   C  -1.082  2.645  -1.966 1.00 . A A .  12 THR CA   1 1 
        1  192 1 1 11 THR CB   C  -0.788  3.130  -3.402 1.00 . A A .  12 THR CB   1 1 
        1  193 1 1 11 THR CG2  C   0.700  3.049  -3.727 1.00 . A A .  12 THR CG2  1 1 
        1  194 1 1 11 THR H    H  -2.884  3.700  -1.807 1.00 . A A .  12 THR H    1 1 
        1  195 1 1 11 THR HA   H  -0.852  1.591  -1.908 1.00 . A A .  12 THR HA   1 1 
        1  196 1 1 11 THR HB   H  -1.102  4.162  -3.483 1.00 . A A .  12 THR HB   1 1 
        1  197 1 1 11 THR HG1  H  -2.430  2.709  -4.417 1.00 . A A .  12 THR HG1  1 1 
        1  198 1 1 11 THR HG21 H   0.859  3.329  -4.758 1.00 . A A .  12 THR HG21 1 1 
        1  199 1 1 11 THR HG22 H   1.051  2.042  -3.567 1.00 . A A .  12 THR HG22 1 1 
        1  200 1 1 11 THR HG23 H   1.244  3.726  -3.086 1.00 . A A .  12 THR HG23 1 1 
        1  201 1 1 11 THR N    N  -2.487  2.822  -1.638 1.00 . A A .  12 THR N    1 1 
        1  202 1 1 11 THR O    O  -0.384  4.611  -0.780 1.00 . A A .  12 THR O    1 1 
        1  203 1 1 11 THR OG1  O  -1.535  2.344  -4.338 1.00 . A A .  12 THR OG1  1 1 
        1  204 1 1 12 SER C    C   3.085  3.003   0.238 1.00 . A A .  13 SER C    1 1 
        1  205 1 1 12 SER CA   C   1.633  3.338   0.599 1.00 . A A .  13 SER CA   1 1 
        1  206 1 1 12 SER CB   C   1.323  2.888   2.031 1.00 . A A .  13 SER CB   1 1 
        1  207 1 1 12 SER H    H   0.787  1.740  -0.491 1.00 . A A .  13 SER H    1 1 
        1  208 1 1 12 SER HA   H   1.485  4.405   0.530 1.00 . A A .  13 SER HA   1 1 
        1  209 1 1 12 SER HB2  H   0.296  3.128   2.265 1.00 . A A .  13 SER HB2  1 1 
        1  210 1 1 12 SER HB3  H   1.468  1.822   2.109 1.00 . A A .  13 SER HB3  1 1 
        1  211 1 1 12 SER HG   H   2.040  4.491   2.925 1.00 . A A .  13 SER HG   1 1 
        1  212 1 1 12 SER N    N   0.720  2.705  -0.336 1.00 . A A .  13 SER N    1 1 
        1  213 1 1 12 SER O    O   3.511  1.852   0.354 1.00 . A A .  13 SER O    1 1 
        1  214 1 1 12 SER OG   O   2.163  3.534   2.976 1.00 . A A .  13 SER OG   1 1 
        1  215 1 1 13 CYS C    C   6.007  4.864   0.355 1.00 . A A .  14 CYS C    1 1 
        1  216 1 1 13 CYS CA   C   5.246  3.855  -0.491 1.00 . A A .  14 CYS CA   1 1 
        1  217 1 1 13 CYS CB   C   5.569  4.078  -1.971 1.00 . A A .  14 CYS CB   1 1 
        1  218 1 1 13 CYS H    H   3.395  4.861  -0.448 1.00 . A A .  14 CYS H    1 1 
        1  219 1 1 13 CYS HA   H   5.541  2.857  -0.205 1.00 . A A .  14 CYS HA   1 1 
        1  220 1 1 13 CYS HB2  H   5.241  5.066  -2.257 1.00 . A A .  14 CYS HB2  1 1 
        1  221 1 1 13 CYS HB3  H   6.639  4.007  -2.110 1.00 . A A .  14 CYS HB3  1 1 
        1  222 1 1 13 CYS N    N   3.822  3.999  -0.244 1.00 . A A .  14 CYS N    1 1 
        1  223 1 1 13 CYS O    O   5.849  6.073   0.177 1.00 . A A .  14 CYS O    1 1 
        1  224 1 1 13 CYS SG   S   4.784  2.889  -3.106 1.00 . A A .  14 CYS SG   1 1 
        1  225 1 1 14 LYS C    C   8.961  4.669   2.412 1.00 . A A .  15 LYS C    1 1 
        1  226 1 1 14 LYS CA   C   7.578  5.249   2.151 1.00 . A A .  15 LYS CA   1 1 
        1  227 1 1 14 LYS CB   C   6.846  5.495   3.476 1.00 . A A .  15 LYS CB   1 1 
        1  228 1 1 14 LYS CD   C   7.964  7.720   3.750 1.00 . A A .  15 LYS CD   1 1 
        1  229 1 1 14 LYS CE   C   9.294  8.266   4.245 1.00 . A A .  15 LYS CE   1 1 
        1  230 1 1 14 LYS CG   C   7.622  6.399   4.418 1.00 . A A .  15 LYS CG   1 1 
        1  231 1 1 14 LYS H    H   6.899  3.401   1.384 1.00 . A A .  15 LYS H    1 1 
        1  232 1 1 14 LYS HA   H   7.695  6.192   1.639 1.00 . A A .  15 LYS HA   1 1 
        1  233 1 1 14 LYS HB2  H   5.891  5.954   3.271 1.00 . A A .  15 LYS HB2  1 1 
        1  234 1 1 14 LYS HB3  H   6.685  4.548   3.971 1.00 . A A .  15 LYS HB3  1 1 
        1  235 1 1 14 LYS HD2  H   8.021  7.568   2.682 1.00 . A A .  15 LYS HD2  1 1 
        1  236 1 1 14 LYS HD3  H   7.186  8.434   3.973 1.00 . A A .  15 LYS HD3  1 1 
        1  237 1 1 14 LYS HE2  H   9.534  9.158   3.686 1.00 . A A .  15 LYS HE2  1 1 
        1  238 1 1 14 LYS HE3  H   9.201  8.511   5.293 1.00 . A A .  15 LYS HE3  1 1 
        1  239 1 1 14 LYS HG2  H   7.021  6.593   5.294 1.00 . A A .  15 LYS HG2  1 1 
        1  240 1 1 14 LYS HG3  H   8.537  5.904   4.707 1.00 . A A .  15 LYS HG3  1 1 
        1  241 1 1 14 LYS HZ1  H  10.373  6.582   4.852 1.00 . A A .  15 LYS HZ1  1 1 
        1  242 1 1 14 LYS HZ2  H  11.321  7.756   4.077 1.00 . A A .  15 LYS HZ2  1 1 
        1  243 1 1 14 LYS HZ3  H  10.284  6.766   3.169 1.00 . A A .  15 LYS HZ3  1 1 
        1  244 1 1 14 LYS N    N   6.812  4.374   1.283 1.00 . A A .  15 LYS N    1 1 
        1  245 1 1 14 LYS NZ   N  10.394  7.276   4.074 1.00 . A A .  15 LYS NZ   1 1 
        1  246 1 1 14 LYS O    O   9.048  3.544   2.943 1.00 . A A .  15 LYS O    1 1 
        1  247 1 1 14 LYS OXT  O   9.960  5.357   2.105 1.00 . A A .  15 LYS OXT  1 1 
        1  248 2 2  1 .   C1   C   9.365 -2.486   0.099 1.00 . B A . 101 OCA C1   1 1 
        1  249 2 2  1 .   C2   C   8.975 -2.636   1.564 1.00 . B A . 101 OCA C2   1 1 
        1  250 2 2  1 .   C3   C   7.490 -2.905   1.761 1.00 . B A . 101 OCA C3   1 1 
        1  251 2 2  1 .   C4   C   7.202 -3.383   3.175 1.00 . B A . 101 OCA C4   1 1 
        1  252 2 2  1 .   C5   C   5.979 -2.702   3.766 1.00 . B A . 101 OCA C5   1 1 
        1  253 2 2  1 .   C6   C   6.210 -1.212   3.965 1.00 . B A . 101 OCA C6   1 1 
        1  254 2 2  1 .   C7   C   5.451 -0.679   5.172 1.00 . B A . 101 OCA C7   1 1 
        1  255 2 2  1 .   C8   C   5.945 -1.290   6.465 1.00 . B A . 101 OCA C8   1 1 
        1  256 2 2  1 .   H21  H   9.234 -1.725   2.084 1.00 . B A . 101 OCA H21  1 1 
        1  257 2 2  1 .   H22  H   9.533 -3.458   1.984 1.00 . B A . 101 OCA H22  1 1 
        1  258 2 2  1 .   H31  H   7.175 -3.666   1.063 1.00 . B A . 101 OCA H31  1 1 
        1  259 2 2  1 .   H32  H   6.940 -1.993   1.579 1.00 . B A . 101 OCA H32  1 1 
        1  260 2 2  1 .   H41  H   7.031 -4.449   3.155 1.00 . B A . 101 OCA H41  1 1 
        1  261 2 2  1 .   H42  H   8.057 -3.165   3.797 1.00 . B A . 101 OCA H42  1 1 
        1  262 2 2  1 .   H51  H   5.143 -2.842   3.098 1.00 . B A . 101 OCA H51  1 1 
        1  263 2 2  1 .   H52  H   5.757 -3.151   4.723 1.00 . B A . 101 OCA H52  1 1 
        1  264 2 2  1 .   H61  H   7.265 -1.040   4.111 1.00 . B A . 101 OCA H61  1 1 
        1  265 2 2  1 .   H62  H   5.877 -0.686   3.082 1.00 . B A . 101 OCA H62  1 1 
        1  266 2 2  1 .   H71  H   5.585  0.391   5.230 1.00 . B A . 101 OCA H71  1 1 
        1  267 2 2  1 .   H72  H   4.402 -0.912   5.064 1.00 . B A . 101 OCA H72  1 1 
        1  268 2 2  1 .   H81  H   5.111 -1.716   7.005 1.00 . B A . 101 OCA H81  1 1 
        1  269 2 2  1 .   H82  H   6.413 -0.526   7.068 1.00 . B A . 101 OCA H82  1 1 
        1  270 2 2  1 .   H83  H   6.664 -2.066   6.245 1.00 . B A . 101 OCA H83  1 1 
        1  271 2 2  1 .   O1   O   9.658 -3.433  -0.633 1.00 . B A . 101 OCA O1   1 1 
        2  272 1 1  1 PRO C    C   7.220  0.379  -0.264 1.00 . A A .   2 PRO C    1 1 
        2  273 1 1  1 PRO CA   C   8.703  0.043  -0.382 1.00 . A A .   2 PRO CA   1 1 
        2  274 1 1  1 PRO CB   C   9.487  1.264  -0.849 1.00 . A A .   2 PRO CB   1 1 
        2  275 1 1  1 PRO CD   C   9.276 -0.243  -2.723 1.00 . A A .   2 PRO CD   1 1 
        2  276 1 1  1 PRO CG   C   9.421  1.210  -2.340 1.00 . A A .   2 PRO CG   1 1 
        2  277 1 1  1 PRO HA   H   9.081 -0.293   0.572 1.00 . A A .   2 PRO HA   1 1 
        2  278 1 1  1 PRO HB2  H   9.024  2.162  -0.464 1.00 . A A .   2 PRO HB2  1 1 
        2  279 1 1  1 PRO HB3  H  10.506  1.197  -0.499 1.00 . A A .   2 PRO HB3  1 1 
        2  280 1 1  1 PRO HD2  H   8.465 -0.367  -3.423 1.00 . A A .   2 PRO HD2  1 1 
        2  281 1 1  1 PRO HD3  H  10.198 -0.612  -3.146 1.00 . A A .   2 PRO HD3  1 1 
        2  282 1 1  1 PRO HG2  H   8.565  1.772  -2.687 1.00 . A A .   2 PRO HG2  1 1 
        2  283 1 1  1 PRO HG3  H  10.330  1.618  -2.758 1.00 . A A .   2 PRO HG3  1 1 
        2  284 1 1  1 PRO N    N   8.973 -0.925  -1.450 1.00 . A A .   2 PRO N    1 1 
        2  285 1 1  1 PRO O    O   6.817  1.191   0.564 1.00 . A A .   2 PRO O    1 1 
        2  286 1 1  2 CYS C    C   4.201 -1.143  -0.565 1.00 . A A .   3 CYS C    1 1 
        2  287 1 1  2 CYS CA   C   4.993  0.035  -1.128 1.00 . A A .   3 CYS CA   1 1 
        2  288 1 1  2 CYS CB   C   4.556  0.338  -2.562 1.00 . A A .   3 CYS CB   1 1 
        2  289 1 1  2 CYS H    H   6.778 -0.933  -1.699 1.00 . A A .   3 CYS H    1 1 
        2  290 1 1  2 CYS HA   H   4.822  0.909  -0.516 1.00 . A A .   3 CYS HA   1 1 
        2  291 1 1  2 CYS HB2  H   4.674 -0.551  -3.161 1.00 . A A .   3 CYS HB2  1 1 
        2  292 1 1  2 CYS HB3  H   3.519  0.634  -2.561 1.00 . A A .   3 CYS HB3  1 1 
        2  293 1 1  2 CYS N    N   6.413 -0.253  -1.096 1.00 . A A .   3 CYS N    1 1 
        2  294 1 1  2 CYS O    O   4.295 -2.262  -1.074 1.00 . A A .   3 CYS O    1 1 
        2  295 1 1  2 CYS SG   S   5.515  1.672  -3.361 1.00 . A A .   3 CYS SG   1 1 
        2  296 1 1  3 LYS C    C   1.156 -1.637   0.865 1.00 . A A .   4 LYS C    1 1 
        2  297 1 1  3 LYS CA   C   2.627 -1.926   1.110 1.00 . A A .   4 LYS CA   1 1 
        2  298 1 1  3 LYS CB   C   2.888 -1.995   2.616 1.00 . A A .   4 LYS CB   1 1 
        2  299 1 1  3 LYS CD   C   2.896 -4.503   2.768 1.00 . A A .   4 LYS CD   1 1 
        2  300 1 1  3 LYS CE   C   2.303 -5.729   3.445 1.00 . A A .   4 LYS CE   1 1 
        2  301 1 1  3 LYS CG   C   2.269 -3.218   3.282 1.00 . A A .   4 LYS CG   1 1 
        2  302 1 1  3 LYS H    H   3.404  0.021   0.857 1.00 . A A .   4 LYS H    1 1 
        2  303 1 1  3 LYS HA   H   2.885 -2.873   0.655 1.00 . A A .   4 LYS HA   1 1 
        2  304 1 1  3 LYS HB2  H   3.950 -2.017   2.788 1.00 . A A .   4 LYS HB2  1 1 
        2  305 1 1  3 LYS HB3  H   2.477 -1.113   3.083 1.00 . A A .   4 LYS HB3  1 1 
        2  306 1 1  3 LYS HD2  H   2.721 -4.575   1.705 1.00 . A A .   4 LYS HD2  1 1 
        2  307 1 1  3 LYS HD3  H   3.959 -4.475   2.958 1.00 . A A .   4 LYS HD3  1 1 
        2  308 1 1  3 LYS HE2  H   2.850 -6.601   3.117 1.00 . A A .   4 LYS HE2  1 1 
        2  309 1 1  3 LYS HE3  H   2.410 -5.619   4.515 1.00 . A A .   4 LYS HE3  1 1 
        2  310 1 1  3 LYS HG2  H   2.424 -3.154   4.348 1.00 . A A .   4 LYS HG2  1 1 
        2  311 1 1  3 LYS HG3  H   1.212 -3.233   3.070 1.00 . A A .   4 LYS HG3  1 1 
        2  312 1 1  3 LYS HZ1  H   0.748 -6.193   2.119 1.00 . A A .   4 LYS HZ1  1 1 
        2  313 1 1  3 LYS HZ2  H   0.342 -5.033   3.279 1.00 . A A .   4 LYS HZ2  1 1 
        2  314 1 1  3 LYS HZ3  H   0.454 -6.661   3.723 1.00 . A A .   4 LYS HZ3  1 1 
        2  315 1 1  3 LYS N    N   3.437 -0.890   0.492 1.00 . A A .   4 LYS N    1 1 
        2  316 1 1  3 LYS NZ   N   0.863 -5.914   3.117 1.00 . A A .   4 LYS NZ   1 1 
        2  317 1 1  3 LYS O    O   0.638 -0.607   1.300 1.00 . A A .   4 LYS O    1 1 
        2  318 1 1  4 ASN C    C  -1.737 -3.377   0.716 1.00 . A A .   5 ASN C    1 1 
        2  319 1 1  4 ASN CA   C  -0.937 -2.347  -0.086 1.00 . A A .   5 ASN CA   1 1 
        2  320 1 1  4 ASN CB   C  -1.232 -2.513  -1.580 1.00 . A A .   5 ASN CB   1 1 
        2  321 1 1  4 ASN CG   C  -0.333 -1.656  -2.461 1.00 . A A .   5 ASN CG   1 1 
        2  322 1 1  4 ASN H    H   0.943 -3.331  -0.181 1.00 . A A .   5 ASN H    1 1 
        2  323 1 1  4 ASN HA   H  -1.201 -1.346   0.215 1.00 . A A .   5 ASN HA   1 1 
        2  324 1 1  4 ASN HB2  H  -1.092 -3.547  -1.851 1.00 . A A .   5 ASN HB2  1 1 
        2  325 1 1  4 ASN HB3  H  -2.261 -2.233  -1.766 1.00 . A A .   5 ASN HB3  1 1 
        2  326 1 1  4 ASN HD21 H  -1.631 -0.147  -2.407 1.00 . A A .   5 ASN HD21 1 1 
        2  327 1 1  4 ASN HD22 H  -0.197  0.116  -3.343 1.00 . A A .   5 ASN HD22 1 1 
        2  328 1 1  4 ASN N    N   0.480 -2.532   0.169 1.00 . A A .   5 ASN N    1 1 
        2  329 1 1  4 ASN ND2  N  -0.761 -0.440  -2.765 1.00 . A A .   5 ASN ND2  1 1 
        2  330 1 1  4 ASN O    O  -1.681 -4.570   0.422 1.00 . A A .   5 ASN O    1 1 
        2  331 1 1  4 ASN OD1  O   0.741 -2.093  -2.871 1.00 . A A .   5 ASN OD1  1 1 
        2  332 1 1  5 .   C    C  -4.479 -4.332   1.825 1.00 . A A .   6 O6H C    1 1 
        2  333 1 1  5 .   CA   C  -3.260 -3.813   2.576 1.00 . A A .   6 O6H CA   1 1 
        2  334 1 1  5 .   CB   C  -3.680 -3.124   3.881 1.00 . A A .   6 O6H CB   1 1 
        2  335 1 1  5 .   CD1  C  -2.225 -1.247   4.713 1.00 . A A .   6 O6H CD1  1 1 
        2  336 1 1  5 .   CD2  C  -1.694 -3.463   5.411 1.00 . A A .   6 O6H CD2  1 1 
        2  337 1 1  5 .   CE1  C  -1.159 -0.755   5.433 1.00 . A A .   6 O6H CE1  1 1 
        2  338 1 1  5 .   CE2  C  -0.622 -2.981   6.138 1.00 . A A .   6 O6H CE2  1 1 
        2  339 1 1  5 .   CF1  C  -3.084 -0.291   3.947 1.00 . A A .   6 O6H CF1  1 1 
        2  340 1 1  5 .   CF2  C  -1.969 -4.941   5.412 1.00 . A A .   6 O6H CF2  1 1 
        2  341 1 1  5 .   CG   C  -2.516 -2.606   4.685 1.00 . A A .   6 O6H CG   1 1 
        2  342 1 1  5 .   CH   C   0.797 -1.087   6.923 1.00 . A A .   6 O6H CH   1 1 
        2  343 1 1  5 .   CZ   C  -0.362 -1.624   6.142 1.00 . A A .   6 O6H CZ   1 1 
        2  344 1 1  5 .   H1   H  -2.434 -1.971   1.973 1.00 . A A .   6 O6H H1   1 1 
        2  345 1 1  5 .   HA   H  -2.639 -4.659   2.826 1.00 . A A .   6 O6H HA   1 1 
        2  346 1 1  5 .   HB1  H  -4.224 -3.825   4.499 1.00 . A A .   6 O6H HB1  1 1 
        2  347 1 1  5 .   HB2  H  -4.318 -2.284   3.650 1.00 . A A .   6 O6H HB2  1 1 
        2  348 1 1  5 .   HE1  H  -0.954  0.305   5.441 1.00 . A A .   6 O6H HE1  1 1 
        2  349 1 1  5 .   HE2  H   0.010 -3.660   6.696 1.00 . A A .   6 O6H HE2  1 1 
        2  350 1 1  5 .   HF11 H  -4.078 -0.193   4.354 1.00 . A A .   6 O6H HF11 1 1 
        2  351 1 1  5 .   HF12 H  -3.226 -0.576   2.915 1.00 . A A .   6 O6H HF12 1 1 
        2  352 1 1  5 .   HF13 H  -2.688  0.714   3.915 1.00 . A A .   6 O6H HF13 1 1 
        2  353 1 1  5 .   HF21 H  -2.630 -5.253   6.207 1.00 . A A .   6 O6H HF21 1 1 
        2  354 1 1  5 .   HF22 H  -2.431 -5.291   4.501 1.00 . A A .   6 O6H HF22 1 1 
        2  355 1 1  5 .   HF23 H  -1.079 -5.541   5.529 1.00 . A A .   6 O6H HF23 1 1 
        2  356 1 1  5 .   HH1  H   1.685 -1.697   6.847 1.00 . A A .   6 O6H HH1  1 1 
        2  357 1 1  5 .   HH2  H   0.596 -1.004   7.980 1.00 . A A .   6 O6H HH2  1 1 
        2  358 1 1  5 .   HH3  H   1.103 -0.098   6.612 1.00 . A A .   6 O6H HH3  1 1 
        2  359 1 1  5 .   N    N  -2.454 -2.924   1.749 1.00 . A A .   6 O6H N    1 1 
        2  360 1 1  5 .   O    O  -4.858 -5.494   1.963 1.00 . A A .   6 O6H O    1 1 
        2  361 1 1  6 PHE C    C  -6.286 -3.982  -1.050 1.00 . A A .   7 PHE C    1 1 
        2  362 1 1  6 PHE CA   C  -6.400 -3.760   0.455 1.00 . A A .   7 PHE CA   1 1 
        2  363 1 1  6 PHE CB   C  -7.392 -2.623   0.734 1.00 . A A .   7 PHE CB   1 1 
        2  364 1 1  6 PHE CD1  C  -7.454 -2.836   3.241 1.00 . A A .   7 PHE CD1  1 1 
        2  365 1 1  6 PHE CD2  C  -6.998 -0.699   2.288 1.00 . A A .   7 PHE CD2  1 1 
        2  366 1 1  6 PHE CE1  C  -7.342 -2.296   4.508 1.00 . A A .   7 PHE CE1  1 1 
        2  367 1 1  6 PHE CE2  C  -6.888 -0.153   3.550 1.00 . A A .   7 PHE CE2  1 1 
        2  368 1 1  6 PHE CG   C  -7.283 -2.042   2.117 1.00 . A A .   7 PHE CG   1 1 
        2  369 1 1  6 PHE CZ   C  -7.058 -0.954   4.663 1.00 . A A .   7 PHE CZ   1 1 
        2  370 1 1  6 PHE H    H  -4.673 -2.599   0.853 1.00 . A A .   7 PHE H    1 1 
        2  371 1 1  6 PHE HA   H  -6.769 -4.664   0.913 1.00 . A A .   7 PHE HA   1 1 
        2  372 1 1  6 PHE HB2  H  -7.220 -1.825   0.027 1.00 . A A .   7 PHE HB2  1 1 
        2  373 1 1  6 PHE HB3  H  -8.400 -2.996   0.608 1.00 . A A .   7 PHE HB3  1 1 
        2  374 1 1  6 PHE HD1  H  -7.676 -3.886   3.121 1.00 . A A .   7 PHE HD1  1 1 
        2  375 1 1  6 PHE HD2  H  -6.865 -0.070   1.418 1.00 . A A .   7 PHE HD2  1 1 
        2  376 1 1  6 PHE HE1  H  -7.476 -2.923   5.377 1.00 . A A .   7 PHE HE1  1 1 
        2  377 1 1  6 PHE HE2  H  -6.665  0.897   3.667 1.00 . A A .   7 PHE HE2  1 1 
        2  378 1 1  6 PHE HZ   H  -6.970 -0.530   5.650 1.00 . A A .   7 PHE HZ   1 1 
        2  379 1 1  6 PHE N    N  -5.097 -3.461   1.039 1.00 . A A .   7 PHE N    1 1 
        2  380 1 1  6 PHE O    O  -7.186 -4.546  -1.669 1.00 . A A .   7 PHE O    1 1 
        2  381 1 1  7 DTR C    C  -4.683 -2.349  -3.759 1.00 . A A .   8 DTR C    1 1 
        2  382 1 1  7 DTR CA   C  -4.960 -3.686  -3.057 1.00 . A A .   8 DTR CA   1 1 
        2  383 1 1  7 DTR CB   C  -3.788 -4.656  -3.273 1.00 . A A .   8 DTR CB   1 1 
        2  384 1 1  7 DTR CD1  C  -4.132 -5.694  -5.587 1.00 . A A .   8 DTR CD1  1 1 
        2  385 1 1  7 DTR CD2  C  -2.412 -4.265  -5.470 1.00 . A A .   8 DTR CD2  1 1 
        2  386 1 1  7 DTR CE2  C  -2.504 -4.747  -6.786 1.00 . A A .   8 DTR CE2  1 1 
        2  387 1 1  7 DTR CE3  C  -1.402 -3.350  -5.158 1.00 . A A .   8 DTR CE3  1 1 
        2  388 1 1  7 DTR CG   C  -3.470 -4.875  -4.720 1.00 . A A .   8 DTR CG   1 1 
        2  389 1 1  7 DTR CH2  C  -0.646 -3.447  -7.457 1.00 . A A .   8 DTR CH2  1 1 
        2  390 1 1  7 DTR CZ2  C  -1.626 -4.346  -7.790 1.00 . A A .   8 DTR CZ2  1 1 
        2  391 1 1  7 DTR CZ3  C  -0.527 -2.955  -6.152 1.00 . A A .   8 DTR CZ3  1 1 
        2  392 1 1  7 DTR H    H  -4.554 -2.993  -1.109 1.00 . A A .   8 DTR H    1 1 
        2  393 1 1  7 DTR HA   H  -5.829 -4.169  -3.486 1.00 . A A .   8 DTR HA   1 1 
        2  394 1 1  7 DTR HB2  H  -2.904 -4.261  -2.793 1.00 . A A .   8 DTR HB2  1 1 
        2  395 1 1  7 DTR HB3  H  -4.035 -5.611  -2.835 1.00 . A A .   8 DTR HB3  1 1 
        2  396 1 1  7 DTR HD1  H  -4.985 -6.303  -5.321 1.00 . A A .   8 DTR HD1  1 1 
        2  397 1 1  7 DTR HE1  H  -3.865 -6.114  -7.630 1.00 . A A .   8 DTR HE1  1 1 
        2  398 1 1  7 DTR HE3  H  -1.295 -2.958  -4.157 1.00 . A A .   8 DTR HE3  1 1 
        2  399 1 1  7 DTR HH2  H   0.061 -3.113  -8.204 1.00 . A A .   8 DTR HH2  1 1 
        2  400 1 1  7 DTR HZ2  H  -1.717 -4.703  -8.801 1.00 . A A .   8 DTR HZ2  1 1 
        2  401 1 1  7 DTR HZ3  H   0.260 -2.248  -5.928 1.00 . A A .   8 DTR HZ3  1 1 
        2  402 1 1  7 DTR N    N  -5.203 -3.495  -1.638 1.00 . A A .   8 DTR N    1 1 
        2  403 1 1  7 DTR NE1  N  -3.561 -5.618  -6.833 1.00 . A A .   8 DTR NE1  1 1 
        2  404 1 1  7 DTR O    O  -3.783 -1.615  -3.354 1.00 . A A .   8 DTR O    1 1 
        2  405 1 1  8 LYS C    C  -5.921  0.382  -4.982 1.00 . A A .   9 LYS C    1 1 
        2  406 1 1  8 LYS CA   C  -5.204 -0.823  -5.584 1.00 . A A .   9 LYS CA   1 1 
        2  407 1 1  8 LYS CB   C  -5.693 -1.040  -7.023 1.00 . A A .   9 LYS CB   1 1 
        2  408 1 1  8 LYS CD   C  -3.948 -2.150  -8.456 1.00 . A A .   9 LYS CD   1 1 
        2  409 1 1  8 LYS CE   C  -4.204 -1.494  -9.807 1.00 . A A .   9 LYS CE   1 1 
        2  410 1 1  8 LYS CG   C  -5.224 -2.337  -7.651 1.00 . A A .   9 LYS CG   1 1 
        2  411 1 1  8 LYS H    H  -6.258 -2.560  -5.004 1.00 . A A .   9 LYS H    1 1 
        2  412 1 1  8 LYS HA   H  -4.138 -0.642  -5.588 1.00 . A A .   9 LYS HA   1 1 
        2  413 1 1  8 LYS HB2  H  -6.772 -1.029  -7.034 1.00 . A A .   9 LYS HB2  1 1 
        2  414 1 1  8 LYS HB3  H  -5.327 -0.231  -7.636 1.00 . A A .   9 LYS HB3  1 1 
        2  415 1 1  8 LYS HD2  H  -3.268 -1.530  -7.892 1.00 . A A .   9 LYS HD2  1 1 
        2  416 1 1  8 LYS HD3  H  -3.499 -3.117  -8.619 1.00 . A A .   9 LYS HD3  1 1 
        2  417 1 1  8 LYS HE2  H  -3.361 -1.698 -10.451 1.00 . A A .   9 LYS HE2  1 1 
        2  418 1 1  8 LYS HE3  H  -5.092 -1.931 -10.238 1.00 . A A .   9 LYS HE3  1 1 
        2  419 1 1  8 LYS HG2  H  -5.038 -3.055  -6.868 1.00 . A A .   9 LYS HG2  1 1 
        2  420 1 1  8 LYS HG3  H  -6.001 -2.708  -8.304 1.00 . A A .   9 LYS HG3  1 1 
        2  421 1 1  8 LYS HZ1  H  -4.618  0.379 -10.642 1.00 . A A .   9 LYS HZ1  1 1 
        2  422 1 1  8 LYS HZ2  H  -3.507  0.428  -9.367 1.00 . A A .   9 LYS HZ2  1 1 
        2  423 1 1  8 LYS HZ3  H  -5.156  0.213  -9.042 1.00 . A A .   9 LYS HZ3  1 1 
        2  424 1 1  8 LYS N    N  -5.470 -2.009  -4.782 1.00 . A A .   9 LYS N    1 1 
        2  425 1 1  8 LYS NZ   N  -4.387 -0.018  -9.705 1.00 . A A .   9 LYS NZ   1 1 
        2  426 1 1  8 LYS O    O  -5.810  1.501  -5.480 1.00 . A A .   9 LYS O    1 1 
        2  427 1 1  9 THR C    C  -6.555  2.065  -2.361 1.00 . A A .  10 THR C    1 1 
        2  428 1 1  9 THR CA   C  -7.431  1.178  -3.250 1.00 . A A .  10 THR CA   1 1 
        2  429 1 1  9 THR CB   C  -8.544  0.545  -2.392 1.00 . A A .  10 THR CB   1 1 
        2  430 1 1  9 THR CG2  C  -9.611  1.572  -2.036 1.00 . A A .  10 THR CG2  1 1 
        2  431 1 1  9 THR H    H  -6.688 -0.775  -3.549 1.00 . A A .  10 THR H    1 1 
        2  432 1 1  9 THR HA   H  -7.893  1.785  -4.013 1.00 . A A .  10 THR HA   1 1 
        2  433 1 1  9 THR HB   H  -8.106  0.168  -1.480 1.00 . A A .  10 THR HB   1 1 
        2  434 1 1  9 THR HG1  H  -9.314 -1.277  -2.503 1.00 . A A .  10 THR HG1  1 1 
        2  435 1 1  9 THR HG21 H  -9.162  2.378  -1.474 1.00 . A A .  10 THR HG21 1 1 
        2  436 1 1  9 THR HG22 H -10.378  1.101  -1.438 1.00 . A A .  10 THR HG22 1 1 
        2  437 1 1  9 THR HG23 H -10.050  1.964  -2.941 1.00 . A A .  10 THR HG23 1 1 
        2  438 1 1  9 THR N    N  -6.647  0.139  -3.898 1.00 . A A .  10 THR N    1 1 
        2  439 1 1  9 THR O    O  -6.779  3.272  -2.263 1.00 . A A .  10 THR O    1 1 
        2  440 1 1  9 THR OG1  O  -9.142 -0.538  -3.113 1.00 . A A .  10 THR OG1  1 1 
        2  441 1 1 10 PHE C    C  -3.225  2.171  -1.331 1.00 . A A .  11 PHE C    1 1 
        2  442 1 1 10 PHE CA   C  -4.687  2.181  -0.811 1.00 . A A .  11 PHE CA   1 1 
        2  443 1 1 10 PHE CB   C  -4.737  1.492   0.558 1.00 . A A .  11 PHE CB   1 1 
        2  444 1 1 10 PHE CD1  C  -4.961  3.029   2.530 1.00 . A A .  11 PHE CD1  1 1 
        2  445 1 1 10 PHE CD2  C  -2.772  2.351   1.873 1.00 . A A .  11 PHE CD2  1 1 
        2  446 1 1 10 PHE CE1  C  -4.425  3.776   3.559 1.00 . A A .  11 PHE CE1  1 1 
        2  447 1 1 10 PHE CE2  C  -2.230  3.097   2.901 1.00 . A A .  11 PHE CE2  1 1 
        2  448 1 1 10 PHE CG   C  -4.144  2.307   1.675 1.00 . A A .  11 PHE CG   1 1 
        2  449 1 1 10 PHE CZ   C  -3.058  3.811   3.745 1.00 . A A .  11 PHE CZ   1 1 
        2  450 1 1 10 PHE H    H  -5.365  0.526  -1.926 1.00 . A A .  11 PHE H    1 1 
        2  451 1 1 10 PHE HA   H  -5.078  3.180  -0.704 1.00 . A A .  11 PHE HA   1 1 
        2  452 1 1 10 PHE HB2  H  -5.766  1.285   0.812 1.00 . A A .  11 PHE HB2  1 1 
        2  453 1 1 10 PHE HB3  H  -4.194  0.559   0.501 1.00 . A A .  11 PHE HB3  1 1 
        2  454 1 1 10 PHE HD1  H  -6.031  3.002   2.389 1.00 . A A .  11 PHE HD1  1 1 
        2  455 1 1 10 PHE HD2  H  -2.123  1.792   1.212 1.00 . A A .  11 PHE HD2  1 1 
        2  456 1 1 10 PHE HE1  H  -5.074  4.334   4.217 1.00 . A A .  11 PHE HE1  1 1 
        2  457 1 1 10 PHE HE2  H  -1.160  3.122   3.045 1.00 . A A .  11 PHE HE2  1 1 
        2  458 1 1 10 PHE HZ   H  -2.636  4.393   4.548 1.00 . A A .  11 PHE HZ   1 1 
        2  459 1 1 10 PHE N    N  -5.547  1.467  -1.740 1.00 . A A .  11 PHE N    1 1 
        2  460 1 1 10 PHE O    O  -2.638  1.091  -1.411 1.00 . A A .  11 PHE O    1 1 
        2  461 1 1 11 THR C    C  -0.324  3.966  -1.115 1.00 . A A .  12 THR C    1 1 
        2  462 1 1 11 THR CA   C  -1.231  3.305  -2.145 1.00 . A A .  12 THR CA   1 1 
        2  463 1 1 11 THR CB   C  -1.076  4.033  -3.494 1.00 . A A .  12 THR CB   1 1 
        2  464 1 1 11 THR CG2  C  -1.719  3.243  -4.623 1.00 . A A .  12 THR CG2  1 1 
        2  465 1 1 11 THR H    H  -3.085  4.175  -1.705 1.00 . A A .  12 THR H    1 1 
        2  466 1 1 11 THR HA   H  -0.927  2.274  -2.274 1.00 . A A .  12 THR HA   1 1 
        2  467 1 1 11 THR HB   H  -0.021  4.142  -3.704 1.00 . A A .  12 THR HB   1 1 
        2  468 1 1 11 THR HG1  H  -1.292  5.819  -2.676 1.00 . A A .  12 THR HG1  1 1 
        2  469 1 1 11 THR HG21 H  -1.593  3.777  -5.553 1.00 . A A .  12 THR HG21 1 1 
        2  470 1 1 11 THR HG22 H  -2.772  3.118  -4.420 1.00 . A A .  12 THR HG22 1 1 
        2  471 1 1 11 THR HG23 H  -1.249  2.273  -4.698 1.00 . A A .  12 THR HG23 1 1 
        2  472 1 1 11 THR N    N  -2.613  3.318  -1.701 1.00 . A A .  12 THR N    1 1 
        2  473 1 1 11 THR O    O  -0.390  5.179  -0.902 1.00 . A A .  12 THR O    1 1 
        2  474 1 1 11 THR OG1  O  -1.677  5.333  -3.419 1.00 . A A .  12 THR OG1  1 1 
        2  475 1 1 12 SER C    C   2.850  3.215   0.233 1.00 . A A .  13 SER C    1 1 
        2  476 1 1 12 SER CA   C   1.429  3.683   0.535 1.00 . A A .  13 SER CA   1 1 
        2  477 1 1 12 SER CB   C   1.011  3.211   1.927 1.00 . A A .  13 SER CB   1 1 
        2  478 1 1 12 SER H    H   0.501  2.207  -0.658 1.00 . A A .  13 SER H    1 1 
        2  479 1 1 12 SER HA   H   1.390  4.762   0.501 1.00 . A A .  13 SER HA   1 1 
        2  480 1 1 12 SER HB2  H  -0.034  3.434   2.080 1.00 . A A .  13 SER HB2  1 1 
        2  481 1 1 12 SER HB3  H   1.164  2.145   2.002 1.00 . A A .  13 SER HB3  1 1 
        2  482 1 1 12 SER HG   H   1.226  3.928   3.744 1.00 . A A .  13 SER HG   1 1 
        2  483 1 1 12 SER N    N   0.506  3.168  -0.464 1.00 . A A .  13 SER N    1 1 
        2  484 1 1 12 SER O    O   3.095  2.012   0.126 1.00 . A A .  13 SER O    1 1 
        2  485 1 1 12 SER OG   O   1.766  3.855   2.939 1.00 . A A .  13 SER OG   1 1 
        2  486 1 1 13 CYS C    C   6.113  4.509   0.768 1.00 . A A .  14 CYS C    1 1 
        2  487 1 1 13 CYS CA   C   5.165  3.811  -0.202 1.00 . A A .  14 CYS CA   1 1 
        2  488 1 1 13 CYS CB   C   5.510  4.191  -1.645 1.00 . A A .  14 CYS CB   1 1 
        2  489 1 1 13 CYS H    H   3.544  5.097   0.224 1.00 . A A .  14 CYS H    1 1 
        2  490 1 1 13 CYS HA   H   5.272  2.741  -0.086 1.00 . A A .  14 CYS HA   1 1 
        2  491 1 1 13 CYS HB2  H   5.382  5.255  -1.768 1.00 . A A .  14 CYS HB2  1 1 
        2  492 1 1 13 CYS HB3  H   6.541  3.934  -1.840 1.00 . A A .  14 CYS HB3  1 1 
        2  493 1 1 13 CYS N    N   3.783  4.152   0.101 1.00 . A A .  14 CYS N    1 1 
        2  494 1 1 13 CYS O    O   6.266  5.733   0.736 1.00 . A A .  14 CYS O    1 1 
        2  495 1 1 13 CYS SG   S   4.482  3.361  -2.905 1.00 . A A .  14 CYS SG   1 1 
        2  496 1 1 14 LYS C    C   8.454  3.089   3.235 1.00 . A A .  15 LYS C    1 1 
        2  497 1 1 14 LYS CA   C   7.645  4.240   2.643 1.00 . A A .  15 LYS CA   1 1 
        2  498 1 1 14 LYS CB   C   6.885  5.021   3.734 1.00 . A A .  15 LYS CB   1 1 
        2  499 1 1 14 LYS CD   C   6.564  3.638   5.806 1.00 . A A .  15 LYS CD   1 1 
        2  500 1 1 14 LYS CE   C   5.865  2.388   6.307 1.00 . A A .  15 LYS CE   1 1 
        2  501 1 1 14 LYS CG   C   5.907  4.183   4.546 1.00 . A A .  15 LYS CG   1 1 
        2  502 1 1 14 LYS H    H   6.570  2.751   1.604 1.00 . A A .  15 LYS H    1 1 
        2  503 1 1 14 LYS HA   H   8.325  4.914   2.143 1.00 . A A .  15 LYS HA   1 1 
        2  504 1 1 14 LYS HB2  H   7.603  5.452   4.415 1.00 . A A .  15 LYS HB2  1 1 
        2  505 1 1 14 LYS HB3  H   6.331  5.820   3.261 1.00 . A A .  15 LYS HB3  1 1 
        2  506 1 1 14 LYS HD2  H   7.593  3.398   5.587 1.00 . A A .  15 LYS HD2  1 1 
        2  507 1 1 14 LYS HD3  H   6.525  4.393   6.577 1.00 . A A .  15 LYS HD3  1 1 
        2  508 1 1 14 LYS HE2  H   6.386  2.023   7.179 1.00 . A A .  15 LYS HE2  1 1 
        2  509 1 1 14 LYS HE3  H   4.850  2.641   6.572 1.00 . A A .  15 LYS HE3  1 1 
        2  510 1 1 14 LYS HG2  H   5.065  4.797   4.825 1.00 . A A .  15 LYS HG2  1 1 
        2  511 1 1 14 LYS HG3  H   5.570  3.356   3.938 1.00 . A A .  15 LYS HG3  1 1 
        2  512 1 1 14 LYS HZ1  H   6.720  1.362   4.700 1.00 . A A .  15 LYS HZ1  1 1 
        2  513 1 1 14 LYS HZ2  H   5.022  1.447   4.642 1.00 . A A .  15 LYS HZ2  1 1 
        2  514 1 1 14 LYS HZ3  H   5.784  0.388   5.728 1.00 . A A .  15 LYS HZ3  1 1 
        2  515 1 1 14 LYS N    N   6.728  3.723   1.642 1.00 . A A .  15 LYS N    1 1 
        2  516 1 1 14 LYS NZ   N   5.846  1.323   5.273 1.00 . A A .  15 LYS NZ   1 1 
        2  517 1 1 14 LYS O    O   9.690  3.217   3.329 1.00 . A A .  15 LYS O    1 1 
        2  518 1 1 14 LYS OXT  O   7.852  2.037   3.548 1.00 . A A .  15 LYS OXT  1 1 
        2  519 2 2  1 .   C1   C   8.971 -2.268  -1.279 1.00 . B A . 101 OCA C1   1 1 
        2  520 2 2  1 .   C2   C   8.773 -2.639   0.188 1.00 . B A . 101 OCA C2   1 1 
        2  521 2 2  1 .   C3   C  10.079 -2.839   0.965 1.00 . B A . 101 OCA C3   1 1 
        2  522 2 2  1 .   C4   C  11.270 -2.149   0.314 1.00 . B A . 101 OCA C4   1 1 
        2  523 2 2  1 .   C5   C  12.586 -2.686   0.854 1.00 . B A . 101 OCA C5   1 1 
        2  524 2 2  1 .   C6   C  13.362 -3.443  -0.217 1.00 . B A . 101 OCA C6   1 1 
        2  525 2 2  1 .   C7   C  13.086 -4.940  -0.168 1.00 . B A . 101 OCA C7   1 1 
        2  526 2 2  1 .   C8   C  13.585 -5.564   1.116 1.00 . B A . 101 OCA C8   1 1 
        2  527 2 2  1 .   H21  H   8.204 -3.557   0.232 1.00 . B A . 101 OCA H21  1 1 
        2  528 2 2  1 .   H22  H   8.209 -1.850   0.665 1.00 . B A . 101 OCA H22  1 1 
        2  529 2 2  1 .   H31  H   9.950 -2.439   1.959 1.00 . B A . 101 OCA H31  1 1 
        2  530 2 2  1 .   H32  H  10.286 -3.897   1.031 1.00 . B A . 101 OCA H32  1 1 
        2  531 2 2  1 .   H41  H  11.235 -2.317  -0.753 1.00 . B A . 101 OCA H41  1 1 
        2  532 2 2  1 .   H42  H  11.215 -1.088   0.516 1.00 . B A . 101 OCA H42  1 1 
        2  533 2 2  1 .   H51  H  13.187 -1.861   1.202 1.00 . B A . 101 OCA H51  1 1 
        2  534 2 2  1 .   H52  H  12.379 -3.356   1.675 1.00 . B A . 101 OCA H52  1 1 
        2  535 2 2  1 .   H61  H  13.073 -3.065  -1.186 1.00 . B A . 101 OCA H61  1 1 
        2  536 2 2  1 .   H62  H  14.418 -3.278  -0.063 1.00 . B A . 101 OCA H62  1 1 
        2  537 2 2  1 .   H71  H  13.587 -5.419  -0.996 1.00 . B A . 101 OCA H71  1 1 
        2  538 2 2  1 .   H72  H  12.021 -5.105  -0.239 1.00 . B A . 101 OCA H72  1 1 
        2  539 2 2  1 .   H81  H  13.100 -6.517   1.267 1.00 . B A . 101 OCA H81  1 1 
        2  540 2 2  1 .   H82  H  13.359 -4.910   1.944 1.00 . B A . 101 OCA H82  1 1 
        2  541 2 2  1 .   H83  H  14.654 -5.709   1.055 1.00 . B A . 101 OCA H83  1 1 
        2  542 2 2  1 .   O1   O   9.129 -3.094  -2.178 1.00 . B A . 101 OCA O1   1 1 
        3  543 1 1  1 PRO C    C   7.145  0.293   0.013 1.00 . A A .   2 PRO C    1 1 
        3  544 1 1  1 PRO CA   C   8.568 -0.258   0.108 1.00 . A A .   2 PRO CA   1 1 
        3  545 1 1  1 PRO CB   C   9.589  0.841  -0.230 1.00 . A A .   2 PRO CB   1 1 
        3  546 1 1  1 PRO CD   C   9.434 -0.700  -2.089 1.00 . A A .   2 PRO CD   1 1 
        3  547 1 1  1 PRO CG   C  10.247  0.429  -1.517 1.00 . A A .   2 PRO CG   1 1 
        3  548 1 1  1 PRO HA   H   8.744 -0.622   1.109 1.00 . A A .   2 PRO HA   1 1 
        3  549 1 1  1 PRO HB2  H   9.075  1.785  -0.340 1.00 . A A .   2 PRO HB2  1 1 
        3  550 1 1  1 PRO HB3  H  10.310  0.915   0.570 1.00 . A A .   2 PRO HB3  1 1 
        3  551 1 1  1 PRO HD2  H   8.671 -0.324  -2.755 1.00 . A A .   2 PRO HD2  1 1 
        3  552 1 1  1 PRO HD3  H  10.070 -1.409  -2.596 1.00 . A A .   2 PRO HD3  1 1 
        3  553 1 1  1 PRO HG2  H  10.257  1.263  -2.204 1.00 . A A .   2 PRO HG2  1 1 
        3  554 1 1  1 PRO HG3  H  11.255  0.098  -1.318 1.00 . A A .   2 PRO HG3  1 1 
        3  555 1 1  1 PRO N    N   8.840 -1.292  -0.893 1.00 . A A .   2 PRO N    1 1 
        3  556 1 1  1 PRO O    O   6.778  1.221   0.736 1.00 . A A .   2 PRO O    1 1 
        3  557 1 1  2 CYS C    C   4.043 -1.004  -0.562 1.00 . A A .   3 CYS C    1 1 
        3  558 1 1  2 CYS CA   C   4.959  0.122  -1.032 1.00 . A A .   3 CYS CA   1 1 
        3  559 1 1  2 CYS CB   C   4.657  0.473  -2.491 1.00 . A A .   3 CYS CB   1 1 
        3  560 1 1  2 CYS H    H   6.709 -0.982  -1.467 1.00 . A A .   3 CYS H    1 1 
        3  561 1 1  2 CYS HA   H   4.793  0.993  -0.416 1.00 . A A .   3 CYS HA   1 1 
        3  562 1 1  2 CYS HB2  H   4.728 -0.421  -3.092 1.00 . A A .   3 CYS HB2  1 1 
        3  563 1 1  2 CYS HB3  H   3.654  0.868  -2.559 1.00 . A A .   3 CYS HB3  1 1 
        3  564 1 1  2 CYS N    N   6.351 -0.276  -0.884 1.00 . A A .   3 CYS N    1 1 
        3  565 1 1  2 CYS O    O   4.040 -2.093  -1.138 1.00 . A A .   3 CYS O    1 1 
        3  566 1 1  2 CYS SG   S   5.791  1.710  -3.210 1.00 . A A .   3 CYS SG   1 1 
        3  567 1 1  3 LYS C    C   0.948 -1.472   0.788 1.00 . A A .   4 LYS C    1 1 
        3  568 1 1  3 LYS CA   C   2.415 -1.783   1.056 1.00 . A A .   4 LYS CA   1 1 
        3  569 1 1  3 LYS CB   C   2.662 -1.935   2.567 1.00 . A A .   4 LYS CB   1 1 
        3  570 1 1  3 LYS CD   C   1.605 -4.243   2.481 1.00 . A A .   4 LYS CD   1 1 
        3  571 1 1  3 LYS CE   C   2.921 -5.001   2.401 1.00 . A A .   4 LYS CE   1 1 
        3  572 1 1  3 LYS CG   C   1.730 -2.933   3.253 1.00 . A A .   4 LYS CG   1 1 
        3  573 1 1  3 LYS H    H   3.275  0.146   0.886 1.00 . A A .   4 LYS H    1 1 
        3  574 1 1  3 LYS HA   H   2.661 -2.715   0.569 1.00 . A A .   4 LYS HA   1 1 
        3  575 1 1  3 LYS HB2  H   3.681 -2.260   2.726 1.00 . A A .   4 LYS HB2  1 1 
        3  576 1 1  3 LYS HB3  H   2.524 -0.972   3.037 1.00 . A A .   4 LYS HB3  1 1 
        3  577 1 1  3 LYS HD2  H   0.879 -4.867   2.977 1.00 . A A .   4 LYS HD2  1 1 
        3  578 1 1  3 LYS HD3  H   1.265 -4.025   1.479 1.00 . A A .   4 LYS HD3  1 1 
        3  579 1 1  3 LYS HE2  H   3.708 -4.308   2.150 1.00 . A A .   4 LYS HE2  1 1 
        3  580 1 1  3 LYS HE3  H   3.123 -5.447   3.363 1.00 . A A .   4 LYS HE3  1 1 
        3  581 1 1  3 LYS HG2  H   2.112 -3.148   4.238 1.00 . A A .   4 LYS HG2  1 1 
        3  582 1 1  3 LYS HG3  H   0.750 -2.485   3.338 1.00 . A A .   4 LYS HG3  1 1 
        3  583 1 1  3 LYS HZ1  H   2.821 -5.652   0.417 1.00 . A A .   4 LYS HZ1  1 1 
        3  584 1 1  3 LYS HZ2  H   2.024 -6.671   1.510 1.00 . A A .   4 LYS HZ2  1 1 
        3  585 1 1  3 LYS HZ3  H   3.718 -6.676   1.431 1.00 . A A .   4 LYS HZ3  1 1 
        3  586 1 1  3 LYS N    N   3.276 -0.753   0.489 1.00 . A A .   4 LYS N    1 1 
        3  587 1 1  3 LYS NZ   N   2.869 -6.073   1.371 1.00 . A A .   4 LYS NZ   1 1 
        3  588 1 1  3 LYS O    O   0.437 -0.422   1.179 1.00 . A A .   4 LYS O    1 1 
        3  589 1 1  4 ASN C    C  -1.882 -3.362   0.609 1.00 . A A .   5 ASN C    1 1 
        3  590 1 1  4 ASN CA   C  -1.135 -2.269  -0.157 1.00 . A A .   5 ASN CA   1 1 
        3  591 1 1  4 ASN CB   C  -1.400 -2.425  -1.655 1.00 . A A .   5 ASN CB   1 1 
        3  592 1 1  4 ASN CG   C  -0.445 -1.619  -2.513 1.00 . A A .   5 ASN CG   1 1 
        3  593 1 1  4 ASN H    H   0.767 -3.181  -0.232 1.00 . A A .   5 ASN H    1 1 
        3  594 1 1  4 ASN HA   H  -1.462 -1.292   0.166 1.00 . A A .   5 ASN HA   1 1 
        3  595 1 1  4 ASN HB2  H  -1.299 -3.466  -1.925 1.00 . A A .   5 ASN HB2  1 1 
        3  596 1 1  4 ASN HB3  H  -2.408 -2.101  -1.872 1.00 . A A .   5 ASN HB3  1 1 
        3  597 1 1  4 ASN HD21 H  -1.665 -0.058  -2.446 1.00 . A A .   5 ASN HD21 1 1 
        3  598 1 1  4 ASN HD22 H  -0.204  0.160  -3.353 1.00 . A A .   5 ASN HD22 1 1 
        3  599 1 1  4 ASN N    N   0.284 -2.394   0.107 1.00 . A A .   5 ASN N    1 1 
        3  600 1 1  4 ASN ND2  N  -0.806 -0.384  -2.800 1.00 . A A .   5 ASN ND2  1 1 
        3  601 1 1  4 ASN O    O  -1.753 -4.539   0.280 1.00 . A A .   5 ASN O    1 1 
        3  602 1 1  4 ASN OD1  O   0.611 -2.105  -2.913 1.00 . A A .   5 ASN OD1  1 1 
        3  603 1 1  5 .   C    C  -4.544 -4.555   1.659 1.00 . A A .   6 O6H C    1 1 
        3  604 1 1  5 .   CA   C  -3.373 -3.968   2.437 1.00 . A A .   6 O6H CA   1 1 
        3  605 1 1  5 .   CB   C  -3.856 -3.375   3.765 1.00 . A A .   6 O6H CB   1 1 
        3  606 1 1  5 .   CD1  C  -2.585 -1.520   4.893 1.00 . A A .   6 O6H CD1  1 1 
        3  607 1 1  5 .   CD2  C  -1.829 -3.753   5.238 1.00 . A A .   6 O6H CD2  1 1 
        3  608 1 1  5 .   CE1  C  -1.563 -1.043   5.689 1.00 . A A .   6 O6H CE1  1 1 
        3  609 1 1  5 .   CE2  C  -0.805 -3.288   6.037 1.00 . A A .   6 O6H CE2  1 1 
        3  610 1 1  5 .   CF1  C  -3.548 -0.548   4.288 1.00 . A A .   6 O6H CF1  1 1 
        3  611 1 1  5 .   CF2  C  -1.958 -5.233   5.012 1.00 . A A .   6 O6H CF2  1 1 
        3  612 1 1  5 .   CG   C  -2.741 -2.876   4.650 1.00 . A A .   6 O6H CG   1 1 
        3  613 1 1  5 .   CH   C   0.435 -1.419   7.121 1.00 . A A .   6 O6H CH   1 1 
        3  614 1 1  5 .   CZ   C  -0.677 -1.932   6.257 1.00 . A A .   6 O6H CZ   1 1 
        3  615 1 1  5 .   H1   H  -2.680 -2.046   1.897 1.00 . A A .   6 O6H H1   1 1 
        3  616 1 1  5 .   HA   H  -2.688 -4.773   2.659 1.00 . A A .   6 O6H HA   1 1 
        3  617 1 1  5 .   HB1  H  -4.399 -4.133   4.310 1.00 . A A .   6 O6H HB1  1 1 
        3  618 1 1  5 .   HB2  H  -4.516 -2.546   3.562 1.00 . A A .   6 O6H HB2  1 1 
        3  619 1 1  5 .   HE1  H  -1.457  0.017   5.865 1.00 . A A .   6 O6H HE1  1 1 
        3  620 1 1  5 .   HE2  H  -0.107 -3.980   6.484 1.00 . A A .   6 O6H HE2  1 1 
        3  621 1 1  5 .   HF11 H  -4.436 -0.401   4.883 1.00 . A A .   6 O6H HF11 1 1 
        3  622 1 1  5 .   HF12 H  -3.903 -0.849   3.311 1.00 . A A .   6 O6H HF12 1 1 
        3  623 1 1  5 .   HF13 H  -3.131  0.436   4.150 1.00 . A A .   6 O6H HF13 1 1 
        3  624 1 1  5 .   HF21 H  -1.093 -5.671   4.536 1.00 . A A .   6 O6H HF21 1 1 
        3  625 1 1  5 .   HF22 H  -2.095 -5.792   5.924 1.00 . A A .   6 O6H HF22 1 1 
        3  626 1 1  5 .   HF23 H  -2.796 -5.500   4.385 1.00 . A A .   6 O6H HF23 1 1 
        3  627 1 1  5 .   HH1  H   1.372 -1.931   6.963 1.00 . A A .   6 O6H HH1  1 1 
        3  628 1 1  5 .   HH2  H   0.234 -1.511   8.177 1.00 . A A .   6 O6H HH2  1 1 
        3  629 1 1  5 .   HH3  H   0.651 -0.373   6.962 1.00 . A A .   6 O6H HH3  1 1 
        3  630 1 1  5 .   N    N  -2.632 -2.990   1.646 1.00 . A A .   6 O6H N    1 1 
        3  631 1 1  5 .   O    O  -4.840 -5.745   1.773 1.00 . A A .   6 O6H O    1 1 
        3  632 1 1  6 PHE C    C  -6.270 -4.231  -1.266 1.00 . A A .   7 PHE C    1 1 
        3  633 1 1  6 PHE CA   C  -6.469 -4.121   0.238 1.00 . A A .   7 PHE CA   1 1 
        3  634 1 1  6 PHE CB   C  -7.596 -3.120   0.524 1.00 . A A .   7 PHE CB   1 1 
        3  635 1 1  6 PHE CD1  C  -7.694 -3.219   3.037 1.00 . A A .   7 PHE CD1  1 1 
        3  636 1 1  6 PHE CD2  C  -7.222 -1.126   1.995 1.00 . A A .   7 PHE CD2  1 1 
        3  637 1 1  6 PHE CE1  C  -7.596 -2.622   4.281 1.00 . A A .   7 PHE CE1  1 1 
        3  638 1 1  6 PHE CE2  C  -7.127 -0.524   3.235 1.00 . A A .   7 PHE CE2  1 1 
        3  639 1 1  6 PHE CG   C  -7.507 -2.477   1.880 1.00 . A A .   7 PHE CG   1 1 
        3  640 1 1  6 PHE CZ   C  -7.311 -1.273   4.380 1.00 . A A .   7 PHE CZ   1 1 
        3  641 1 1  6 PHE H    H  -4.904 -2.797   0.781 1.00 . A A .   7 PHE H    1 1 
        3  642 1 1  6 PHE HA   H  -6.749 -5.087   0.629 1.00 . A A .   7 PHE HA   1 1 
        3  643 1 1  6 PHE HB2  H  -7.564 -2.336  -0.217 1.00 . A A .   7 PHE HB2  1 1 
        3  644 1 1  6 PHE HB3  H  -8.546 -3.630   0.459 1.00 . A A .   7 PHE HB3  1 1 
        3  645 1 1  6 PHE HD1  H  -7.917 -4.273   2.961 1.00 . A A .   7 PHE HD1  1 1 
        3  646 1 1  6 PHE HD2  H  -7.078 -0.538   1.099 1.00 . A A .   7 PHE HD2  1 1 
        3  647 1 1  6 PHE HE1  H  -7.744 -3.211   5.175 1.00 . A A .   7 PHE HE1  1 1 
        3  648 1 1  6 PHE HE2  H  -6.908  0.532   3.308 1.00 . A A .   7 PHE HE2  1 1 
        3  649 1 1  6 PHE HZ   H  -7.231 -0.804   5.350 1.00 . A A .   7 PHE HZ   1 1 
        3  650 1 1  6 PHE N    N  -5.231 -3.711   0.896 1.00 . A A .   7 PHE N    1 1 
        3  651 1 1  6 PHE O    O  -7.058 -4.864  -1.964 1.00 . A A .   7 PHE O    1 1 
        3  652 1 1  7 DTR C    C  -4.756 -2.239  -3.766 1.00 . A A .   8 DTR C    1 1 
        3  653 1 1  7 DTR CA   C  -4.893 -3.641  -3.172 1.00 . A A .   8 DTR CA   1 1 
        3  654 1 1  7 DTR CB   C  -3.586 -4.431  -3.363 1.00 . A A .   8 DTR CB   1 1 
        3  655 1 1  7 DTR CD1  C  -3.450 -5.837  -5.497 1.00 . A A .   8 DTR CD1  1 1 
        3  656 1 1  7 DTR CD2  C  -2.547 -3.796  -5.697 1.00 . A A .   8 DTR CD2  1 1 
        3  657 1 1  7 DTR CE2  C  -2.418 -4.466  -6.926 1.00 . A A .   8 DTR CE2  1 1 
        3  658 1 1  7 DTR CE3  C  -2.050 -2.494  -5.585 1.00 . A A .   8 DTR CE3  1 1 
        3  659 1 1  7 DTR CG   C  -3.220 -4.691  -4.795 1.00 . A A .   8 DTR CG   1 1 
        3  660 1 1  7 DTR CH2  C  -1.336 -2.602  -7.895 1.00 . A A .   8 DTR CH2  1 1 
        3  661 1 1  7 DTR CZ2  C  -1.813 -3.878  -8.033 1.00 . A A .   8 DTR CZ2  1 1 
        3  662 1 1  7 DTR CZ3  C  -1.448 -1.913  -6.683 1.00 . A A .   8 DTR CZ3  1 1 
        3  663 1 1  7 DTR H    H  -4.671 -3.048  -1.162 1.00 . A A .   8 DTR H    1 1 
        3  664 1 1  7 DTR HA   H  -5.663 -4.200  -3.689 1.00 . A A .   8 DTR HA   1 1 
        3  665 1 1  7 DTR HB2  H  -2.774 -3.877  -2.915 1.00 . A A .   8 DTR HB2  1 1 
        3  666 1 1  7 DTR HB3  H  -3.678 -5.383  -2.864 1.00 . A A .   8 DTR HB3  1 1 
        3  667 1 1  7 DTR HD1  H  -3.937 -6.712  -5.092 1.00 . A A .   8 DTR HD1  1 1 
        3  668 1 1  7 DTR HE1  H  -3.022 -6.405  -7.476 1.00 . A A .   8 DTR HE1  1 1 
        3  669 1 1  7 DTR HE3  H  -2.129 -1.946  -4.658 1.00 . A A .   8 DTR HE3  1 1 
        3  670 1 1  7 DTR HH2  H  -0.856 -2.110  -8.728 1.00 . A A .   8 DTR HH2  1 1 
        3  671 1 1  7 DTR HZ2  H  -1.724 -4.394  -8.975 1.00 . A A .   8 DTR HZ2  1 1 
        3  672 1 1  7 DTR HZ3  H  -1.058 -0.909  -6.612 1.00 . A A .   8 DTR HZ3  1 1 
        3  673 1 1  7 DTR N    N  -5.230 -3.581  -1.761 1.00 . A A .   8 DTR N    1 1 
        3  674 1 1  7 DTR NE1  N  -2.973 -5.710  -6.777 1.00 . A A .   8 DTR NE1  1 1 
        3  675 1 1  7 DTR O    O  -3.943 -1.448  -3.292 1.00 . A A .   8 DTR O    1 1 
        3  676 1 1  8 LYS C    C  -6.095  0.498  -4.891 1.00 . A A .   9 LYS C    1 1 
        3  677 1 1  8 LYS CA   C  -5.356 -0.675  -5.525 1.00 . A A .   9 LYS CA   1 1 
        3  678 1 1  8 LYS CB   C  -5.828 -0.837  -6.979 1.00 . A A .   9 LYS CB   1 1 
        3  679 1 1  8 LYS CD   C  -6.486 -3.250  -7.320 1.00 . A A .   9 LYS CD   1 1 
        3  680 1 1  8 LYS CE   C  -6.151 -4.543  -8.044 1.00 . A A .   9 LYS CE   1 1 
        3  681 1 1  8 LYS CG   C  -5.462 -2.164  -7.629 1.00 . A A .   9 LYS CG   1 1 
        3  682 1 1  8 LYS H    H  -6.331 -2.479  -4.992 1.00 . A A .   9 LYS H    1 1 
        3  683 1 1  8 LYS HA   H  -4.298 -0.463  -5.520 1.00 . A A .   9 LYS HA   1 1 
        3  684 1 1  8 LYS HB2  H  -6.902 -0.734  -7.006 1.00 . A A .   9 LYS HB2  1 1 
        3  685 1 1  8 LYS HB3  H  -5.387 -0.047  -7.569 1.00 . A A .   9 LYS HB3  1 1 
        3  686 1 1  8 LYS HD2  H  -6.495 -3.434  -6.256 1.00 . A A .   9 LYS HD2  1 1 
        3  687 1 1  8 LYS HD3  H  -7.462 -2.914  -7.637 1.00 . A A .   9 LYS HD3  1 1 
        3  688 1 1  8 LYS HE2  H  -6.169 -4.359  -9.108 1.00 . A A .   9 LYS HE2  1 1 
        3  689 1 1  8 LYS HE3  H  -5.163 -4.855  -7.752 1.00 . A A .   9 LYS HE3  1 1 
        3  690 1 1  8 LYS HG2  H  -5.412 -2.026  -8.699 1.00 . A A .   9 LYS HG2  1 1 
        3  691 1 1  8 LYS HG3  H  -4.497 -2.478  -7.259 1.00 . A A .   9 LYS HG3  1 1 
        3  692 1 1  8 LYS HZ1  H  -6.867 -6.493  -8.255 1.00 . A A .   9 LYS HZ1  1 1 
        3  693 1 1  8 LYS HZ2  H  -8.083 -5.341  -7.990 1.00 . A A .   9 LYS HZ2  1 1 
        3  694 1 1  8 LYS HZ3  H  -7.096 -5.844  -6.706 1.00 . A A .   9 LYS HZ3  1 1 
        3  695 1 1  8 LYS N    N  -5.574 -1.902  -4.762 1.00 . A A .   9 LYS N    1 1 
        3  696 1 1  8 LYS NZ   N  -7.116 -5.629  -7.728 1.00 . A A .   9 LYS NZ   1 1 
        3  697 1 1  8 LYS O    O  -6.010  1.632  -5.367 1.00 . A A .   9 LYS O    1 1 
        3  698 1 1  9 THR C    C  -6.661  2.065  -2.190 1.00 . A A .  10 THR C    1 1 
        3  699 1 1  9 THR CA   C  -7.571  1.247  -3.115 1.00 . A A .  10 THR CA   1 1 
        3  700 1 1  9 THR CB   C  -8.695  0.602  -2.286 1.00 . A A .  10 THR CB   1 1 
        3  701 1 1  9 THR CG2  C  -9.775  1.619  -1.951 1.00 . A A .  10 THR CG2  1 1 
        3  702 1 1  9 THR H    H  -6.881 -0.710  -3.513 1.00 . A A .  10 THR H    1 1 
        3  703 1 1  9 THR HA   H  -8.017  1.903  -3.849 1.00 . A A .  10 THR HA   1 1 
        3  704 1 1  9 THR HB   H  -8.275  0.225  -1.366 1.00 . A A .  10 THR HB   1 1 
        3  705 1 1  9 THR HG1  H -10.089 -0.198  -3.444 1.00 . A A .  10 THR HG1  1 1 
        3  706 1 1  9 THR HG21 H -10.200  2.007  -2.864 1.00 . A A .  10 THR HG21 1 1 
        3  707 1 1  9 THR HG22 H  -9.340  2.429  -1.383 1.00 . A A .  10 THR HG22 1 1 
        3  708 1 1  9 THR HG23 H -10.548  1.143  -1.363 1.00 . A A .  10 THR HG23 1 1 
        3  709 1 1  9 THR N    N  -6.820  0.219  -3.820 1.00 . A A .  10 THR N    1 1 
        3  710 1 1  9 THR O    O  -6.890  3.255  -1.972 1.00 . A A .  10 THR O    1 1 
        3  711 1 1  9 THR OG1  O  -9.271 -0.487  -3.024 1.00 . A A .  10 THR OG1  1 1 
        3  712 1 1 10 PHE C    C  -3.252  1.853  -1.159 1.00 . A A .  11 PHE C    1 1 
        3  713 1 1 10 PHE CA   C  -4.723  2.074  -0.717 1.00 . A A .  11 PHE CA   1 1 
        3  714 1 1 10 PHE CB   C  -4.924  1.473   0.677 1.00 . A A .  11 PHE CB   1 1 
        3  715 1 1 10 PHE CD1  C  -4.689  3.167   2.518 1.00 . A A .  11 PHE CD1  1 1 
        3  716 1 1 10 PHE CD2  C  -2.819  1.770   2.022 1.00 . A A .  11 PHE CD2  1 1 
        3  717 1 1 10 PHE CE1  C  -3.965  3.783   3.519 1.00 . A A .  11 PHE CE1  1 1 
        3  718 1 1 10 PHE CE2  C  -2.090  2.386   3.021 1.00 . A A .  11 PHE CE2  1 1 
        3  719 1 1 10 PHE CG   C  -4.126  2.152   1.758 1.00 . A A .  11 PHE CG   1 1 
        3  720 1 1 10 PHE CZ   C  -2.665  3.393   3.772 1.00 . A A .  11 PHE CZ   1 1 
        3  721 1 1 10 PHE H    H  -5.451  0.498  -1.914 1.00 . A A .  11 PHE H    1 1 
        3  722 1 1 10 PHE HA   H  -4.988  3.121  -0.681 1.00 . A A .  11 PHE HA   1 1 
        3  723 1 1 10 PHE HB2  H  -5.968  1.542   0.943 1.00 . A A .  11 PHE HB2  1 1 
        3  724 1 1 10 PHE HB3  H  -4.634  0.433   0.656 1.00 . A A .  11 PHE HB3  1 1 
        3  725 1 1 10 PHE HD1  H  -5.706  3.474   2.321 1.00 . A A .  11 PHE HD1  1 1 
        3  726 1 1 10 PHE HD2  H  -2.367  0.984   1.434 1.00 . A A .  11 PHE HD2  1 1 
        3  727 1 1 10 PHE HE1  H  -4.414  4.572   4.105 1.00 . A A .  11 PHE HE1  1 1 
        3  728 1 1 10 PHE HE2  H  -1.072  2.080   3.215 1.00 . A A .  11 PHE HE2  1 1 
        3  729 1 1 10 PHE HZ   H  -2.099  3.872   4.556 1.00 . A A .  11 PHE HZ   1 1 
        3  730 1 1 10 PHE N    N  -5.627  1.424  -1.656 1.00 . A A .  11 PHE N    1 1 
        3  731 1 1 10 PHE O    O  -2.820  0.699  -1.193 1.00 . A A .  11 PHE O    1 1 
        3  732 1 1 11 THR C    C  -0.201  3.690  -1.056 1.00 . A A .  12 THR C    1 1 
        3  733 1 1 11 THR CA   C  -1.069  2.690  -1.823 1.00 . A A .  12 THR CA   1 1 
        3  734 1 1 11 THR CB   C  -0.793  2.778  -3.346 1.00 . A A .  12 THR CB   1 1 
        3  735 1 1 11 THR CG2  C  -1.166  4.142  -3.913 1.00 . A A .  12 THR CG2  1 1 
        3  736 1 1 11 THR H    H  -2.830  3.801  -1.602 1.00 . A A .  12 THR H    1 1 
        3  737 1 1 11 THR HA   H  -0.808  1.693  -1.495 1.00 . A A .  12 THR HA   1 1 
        3  738 1 1 11 THR HB   H  -1.398  2.029  -3.839 1.00 . A A .  12 THR HB   1 1 
        3  739 1 1 11 THR HG1  H   0.824  2.840  -4.492 1.00 . A A .  12 THR HG1  1 1 
        3  740 1 1 11 THR HG21 H  -0.587  4.908  -3.418 1.00 . A A .  12 THR HG21 1 1 
        3  741 1 1 11 THR HG22 H  -2.219  4.325  -3.751 1.00 . A A .  12 THR HG22 1 1 
        3  742 1 1 11 THR HG23 H  -0.956  4.161  -4.973 1.00 . A A .  12 THR HG23 1 1 
        3  743 1 1 11 THR N    N  -2.473  2.896  -1.519 1.00 . A A .  12 THR N    1 1 
        3  744 1 1 11 THR O    O  -0.408  4.904  -1.123 1.00 . A A .  12 THR O    1 1 
        3  745 1 1 11 THR OG1  O   0.585  2.496  -3.614 1.00 . A A .  12 THR OG1  1 1 
        3  746 1 1 12 SER C    C   3.091  3.512   0.259 1.00 . A A .  13 SER C    1 1 
        3  747 1 1 12 SER CA   C   1.658  3.999   0.473 1.00 . A A .  13 SER CA   1 1 
        3  748 1 1 12 SER CB   C   1.308  3.987   1.960 1.00 . A A .  13 SER CB   1 1 
        3  749 1 1 12 SER H    H   0.787  2.193  -0.184 1.00 . A A .  13 SER H    1 1 
        3  750 1 1 12 SER HA   H   1.565  5.006   0.100 1.00 . A A .  13 SER HA   1 1 
        3  751 1 1 12 SER HB2  H   1.349  2.974   2.332 1.00 . A A .  13 SER HB2  1 1 
        3  752 1 1 12 SER HB3  H   2.013  4.599   2.501 1.00 . A A .  13 SER HB3  1 1 
        3  753 1 1 12 SER HG   H  -0.361  4.783   1.324 1.00 . A A .  13 SER HG   1 1 
        3  754 1 1 12 SER N    N   0.726  3.167  -0.268 1.00 . A A .  13 SER N    1 1 
        3  755 1 1 12 SER O    O   3.376  2.326   0.426 1.00 . A A .  13 SER O    1 1 
        3  756 1 1 12 SER OG   O   0.005  4.497   2.167 1.00 . A A .  13 SER OG   1 1 
        3  757 1 1 13 CYS C    C   6.290  4.813   0.613 1.00 . A A .  14 CYS C    1 1 
        3  758 1 1 13 CYS CA   C   5.373  4.073  -0.349 1.00 . A A .  14 CYS CA   1 1 
        3  759 1 1 13 CYS CB   C   5.755  4.391  -1.795 1.00 . A A .  14 CYS CB   1 1 
        3  760 1 1 13 CYS H    H   3.713  5.361  -0.199 1.00 . A A .  14 CYS H    1 1 
        3  761 1 1 13 CYS HA   H   5.480  3.011  -0.184 1.00 . A A .  14 CYS HA   1 1 
        3  762 1 1 13 CYS HB2  H   5.603  5.444  -1.978 1.00 . A A .  14 CYS HB2  1 1 
        3  763 1 1 13 CYS HB3  H   6.797  4.150  -1.946 1.00 . A A .  14 CYS HB3  1 1 
        3  764 1 1 13 CYS N    N   3.986  4.425  -0.103 1.00 . A A .  14 CYS N    1 1 
        3  765 1 1 13 CYS O    O   6.234  6.039   0.720 1.00 . A A .  14 CYS O    1 1 
        3  766 1 1 13 CYS SG   S   4.785  3.464  -3.032 1.00 . A A .  14 CYS SG   1 1 
        3  767 1 1 14 LYS C    C   9.307  3.750   2.301 1.00 . A A .  15 LYS C    1 1 
        3  768 1 1 14 LYS CA   C   8.068  4.636   2.253 1.00 . A A .  15 LYS CA   1 1 
        3  769 1 1 14 LYS CB   C   7.435  4.768   3.650 1.00 . A A .  15 LYS CB   1 1 
        3  770 1 1 14 LYS CD   C   9.526  5.328   5.004 1.00 . A A .  15 LYS CD   1 1 
        3  771 1 1 14 LYS CE   C   9.508  4.219   6.054 1.00 . A A .  15 LYS CE   1 1 
        3  772 1 1 14 LYS CG   C   8.126  5.768   4.578 1.00 . A A .  15 LYS CG   1 1 
        3  773 1 1 14 LYS H    H   7.082  3.083   1.214 1.00 . A A .  15 LYS H    1 1 
        3  774 1 1 14 LYS HA   H   8.347  5.615   1.890 1.00 . A A .  15 LYS HA   1 1 
        3  775 1 1 14 LYS HB2  H   6.407  5.079   3.534 1.00 . A A .  15 LYS HB2  1 1 
        3  776 1 1 14 LYS HB3  H   7.453  3.800   4.127 1.00 . A A .  15 LYS HB3  1 1 
        3  777 1 1 14 LYS HD2  H  10.054  4.968   4.134 1.00 . A A .  15 LYS HD2  1 1 
        3  778 1 1 14 LYS HD3  H  10.049  6.183   5.410 1.00 . A A .  15 LYS HD3  1 1 
        3  779 1 1 14 LYS HE2  H  10.522  4.029   6.368 1.00 . A A .  15 LYS HE2  1 1 
        3  780 1 1 14 LYS HE3  H   8.930  4.558   6.900 1.00 . A A .  15 LYS HE3  1 1 
        3  781 1 1 14 LYS HG2  H   8.209  6.715   4.068 1.00 . A A .  15 LYS HG2  1 1 
        3  782 1 1 14 LYS HG3  H   7.519  5.893   5.463 1.00 . A A .  15 LYS HG3  1 1 
        3  783 1 1 14 LYS HZ1  H   9.318  2.722   4.603 1.00 . A A .  15 LYS HZ1  1 1 
        3  784 1 1 14 LYS HZ2  H   7.891  3.036   5.458 1.00 . A A .  15 LYS HZ2  1 1 
        3  785 1 1 14 LYS HZ3  H   9.135  2.164   6.193 1.00 . A A .  15 LYS HZ3  1 1 
        3  786 1 1 14 LYS N    N   7.114  4.061   1.321 1.00 . A A .  15 LYS N    1 1 
        3  787 1 1 14 LYS NZ   N   8.921  2.950   5.543 1.00 . A A .  15 LYS NZ   1 1 
        3  788 1 1 14 LYS O    O   9.246  2.683   2.946 1.00 . A A .  15 LYS O    1 1 
        3  789 1 1 14 LYS OXT  O  10.330  4.119   1.696 1.00 . A A .  15 LYS OXT  1 1 
        3  790 2 2  1 .   C1   C   8.597 -2.611  -0.720 1.00 . B A . 101 OCA C1   1 1 
        3  791 2 2  1 .   C2   C   8.044 -2.885   0.673 1.00 . B A . 101 OCA C2   1 1 
        3  792 2 2  1 .   C3   C   9.129 -3.178   1.697 1.00 . B A . 101 OCA C3   1 1 
        3  793 2 2  1 .   C4   C   9.678 -4.587   1.537 1.00 . B A . 101 OCA C4   1 1 
        3  794 2 2  1 .   C5   C  10.375 -5.065   2.799 1.00 . B A . 101 OCA C5   1 1 
        3  795 2 2  1 .   C6   C   9.565 -6.140   3.509 1.00 . B A . 101 OCA C6   1 1 
        3  796 2 2  1 .   C7   C   8.705 -5.561   4.623 1.00 . B A . 101 OCA C7   1 1 
        3  797 2 2  1 .   C8   C   9.541 -4.927   5.713 1.00 . B A . 101 OCA C8   1 1 
        3  798 2 2  1 .   H21  H   7.382 -3.738   0.618 1.00 . B A . 101 OCA H21  1 1 
        3  799 2 2  1 .   H22  H   7.486 -2.018   0.996 1.00 . B A . 101 OCA H22  1 1 
        3  800 2 2  1 .   H31  H   9.933 -2.471   1.566 1.00 . B A . 101 OCA H31  1 1 
        3  801 2 2  1 .   H32  H   8.711 -3.075   2.687 1.00 . B A . 101 OCA H32  1 1 
        3  802 2 2  1 .   H41  H   8.862 -5.258   1.314 1.00 . B A . 101 OCA H41  1 1 
        3  803 2 2  1 .   H42  H  10.386 -4.596   0.722 1.00 . B A . 101 OCA H42  1 1 
        3  804 2 2  1 .   H51  H  11.340 -5.473   2.536 1.00 . B A . 101 OCA H51  1 1 
        3  805 2 2  1 .   H52  H  10.506 -4.228   3.468 1.00 . B A . 101 OCA H52  1 1 
        3  806 2 2  1 .   H61  H   8.923 -6.625   2.789 1.00 . B A . 101 OCA H61  1 1 
        3  807 2 2  1 .   H62  H  10.244 -6.863   3.933 1.00 . B A . 101 OCA H62  1 1 
        3  808 2 2  1 .   H71  H   8.116 -6.353   5.062 1.00 . B A . 101 OCA H71  1 1 
        3  809 2 2  1 .   H72  H   8.053 -4.806   4.209 1.00 . B A . 101 OCA H72  1 1 
        3  810 2 2  1 .   H81  H   9.792 -3.913   5.433 1.00 . B A . 101 OCA H81  1 1 
        3  811 2 2  1 .   H82  H  10.449 -5.498   5.844 1.00 . B A . 101 OCA H82  1 1 
        3  812 2 2  1 .   H83  H   8.983 -4.919   6.638 1.00 . B A . 101 OCA H83  1 1 
        3  813 2 2  1 .   O1   O   8.839 -3.490  -1.548 1.00 . B A . 101 OCA O1   1 1 
        4  814 1 1  1 PRO C    C   7.354  0.308  -0.039 1.00 . A A .   2 PRO C    1 1 
        4  815 1 1  1 PRO CA   C   8.820 -0.127   0.009 1.00 . A A .   2 PRO CA   1 1 
        4  816 1 1  1 PRO CB   C   9.713  0.957  -0.579 1.00 . A A .   2 PRO CB   1 1 
        4  817 1 1  1 PRO CD   C   9.671 -0.866  -2.149 1.00 . A A .   2 PRO CD   1 1 
        4  818 1 1  1 PRO CG   C   9.787  0.632  -2.033 1.00 . A A .   2 PRO CG   1 1 
        4  819 1 1  1 PRO HA   H   9.105 -0.309   1.035 1.00 . A A .   2 PRO HA   1 1 
        4  820 1 1  1 PRO HB2  H   9.265  1.925  -0.411 1.00 . A A .   2 PRO HB2  1 1 
        4  821 1 1  1 PRO HB3  H  10.688  0.919  -0.116 1.00 . A A .   2 PRO HB3  1 1 
        4  822 1 1  1 PRO HD2  H   8.997 -1.127  -2.952 1.00 . A A .   2 PRO HD2  1 1 
        4  823 1 1  1 PRO HD3  H  10.643 -1.305  -2.318 1.00 . A A .   2 PRO HD3  1 1 
        4  824 1 1  1 PRO HG2  H   8.973  1.110  -2.555 1.00 . A A .   2 PRO HG2  1 1 
        4  825 1 1  1 PRO HG3  H  10.735  0.964  -2.432 1.00 . A A .   2 PRO HG3  1 1 
        4  826 1 1  1 PRO N    N   9.120 -1.286  -0.846 1.00 . A A .   2 PRO N    1 1 
        4  827 1 1  1 PRO O    O   6.918  1.139   0.759 1.00 . A A .   2 PRO O    1 1 
        4  828 1 1  2 CYS C    C   4.321 -1.058  -0.649 1.00 . A A .   3 CYS C    1 1 
        4  829 1 1  2 CYS CA   C   5.190  0.105  -1.109 1.00 . A A .   3 CYS CA   1 1 
        4  830 1 1  2 CYS CB   C   4.865  0.440  -2.573 1.00 . A A .   3 CYS CB   1 1 
        4  831 1 1  2 CYS H    H   6.979 -0.933  -1.563 1.00 . A A .   3 CYS H    1 1 
        4  832 1 1  2 CYS HA   H   4.994  0.966  -0.489 1.00 . A A .   3 CYS HA   1 1 
        4  833 1 1  2 CYS HB2  H   4.719 -0.481  -3.116 1.00 . A A .   3 CYS HB2  1 1 
        4  834 1 1  2 CYS HB3  H   3.947  1.012  -2.604 1.00 . A A .   3 CYS HB3  1 1 
        4  835 1 1  2 CYS N    N   6.592 -0.258  -0.962 1.00 . A A .   3 CYS N    1 1 
        4  836 1 1  2 CYS O    O   4.443 -2.168  -1.164 1.00 . A A .   3 CYS O    1 1 
        4  837 1 1  2 CYS SG   S   6.145  1.399  -3.461 1.00 . A A .   3 CYS SG   1 1 
        4  838 1 1  3 LYS C    C   1.153 -1.559   0.672 1.00 . A A .   4 LYS C    1 1 
        4  839 1 1  3 LYS CA   C   2.629 -1.864   0.884 1.00 . A A .   4 LYS CA   1 1 
        4  840 1 1  3 LYS CB   C   2.909 -2.041   2.377 1.00 . A A .   4 LYS CB   1 1 
        4  841 1 1  3 LYS CD   C   3.221 -4.519   2.240 1.00 . A A .   4 LYS CD   1 1 
        4  842 1 1  3 LYS CE   C   2.727 -5.892   2.661 1.00 . A A .   4 LYS CE   1 1 
        4  843 1 1  3 LYS CG   C   2.451 -3.389   2.912 1.00 . A A .   4 LYS CG   1 1 
        4  844 1 1  3 LYS H    H   3.369  0.109   0.672 1.00 . A A .   4 LYS H    1 1 
        4  845 1 1  3 LYS HA   H   2.872 -2.782   0.370 1.00 . A A .   4 LYS HA   1 1 
        4  846 1 1  3 LYS HB2  H   3.970 -1.948   2.548 1.00 . A A .   4 LYS HB2  1 1 
        4  847 1 1  3 LYS HB3  H   2.393 -1.265   2.924 1.00 . A A .   4 LYS HB3  1 1 
        4  848 1 1  3 LYS HD2  H   3.108 -4.427   1.171 1.00 . A A .   4 LYS HD2  1 1 
        4  849 1 1  3 LYS HD3  H   4.267 -4.430   2.497 1.00 . A A .   4 LYS HD3  1 1 
        4  850 1 1  3 LYS HE2  H   3.388 -6.640   2.249 1.00 . A A .   4 LYS HE2  1 1 
        4  851 1 1  3 LYS HE3  H   2.746 -5.952   3.740 1.00 . A A .   4 LYS HE3  1 1 
        4  852 1 1  3 LYS HG2  H   2.631 -3.425   3.978 1.00 . A A .   4 LYS HG2  1 1 
        4  853 1 1  3 LYS HG3  H   1.392 -3.510   2.716 1.00 . A A .   4 LYS HG3  1 1 
        4  854 1 1  3 LYS HZ1  H   1.146 -7.181   2.215 1.00 . A A .   4 LYS HZ1  1 1 
        4  855 1 1  3 LYS HZ2  H   1.227 -5.816   1.207 1.00 . A A .   4 LYS HZ2  1 1 
        4  856 1 1  3 LYS HZ3  H   0.658 -5.667   2.800 1.00 . A A .   4 LYS HZ3  1 1 
        4  857 1 1  3 LYS N    N   3.460 -0.807   0.327 1.00 . A A .   4 LYS N    1 1 
        4  858 1 1  3 LYS NZ   N   1.345 -6.155   2.186 1.00 . A A .   4 LYS NZ   1 1 
        4  859 1 1  3 LYS O    O   0.668 -0.484   1.031 1.00 . A A .   4 LYS O    1 1 
        4  860 1 1  4 ASN C    C  -1.755 -3.388   0.688 1.00 . A A .   5 ASN C    1 1 
        4  861 1 1  4 ASN CA   C  -0.982 -2.365  -0.149 1.00 . A A .   5 ASN CA   1 1 
        4  862 1 1  4 ASN CB   C  -1.302 -2.587  -1.625 1.00 . A A .   5 ASN CB   1 1 
        4  863 1 1  4 ASN CG   C  -0.467 -1.732  -2.562 1.00 . A A .   5 ASN CG   1 1 
        4  864 1 1  4 ASN H    H   0.892 -3.338  -0.196 1.00 . A A .   5 ASN H    1 1 
        4  865 1 1  4 ASN HA   H  -1.269 -1.362   0.129 1.00 . A A .   5 ASN HA   1 1 
        4  866 1 1  4 ASN HB2  H  -1.129 -3.620  -1.863 1.00 . A A .   5 ASN HB2  1 1 
        4  867 1 1  4 ASN HB3  H  -2.344 -2.357  -1.792 1.00 . A A .   5 ASN HB3  1 1 
        4  868 1 1  4 ASN HD21 H  -1.896 -0.354  -2.649 1.00 . A A .   5 ASN HD21 1 1 
        4  869 1 1  4 ASN HD22 H  -0.477 -0.039  -3.590 1.00 . A A .   5 ASN HD22 1 1 
        4  870 1 1  4 ASN N    N   0.442 -2.510   0.089 1.00 . A A .   5 ASN N    1 1 
        4  871 1 1  4 ASN ND2  N  -0.997 -0.592  -2.970 1.00 . A A .   5 ASN ND2  1 1 
        4  872 1 1  4 ASN O    O  -1.665 -4.589   0.429 1.00 . A A .   5 ASN O    1 1 
        4  873 1 1  4 ASN OD1  O   0.643 -2.109  -2.935 1.00 . A A .   5 ASN OD1  1 1 
        4  874 1 1  5 .   C    C  -4.462 -4.394   1.793 1.00 . A A .   6 O6H C    1 1 
        4  875 1 1  5 .   CA   C  -3.261 -3.837   2.550 1.00 . A A .   6 O6H CA   1 1 
        4  876 1 1  5 .   CB   C  -3.759 -3.118   3.810 1.00 . A A .   6 O6H CB   1 1 
        4  877 1 1  5 .   CD1  C  -2.210 -1.239   4.480 1.00 . A A .   6 O6H CD1  1 1 
        4  878 1 1  5 .   CD2  C  -2.100 -3.278   5.708 1.00 . A A .   6 O6H CD2  1 1 
        4  879 1 1  5 .   CE1  C  -1.219 -0.699   5.269 1.00 . A A .   6 O6H CE1  1 1 
        4  880 1 1  5 .   CE2  C  -1.104 -2.746   6.507 1.00 . A A .   6 O6H CE2  1 1 
        4  881 1 1  5 .   CF1  C  -2.800 -0.399   3.391 1.00 . A A .   6 O6H CF1  1 1 
        4  882 1 1  5 .   CF2  C  -2.576 -4.677   5.969 1.00 . A A .   6 O6H CF2  1 1 
        4  883 1 1  5 .   CG   C  -2.670 -2.537   4.678 1.00 . A A .   6 O6H CG   1 1 
        4  884 1 1  5 .   CH   C   0.409 -0.865   7.134 1.00 . A A .   6 O6H CH   1 1 
        4  885 1 1  5 .   CZ   C  -0.669 -1.455   6.279 1.00 . A A .   6 O6H CZ   1 1 
        4  886 1 1  5 .   H1   H  -2.473 -1.978   1.923 1.00 . A A .   6 O6H H1   1 1 
        4  887 1 1  5 .   HA   H  -2.622 -4.655   2.843 1.00 . A A .   6 O6H HA   1 1 
        4  888 1 1  5 .   HB1  H  -4.322 -3.818   4.410 1.00 . A A .   6 O6H HB1  1 1 
        4  889 1 1  5 .   HB2  H  -4.410 -2.308   3.514 1.00 . A A .   6 O6H HB2  1 1 
        4  890 1 1  5 .   HE1  H  -0.875  0.311   5.097 1.00 . A A .   6 O6H HE1  1 1 
        4  891 1 1  5 .   HE2  H  -0.669 -3.335   7.301 1.00 . A A .   6 O6H HE2  1 1 
        4  892 1 1  5 .   HF11 H  -2.129 -0.247   2.557 1.00 . A A .   6 O6H HF11 1 1 
        4  893 1 1  5 .   HF12 H  -3.696 -0.821   2.961 1.00 . A A .   6 O6H HF12 1 1 
        4  894 1 1  5 .   HF13 H  -3.078  0.593   3.717 1.00 . A A .   6 O6H HF13 1 1 
        4  895 1 1  5 .   HF21 H  -3.486 -4.925   5.443 1.00 . A A .   6 O6H HF21 1 1 
        4  896 1 1  5 .   HF22 H  -2.787 -4.869   7.011 1.00 . A A .   6 O6H HF22 1 1 
        4  897 1 1  5 .   HF23 H  -1.862 -5.434   5.678 1.00 . A A .   6 O6H HF23 1 1 
        4  898 1 1  5 .   HH1  H   0.099 -0.689   8.154 1.00 . A A .   6 O6H HH1  1 1 
        4  899 1 1  5 .   HH2  H   1.290 -1.485   7.205 1.00 . A A .   6 O6H HH2  1 1 
        4  900 1 1  5 .   HH3  H   0.761  0.091   6.775 1.00 . A A .   6 O6H HH3  1 1 
        4  901 1 1  5 .   N    N  -2.476 -2.935   1.711 1.00 . A A .   6 O6H N    1 1 
        4  902 1 1  5 .   O    O  -4.803 -5.571   1.920 1.00 . A A .   6 O6H O    1 1 
        4  903 1 1  6 PHE C    C  -6.258 -4.026  -1.100 1.00 . A A .   7 PHE C    1 1 
        4  904 1 1  6 PHE CA   C  -6.393 -3.861   0.408 1.00 . A A .   7 PHE CA   1 1 
        4  905 1 1  6 PHE CB   C  -7.420 -2.773   0.738 1.00 . A A .   7 PHE CB   1 1 
        4  906 1 1  6 PHE CD1  C  -7.773 -3.132   3.202 1.00 . A A .   7 PHE CD1  1 1 
        4  907 1 1  6 PHE CD2  C  -6.804 -1.075   2.480 1.00 . A A .   7 PHE CD2  1 1 
        4  908 1 1  6 PHE CE1  C  -7.667 -2.722   4.518 1.00 . A A .   7 PHE CE1  1 1 
        4  909 1 1  6 PHE CE2  C  -6.703 -0.658   3.792 1.00 . A A .   7 PHE CE2  1 1 
        4  910 1 1  6 PHE CG   C  -7.340 -2.314   2.169 1.00 . A A .   7 PHE CG   1 1 
        4  911 1 1  6 PHE CZ   C  -7.132 -1.482   4.813 1.00 . A A .   7 PHE CZ   1 1 
        4  912 1 1  6 PHE H    H  -4.720 -2.649   0.864 1.00 . A A .   7 PHE H    1 1 
        4  913 1 1  6 PHE HA   H  -6.728 -4.795   0.830 1.00 . A A .   7 PHE HA   1 1 
        4  914 1 1  6 PHE HB2  H  -7.250 -1.918   0.101 1.00 . A A .   7 PHE HB2  1 1 
        4  915 1 1  6 PHE HB3  H  -8.414 -3.158   0.564 1.00 . A A .   7 PHE HB3  1 1 
        4  916 1 1  6 PHE HD1  H  -8.192 -4.099   2.971 1.00 . A A .   7 PHE HD1  1 1 
        4  917 1 1  6 PHE HD2  H  -6.468 -0.429   1.682 1.00 . A A .   7 PHE HD2  1 1 
        4  918 1 1  6 PHE HE1  H  -8.008 -3.368   5.315 1.00 . A A .   7 PHE HE1  1 1 
        4  919 1 1  6 PHE HE2  H  -6.287  0.312   4.021 1.00 . A A .   7 PHE HE2  1 1 
        4  920 1 1  6 PHE HZ   H  -7.041 -1.163   5.839 1.00 . A A .   7 PHE HZ   1 1 
        4  921 1 1  6 PHE N    N  -5.110 -3.531   1.020 1.00 . A A .   7 PHE N    1 1 
        4  922 1 1  6 PHE O    O  -7.125 -4.605  -1.755 1.00 . A A .   7 PHE O    1 1 
        4  923 1 1  7 DTR C    C  -4.625 -2.216  -3.683 1.00 . A A .   8 DTR C    1 1 
        4  924 1 1  7 DTR CA   C  -4.931 -3.585  -3.071 1.00 . A A .   8 DTR CA   1 1 
        4  925 1 1  7 DTR CB   C  -3.777 -4.562  -3.325 1.00 . A A .   8 DTR CB   1 1 
        4  926 1 1  7 DTR CD1  C  -2.462 -4.204  -5.492 1.00 . A A .   8 DTR CD1  1 1 
        4  927 1 1  7 DTR CD2  C  -4.224 -5.570  -5.699 1.00 . A A .   8 DTR CD2  1 1 
        4  928 1 1  7 DTR CE2  C  -3.598 -5.450  -6.953 1.00 . A A .   8 DTR CE2  1 1 
        4  929 1 1  7 DTR CE3  C  -5.358 -6.379  -5.588 1.00 . A A .   8 DTR CE3  1 1 
        4  930 1 1  7 DTR CG   C  -3.482 -4.763  -4.778 1.00 . A A .   8 DTR CG   1 1 
        4  931 1 1  7 DTR CH2  C  -5.179 -6.896  -7.946 1.00 . A A .   8 DTR CH2  1 1 
        4  932 1 1  7 DTR CZ2  C  -4.067 -6.111  -8.084 1.00 . A A .   8 DTR CZ2  1 1 
        4  933 1 1  7 DTR CZ3  C  -5.821 -7.036  -6.711 1.00 . A A .   8 DTR CZ3  1 1 
        4  934 1 1  7 DTR H    H  -4.559 -2.988  -1.090 1.00 . A A .   8 DTR H    1 1 
        4  935 1 1  7 DTR HA   H  -5.803 -4.024  -3.539 1.00 . A A .   8 DTR HA   1 1 
        4  936 1 1  7 DTR HB2  H  -2.883 -4.184  -2.853 1.00 . A A .   8 DTR HB2  1 1 
        4  937 1 1  7 DTR HB3  H  -4.026 -5.523  -2.899 1.00 . A A .   8 DTR HB3  1 1 
        4  938 1 1  7 DTR HD1  H  -1.718 -3.540  -5.075 1.00 . A A .   8 DTR HD1  1 1 
        4  939 1 1  7 DTR HE1  H  -1.894 -4.349  -7.515 1.00 . A A .   8 DTR HE1  1 1 
        4  940 1 1  7 DTR HE3  H  -5.868 -6.499  -4.643 1.00 . A A .   8 DTR HE3  1 1 
        4  941 1 1  7 DTR HH2  H  -5.576 -7.426  -8.798 1.00 . A A .   8 DTR HH2  1 1 
        4  942 1 1  7 DTR HZ2  H  -3.586 -6.007  -9.043 1.00 . A A .   8 DTR HZ2  1 1 
        4  943 1 1  7 DTR HZ3  H  -6.696 -7.664  -6.644 1.00 . A A .   8 DTR HZ3  1 1 
        4  944 1 1  7 DTR N    N  -5.190 -3.477  -1.651 1.00 . A A .   8 DTR N    1 1 
        4  945 1 1  7 DTR NE1  N  -2.524 -4.615  -6.800 1.00 . A A .   8 DTR NE1  1 1 
        4  946 1 1  7 DTR O    O  -3.807 -1.473  -3.145 1.00 . A A .   8 DTR O    1 1 
        4  947 1 1  8 LYS C    C  -5.838  0.528  -4.951 1.00 . A A .   9 LYS C    1 1 
        4  948 1 1  8 LYS CA   C  -4.984 -0.620  -5.480 1.00 . A A .   9 LYS CA   1 1 
        4  949 1 1  8 LYS CB   C  -5.170 -0.768  -7.000 1.00 . A A .   9 LYS CB   1 1 
        4  950 1 1  8 LYS CD   C  -6.786 -2.667  -7.408 1.00 . A A .   9 LYS CD   1 1 
        4  951 1 1  8 LYS CE   C  -6.007 -3.358  -8.515 1.00 . A A .   9 LYS CE   1 1 
        4  952 1 1  8 LYS CG   C  -6.576 -1.161  -7.431 1.00 . A A .   9 LYS CG   1 1 
        4  953 1 1  8 LYS H    H  -6.018 -2.431  -5.120 1.00 . A A .   9 LYS H    1 1 
        4  954 1 1  8 LYS HA   H  -3.947 -0.390  -5.282 1.00 . A A .   9 LYS HA   1 1 
        4  955 1 1  8 LYS HB2  H  -4.932  0.175  -7.469 1.00 . A A .   9 LYS HB2  1 1 
        4  956 1 1  8 LYS HB3  H  -4.485 -1.520  -7.362 1.00 . A A .   9 LYS HB3  1 1 
        4  957 1 1  8 LYS HD2  H  -6.453 -3.051  -6.455 1.00 . A A .   9 LYS HD2  1 1 
        4  958 1 1  8 LYS HD3  H  -7.838 -2.875  -7.535 1.00 . A A .   9 LYS HD3  1 1 
        4  959 1 1  8 LYS HE2  H  -4.966 -3.082  -8.430 1.00 . A A .   9 LYS HE2  1 1 
        4  960 1 1  8 LYS HE3  H  -6.102 -4.428  -8.389 1.00 . A A .   9 LYS HE3  1 1 
        4  961 1 1  8 LYS HG2  H  -7.283 -0.707  -6.760 1.00 . A A .   9 LYS HG2  1 1 
        4  962 1 1  8 LYS HG3  H  -6.747 -0.798  -8.435 1.00 . A A .   9 LYS HG3  1 1 
        4  963 1 1  8 LYS HZ1  H  -6.007 -3.553 -10.595 1.00 . A A .   9 LYS HZ1  1 1 
        4  964 1 1  8 LYS HZ2  H  -6.303 -1.980 -10.058 1.00 . A A .   9 LYS HZ2  1 1 
        4  965 1 1  8 LYS HZ3  H  -7.523 -3.151  -9.943 1.00 . A A .   9 LYS HZ3  1 1 
        4  966 1 1  8 LYS N    N  -5.292 -1.861  -4.782 1.00 . A A .   9 LYS N    1 1 
        4  967 1 1  8 LYS NZ   N  -6.494 -2.984  -9.868 1.00 . A A .   9 LYS NZ   1 1 
        4  968 1 1  8 LYS O    O  -5.680  1.674  -5.369 1.00 . A A .   9 LYS O    1 1 
        4  969 1 1  9 THR C    C  -6.837  2.033  -2.344 1.00 . A A .  10 THR C    1 1 
        4  970 1 1  9 THR CA   C  -7.582  1.235  -3.415 1.00 . A A .  10 THR CA   1 1 
        4  971 1 1  9 THR CB   C  -8.846  0.604  -2.799 1.00 . A A .  10 THR CB   1 1 
        4  972 1 1  9 THR CG2  C  -9.778  0.085  -3.884 1.00 . A A .  10 THR CG2  1 1 
        4  973 1 1  9 THR H    H  -6.833 -0.720  -3.739 1.00 . A A .  10 THR H    1 1 
        4  974 1 1  9 THR HA   H  -7.890  1.909  -4.200 1.00 . A A .  10 THR HA   1 1 
        4  975 1 1  9 THR HB   H  -9.367  1.363  -2.233 1.00 . A A .  10 THR HB   1 1 
        4  976 1 1  9 THR HG1  H  -9.186 -0.587  -1.259 1.00 . A A .  10 THR HG1  1 1 
        4  977 1 1  9 THR HG21 H -10.654 -0.353  -3.429 1.00 . A A .  10 THR HG21 1 1 
        4  978 1 1  9 THR HG22 H  -9.265 -0.662  -4.470 1.00 . A A .  10 THR HG22 1 1 
        4  979 1 1  9 THR HG23 H -10.076  0.902  -4.525 1.00 . A A .  10 THR HG23 1 1 
        4  980 1 1  9 THR N    N  -6.726  0.218  -4.011 1.00 . A A .  10 THR N    1 1 
        4  981 1 1  9 THR O    O  -7.235  3.145  -1.995 1.00 . A A .  10 THR O    1 1 
        4  982 1 1  9 THR OG1  O  -8.486 -0.470  -1.915 1.00 . A A .  10 THR OG1  1 1 
        4  983 1 1 10 PHE C    C  -3.447  2.073  -1.328 1.00 . A A .  11 PHE C    1 1 
        4  984 1 1 10 PHE CA   C  -4.922  2.141  -0.853 1.00 . A A .  11 PHE CA   1 1 
        4  985 1 1 10 PHE CB   C  -5.058  1.441   0.503 1.00 . A A .  11 PHE CB   1 1 
        4  986 1 1 10 PHE CD1  C  -3.120  2.468   1.735 1.00 . A A .  11 PHE CD1  1 1 
        4  987 1 1 10 PHE CD2  C  -5.302  2.687   2.668 1.00 . A A .  11 PHE CD2  1 1 
        4  988 1 1 10 PHE CE1  C  -2.590  3.168   2.798 1.00 . A A .  11 PHE CE1  1 1 
        4  989 1 1 10 PHE CE2  C  -4.777  3.392   3.734 1.00 . A A .  11 PHE CE2  1 1 
        4  990 1 1 10 PHE CG   C  -4.481  2.217   1.656 1.00 . A A .  11 PHE CG   1 1 
        4  991 1 1 10 PHE CZ   C  -3.418  3.632   3.797 1.00 . A A .  11 PHE CZ   1 1 
        4  992 1 1 10 PHE H    H  -5.493  0.572  -2.133 1.00 . A A .  11 PHE H    1 1 
        4  993 1 1 10 PHE HA   H  -5.279  3.155  -0.766 1.00 . A A .  11 PHE HA   1 1 
        4  994 1 1 10 PHE HB2  H  -6.107  1.276   0.709 1.00 . A A .  11 PHE HB2  1 1 
        4  995 1 1 10 PHE HB3  H  -4.556  0.486   0.458 1.00 . A A .  11 PHE HB3  1 1 
        4  996 1 1 10 PHE HD1  H  -2.468  2.110   0.951 1.00 . A A .  11 PHE HD1  1 1 
        4  997 1 1 10 PHE HD2  H  -6.365  2.500   2.619 1.00 . A A .  11 PHE HD2  1 1 
        4  998 1 1 10 PHE HE1  H  -1.528  3.356   2.847 1.00 . A A .  11 PHE HE1  1 1 
        4  999 1 1 10 PHE HE2  H  -5.428  3.753   4.517 1.00 . A A .  11 PHE HE2  1 1 
        4 1000 1 1 10 PHE HZ   H  -3.004  4.177   4.627 1.00 . A A .  11 PHE HZ   1 1 
        4 1001 1 1 10 PHE N    N  -5.750  1.465  -1.834 1.00 . A A .  11 PHE N    1 1 
        4 1002 1 1 10 PHE O    O  -2.977  0.975  -1.625 1.00 . A A .  11 PHE O    1 1 
        4 1003 1 1 11 THR C    C  -0.412  3.846  -0.843 1.00 . A A .  12 THR C    1 1 
        4 1004 1 1 11 THR CA   C  -1.308  3.098  -1.826 1.00 . A A .  12 THR CA   1 1 
        4 1005 1 1 11 THR CB   C  -1.117  3.658  -3.250 1.00 . A A .  12 THR CB   1 1 
        4 1006 1 1 11 THR CG2  C   0.324  3.507  -3.720 1.00 . A A .  12 THR CG2  1 1 
        4 1007 1 1 11 THR H    H  -3.060  4.076  -1.215 1.00 . A A .  12 THR H    1 1 
        4 1008 1 1 11 THR HA   H  -1.028  2.054  -1.831 1.00 . A A .  12 THR HA   1 1 
        4 1009 1 1 11 THR HB   H  -1.372  4.707  -3.244 1.00 . A A .  12 THR HB   1 1 
        4 1010 1 1 11 THR HG1  H  -2.507  2.319  -3.658 1.00 . A A .  12 THR HG1  1 1 
        4 1011 1 1 11 THR HG21 H   0.417  3.900  -4.721 1.00 . A A .  12 THR HG21 1 1 
        4 1012 1 1 11 THR HG22 H   0.600  2.463  -3.716 1.00 . A A .  12 THR HG22 1 1 
        4 1013 1 1 11 THR HG23 H   0.979  4.054  -3.057 1.00 . A A .  12 THR HG23 1 1 
        4 1014 1 1 11 THR N    N  -2.697  3.188  -1.419 1.00 . A A .  12 THR N    1 1 
        4 1015 1 1 11 THR O    O  -0.449  5.074  -0.761 1.00 . A A .  12 THR O    1 1 
        4 1016 1 1 11 THR OG1  O  -1.992  2.966  -4.152 1.00 . A A .  12 THR OG1  1 1 
        4 1017 1 1 12 SER C    C   2.700  3.154   0.607 1.00 . A A .  13 SER C    1 1 
        4 1018 1 1 12 SER CA   C   1.291  3.679   0.874 1.00 . A A .  13 SER CA   1 1 
        4 1019 1 1 12 SER CB   C   0.854  3.335   2.301 1.00 . A A .  13 SER CB   1 1 
        4 1020 1 1 12 SER H    H   0.333  2.121  -0.171 1.00 . A A .  13 SER H    1 1 
        4 1021 1 1 12 SER HA   H   1.275  4.750   0.746 1.00 . A A .  13 SER HA   1 1 
        4 1022 1 1 12 SER HB2  H  -0.196  3.556   2.416 1.00 . A A .  13 SER HB2  1 1 
        4 1023 1 1 12 SER HB3  H   1.019  2.282   2.483 1.00 . A A .  13 SER HB3  1 1 
        4 1024 1 1 12 SER HG   H   1.037  4.188   4.061 1.00 . A A .  13 SER HG   1 1 
        4 1025 1 1 12 SER N    N   0.372  3.097  -0.084 1.00 . A A .  13 SER N    1 1 
        4 1026 1 1 12 SER O    O   2.961  1.956   0.746 1.00 . A A .  13 SER O    1 1 
        4 1027 1 1 12 SER OG   O   1.582  4.083   3.260 1.00 . A A .  13 SER OG   1 1 
        4 1028 1 1 13 CYS C    C   5.978  4.475   0.557 1.00 . A A .  14 CYS C    1 1 
        4 1029 1 1 13 CYS CA   C   4.946  3.603  -0.140 1.00 . A A .  14 CYS CA   1 1 
        4 1030 1 1 13 CYS CB   C   5.160  3.640  -1.651 1.00 . A A .  14 CYS CB   1 1 
        4 1031 1 1 13 CYS H    H   3.369  4.980   0.119 1.00 . A A .  14 CYS H    1 1 
        4 1032 1 1 13 CYS HA   H   5.063  2.586   0.202 1.00 . A A .  14 CYS HA   1 1 
        4 1033 1 1 13 CYS HB2  H   4.350  3.115  -2.139 1.00 . A A .  14 CYS HB2  1 1 
        4 1034 1 1 13 CYS HB3  H   5.169  4.668  -1.985 1.00 . A A .  14 CYS HB3  1 1 
        4 1035 1 1 13 CYS N    N   3.602  4.029   0.193 1.00 . A A .  14 CYS N    1 1 
        4 1036 1 1 13 CYS O    O   5.975  5.698   0.410 1.00 . A A .  14 CYS O    1 1 
        4 1037 1 1 13 CYS SG   S   6.721  2.869  -2.185 1.00 . A A .  14 CYS SG   1 1 
        4 1038 1 1 14 LYS C    C   9.072  3.540   2.272 1.00 . A A .  15 LYS C    1 1 
        4 1039 1 1 14 LYS CA   C   7.937  4.522   1.993 1.00 . A A .  15 LYS CA   1 1 
        4 1040 1 1 14 LYS CB   C   7.460  5.234   3.283 1.00 . A A .  15 LYS CB   1 1 
        4 1041 1 1 14 LYS CD   C   5.751  3.638   4.313 1.00 . A A .  15 LYS CD   1 1 
        4 1042 1 1 14 LYS CE   C   5.908  2.202   3.835 1.00 . A A .  15 LYS CE   1 1 
        4 1043 1 1 14 LYS CG   C   7.095  4.340   4.472 1.00 . A A .  15 LYS CG   1 1 
        4 1044 1 1 14 LYS H    H   6.791  2.858   1.398 1.00 . A A .  15 LYS H    1 1 
        4 1045 1 1 14 LYS HA   H   8.310  5.271   1.309 1.00 . A A .  15 LYS HA   1 1 
        4 1046 1 1 14 LYS HB2  H   8.243  5.902   3.608 1.00 . A A .  15 LYS HB2  1 1 
        4 1047 1 1 14 LYS HB3  H   6.590  5.828   3.037 1.00 . A A .  15 LYS HB3  1 1 
        4 1048 1 1 14 LYS HD2  H   5.247  3.631   5.268 1.00 . A A .  15 LYS HD2  1 1 
        4 1049 1 1 14 LYS HD3  H   5.156  4.184   3.597 1.00 . A A .  15 LYS HD3  1 1 
        4 1050 1 1 14 LYS HE2  H   4.978  1.677   3.996 1.00 . A A .  15 LYS HE2  1 1 
        4 1051 1 1 14 LYS HE3  H   6.140  2.208   2.778 1.00 . A A .  15 LYS HE3  1 1 
        4 1052 1 1 14 LYS HG2  H   7.862  3.588   4.585 1.00 . A A .  15 LYS HG2  1 1 
        4 1053 1 1 14 LYS HG3  H   7.065  4.950   5.364 1.00 . A A .  15 LYS HG3  1 1 
        4 1054 1 1 14 LYS HZ1  H   6.922  0.468   4.425 1.00 . A A .  15 LYS HZ1  1 1 
        4 1055 1 1 14 LYS HZ2  H   6.935  1.702   5.581 1.00 . A A .  15 LYS HZ2  1 1 
        4 1056 1 1 14 LYS HZ3  H   7.926  1.820   4.207 1.00 . A A .  15 LYS HZ3  1 1 
        4 1057 1 1 14 LYS N    N   6.855  3.836   1.314 1.00 . A A .  15 LYS N    1 1 
        4 1058 1 1 14 LYS NZ   N   6.995  1.497   4.566 1.00 . A A .  15 LYS NZ   1 1 
        4 1059 1 1 14 LYS O    O   8.864  2.581   3.047 1.00 . A A .  15 LYS O    1 1 
        4 1060 1 1 14 LYS OXT  O  10.154  3.712   1.677 1.00 . A A .  15 LYS OXT  1 1 
        4 1061 2 2  1 .   C1   C   8.938 -2.577  -0.469 1.00 . B A . 101 OCA C1   1 1 
        4 1062 2 2  1 .   C2   C   8.358 -2.655   0.936 1.00 . B A . 101 OCA C2   1 1 
        4 1063 2 2  1 .   C3   C   9.424 -2.645   2.020 1.00 . B A . 101 OCA C3   1 1 
        4 1064 2 2  1 .   C4   C   8.914 -1.964   3.281 1.00 . B A . 101 OCA C4   1 1 
        4 1065 2 2  1 .   C5   C  10.051 -1.547   4.200 1.00 . B A . 101 OCA C5   1 1 
        4 1066 2 2  1 .   C6   C  10.213 -0.035   4.237 1.00 . B A . 101 OCA C6   1 1 
        4 1067 2 2  1 .   C7   C  10.466  0.474   5.650 1.00 . B A . 101 OCA C7   1 1 
        4 1068 2 2  1 .   C8   C  11.755 -0.073   6.221 1.00 . B A . 101 OCA C8   1 1 
        4 1069 2 2  1 .   H21  H   7.706 -1.808   1.085 1.00 . B A . 101 OCA H21  1 1 
        4 1070 2 2  1 .   H22  H   7.786 -3.567   1.020 1.00 . B A . 101 OCA H22  1 1 
        4 1071 2 2  1 .   H31  H   9.699 -3.665   2.255 1.00 . B A . 101 OCA H31  1 1 
        4 1072 2 2  1 .   H32  H  10.289 -2.112   1.656 1.00 . B A . 101 OCA H32  1 1 
        4 1073 2 2  1 .   H41  H   8.354 -1.086   3.000 1.00 . B A . 101 OCA H41  1 1 
        4 1074 2 2  1 .   H42  H   8.270 -2.649   3.813 1.00 . B A . 101 OCA H42  1 1 
        4 1075 2 2  1 .   H51  H   9.843 -1.902   5.199 1.00 . B A . 101 OCA H51  1 1 
        4 1076 2 2  1 .   H52  H  10.970 -1.988   3.843 1.00 . B A . 101 OCA H52  1 1 
        4 1077 2 2  1 .   H61  H  11.048  0.243   3.614 1.00 . B A . 101 OCA H61  1 1 
        4 1078 2 2  1 .   H62  H   9.310  0.423   3.857 1.00 . B A . 101 OCA H62  1 1 
        4 1079 2 2  1 .   H71  H  10.530  1.552   5.631 1.00 . B A . 101 OCA H71  1 1 
        4 1080 2 2  1 .   H72  H   9.650  0.167   6.288 1.00 . B A . 101 OCA H72  1 1 
        4 1081 2 2  1 .   H81  H  11.538 -0.931   6.842 1.00 . B A . 101 OCA H81  1 1 
        4 1082 2 2  1 .   H82  H  12.237  0.689   6.817 1.00 . B A . 101 OCA H82  1 1 
        4 1083 2 2  1 .   H83  H  12.411 -0.368   5.415 1.00 . B A . 101 OCA H83  1 1 
        4 1084 2 2  1 .   O1   O   9.268 -3.562  -1.132 1.00 . B A . 101 OCA O1   1 1 
        5 1085 1 1  1 PRO C    C   7.146 -0.579   0.212 1.00 . A A .   2 PRO C    1 1 
        5 1086 1 1  1 PRO CA   C   8.546 -1.185   0.323 1.00 . A A .   2 PRO CA   1 1 
        5 1087 1 1  1 PRO CB   C   9.608 -0.076   0.253 1.00 . A A .   2 PRO CB   1 1 
        5 1088 1 1  1 PRO CD   C   9.767 -1.381  -1.751 1.00 . A A .   2 PRO CD   1 1 
        5 1089 1 1  1 PRO CG   C  10.539 -0.461  -0.854 1.00 . A A .   2 PRO CG   1 1 
        5 1090 1 1  1 PRO HA   H   8.631 -1.705   1.267 1.00 . A A .   2 PRO HA   1 1 
        5 1091 1 1  1 PRO HB2  H   9.128  0.869   0.045 1.00 . A A .   2 PRO HB2  1 1 
        5 1092 1 1  1 PRO HB3  H  10.127 -0.014   1.197 1.00 . A A .   2 PRO HB3  1 1 
        5 1093 1 1  1 PRO HD2  H   9.196 -0.817  -2.475 1.00 . A A .   2 PRO HD2  1 1 
        5 1094 1 1  1 PRO HD3  H  10.429 -2.078  -2.242 1.00 . A A .   2 PRO HD3  1 1 
        5 1095 1 1  1 PRO HG2  H  10.844  0.423  -1.394 1.00 . A A .   2 PRO HG2  1 1 
        5 1096 1 1  1 PRO HG3  H  11.400 -0.969  -0.446 1.00 . A A .   2 PRO HG3  1 1 
        5 1097 1 1  1 PRO N    N   8.884 -2.070  -0.808 1.00 . A A .   2 PRO N    1 1 
        5 1098 1 1  1 PRO O    O   6.765  0.275   1.009 1.00 . A A .   2 PRO O    1 1 
        5 1099 1 1  2 CYS C    C   4.099 -1.823  -0.574 1.00 . A A .   3 CYS C    1 1 
        5 1100 1 1  2 CYS CA   C   4.997 -0.633  -0.899 1.00 . A A .   3 CYS CA   1 1 
        5 1101 1 1  2 CYS CB   C   4.710 -0.120  -2.313 1.00 . A A .   3 CYS CB   1 1 
        5 1102 1 1  2 CYS H    H   6.773 -1.642  -1.431 1.00 . A A .   3 CYS H    1 1 
        5 1103 1 1  2 CYS HA   H   4.813  0.160  -0.189 1.00 . A A .   3 CYS HA   1 1 
        5 1104 1 1  2 CYS HB2  H   4.879 -0.917  -3.020 1.00 . A A .   3 CYS HB2  1 1 
        5 1105 1 1  2 CYS HB3  H   3.679  0.193  -2.371 1.00 . A A .   3 CYS HB3  1 1 
        5 1106 1 1  2 CYS N    N   6.388 -1.030  -0.771 1.00 . A A .   3 CYS N    1 1 
        5 1107 1 1  2 CYS O    O   4.117 -2.834  -1.277 1.00 . A A .   3 CYS O    1 1 
        5 1108 1 1  2 CYS SG   S   5.749  1.291  -2.813 1.00 . A A .   3 CYS SG   1 1 
        5 1109 1 1  3 LYS C    C   1.030 -2.417   0.732 1.00 . A A .   4 LYS C    1 1 
        5 1110 1 1  3 LYS CA   C   2.481 -2.798   0.948 1.00 . A A .   4 LYS CA   1 1 
        5 1111 1 1  3 LYS CB   C   2.710 -3.092   2.435 1.00 . A A .   4 LYS CB   1 1 
        5 1112 1 1  3 LYS CD   C   2.824 -5.604   2.330 1.00 . A A .   4 LYS CD   1 1 
        5 1113 1 1  3 LYS CE   C   2.252 -6.909   2.863 1.00 . A A .   4 LYS CE   1 1 
        5 1114 1 1  3 LYS CG   C   2.098 -4.399   2.910 1.00 . A A .   4 LYS CG   1 1 
        5 1115 1 1  3 LYS H    H   3.348 -0.877   1.020 1.00 . A A .   4 LYS H    1 1 
        5 1116 1 1  3 LYS HA   H   2.710 -3.678   0.367 1.00 . A A .   4 LYS HA   1 1 
        5 1117 1 1  3 LYS HB2  H   3.770 -3.131   2.623 1.00 . A A .   4 LYS HB2  1 1 
        5 1118 1 1  3 LYS HB3  H   2.279 -2.290   3.016 1.00 . A A .   4 LYS HB3  1 1 
        5 1119 1 1  3 LYS HD2  H   2.719 -5.592   1.255 1.00 . A A .   4 LYS HD2  1 1 
        5 1120 1 1  3 LYS HD3  H   3.870 -5.544   2.593 1.00 . A A .   4 LYS HD3  1 1 
        5 1121 1 1  3 LYS HE2  H   2.282 -6.890   3.942 1.00 . A A .   4 LYS HE2  1 1 
        5 1122 1 1  3 LYS HE3  H   1.225 -6.997   2.534 1.00 . A A .   4 LYS HE3  1 1 
        5 1123 1 1  3 LYS HG2  H   2.155 -4.441   3.987 1.00 . A A .   4 LYS HG2  1 1 
        5 1124 1 1  3 LYS HG3  H   1.063 -4.432   2.602 1.00 . A A .   4 LYS HG3  1 1 
        5 1125 1 1  3 LYS HZ1  H   3.063 -8.085   1.337 1.00 . A A .   4 LYS HZ1  1 1 
        5 1126 1 1  3 LYS HZ2  H   2.557 -8.972   2.688 1.00 . A A .   4 LYS HZ2  1 1 
        5 1127 1 1  3 LYS HZ3  H   3.992 -8.068   2.755 1.00 . A A .   4 LYS HZ3  1 1 
        5 1128 1 1  3 LYS N    N   3.342 -1.713   0.509 1.00 . A A .   4 LYS N    1 1 
        5 1129 1 1  3 LYS NZ   N   3.017 -8.087   2.379 1.00 . A A .   4 LYS NZ   1 1 
        5 1130 1 1  3 LYS O    O   0.568 -1.404   1.256 1.00 . A A .   4 LYS O    1 1 
        5 1131 1 1  4 ASN C    C  -1.934 -4.001   0.491 1.00 . A A .   5 ASN C    1 1 
        5 1132 1 1  4 ASN CA   C  -1.098 -2.948  -0.240 1.00 . A A .   5 ASN CA   1 1 
        5 1133 1 1  4 ASN CB   C  -1.427 -2.976  -1.737 1.00 . A A .   5 ASN CB   1 1 
        5 1134 1 1  4 ASN CG   C  -0.586 -2.011  -2.557 1.00 . A A .   5 ASN CG   1 1 
        5 1135 1 1  4 ASN H    H   0.725 -4.002  -0.452 1.00 . A A .   5 ASN H    1 1 
        5 1136 1 1  4 ASN HA   H  -1.309 -1.963   0.146 1.00 . A A .   5 ASN HA   1 1 
        5 1137 1 1  4 ASN HB2  H  -1.262 -3.974  -2.114 1.00 . A A .   5 ASN HB2  1 1 
        5 1138 1 1  4 ASN HB3  H  -2.467 -2.717  -1.869 1.00 . A A .   5 ASN HB3  1 1 
        5 1139 1 1  4 ASN HD21 H  -1.919 -0.562  -2.278 1.00 . A A .   5 ASN HD21 1 1 
        5 1140 1 1  4 ASN HD22 H  -0.538 -0.146  -3.227 1.00 . A A .   5 ASN HD22 1 1 
        5 1141 1 1  4 ASN N    N   0.307 -3.220  -0.027 1.00 . A A .   5 ASN N    1 1 
        5 1142 1 1  4 ASN ND2  N  -1.059 -0.782  -2.701 1.00 . A A .   5 ASN ND2  1 1 
        5 1143 1 1  4 ASN O    O  -1.948 -5.168   0.100 1.00 . A A .   5 ASN O    1 1 
        5 1144 1 1  4 ASN OD1  O   0.480 -2.367  -3.062 1.00 . A A .   5 ASN OD1  1 1 
        5 1145 1 1  5 .   C    C  -4.694 -4.915   1.565 1.00 . A A .   6 O6H C    1 1 
        5 1146 1 1  5 .   CA   C  -3.441 -4.518   2.335 1.00 . A A .   6 O6H CA   1 1 
        5 1147 1 1  5 .   CB   C  -3.822 -3.916   3.691 1.00 . A A .   6 O6H CB   1 1 
        5 1148 1 1  5 .   CD1  C  -1.840 -4.404   5.195 1.00 . A A .   6 O6H CD1  1 1 
        5 1149 1 1  5 .   CD2  C  -2.309 -2.135   4.632 1.00 . A A .   6 O6H CD2  1 1 
        5 1150 1 1  5 .   CE1  C  -0.755 -3.998   5.951 1.00 . A A .   6 O6H CE1  1 1 
        5 1151 1 1  5 .   CE2  C  -1.230 -1.716   5.386 1.00 . A A .   6 O6H CE2  1 1 
        5 1152 1 1  5 .   CF1  C  -2.163 -5.868   5.109 1.00 . A A .   6 O6H CF1  1 1 
        5 1153 1 1  5 .   CF2  C  -3.151 -1.108   3.929 1.00 . A A .   6 O6H CF2  1 1 
        5 1154 1 1  5 .   CG   C  -2.639 -3.480   4.522 1.00 . A A .   6 O6H CG   1 1 
        5 1155 1 1  5 .   CH   C   0.719 -2.197   6.851 1.00 . A A .   6 O6H CH   1 1 
        5 1156 1 1  5 .   CZ   C  -0.456 -2.653   6.040 1.00 . A A .   6 O6H CZ   1 1 
        5 1157 1 1  5 .   H1   H  -2.537 -2.675   1.875 1.00 . A A .   6 O6H H1   1 1 
        5 1158 1 1  5 .   HA   H  -2.858 -5.408   2.509 1.00 . A A .   6 O6H HA   1 1 
        5 1159 1 1  5 .   HB1  H  -4.374 -4.652   4.257 1.00 . A A .   6 O6H HB1  1 1 
        5 1160 1 1  5 .   HB2  H  -4.448 -3.051   3.529 1.00 . A A .   6 O6H HB2  1 1 
        5 1161 1 1  5 .   HE1  H  -0.147 -4.726   6.470 1.00 . A A .   6 O6H HE1  1 1 
        5 1162 1 1  5 .   HE2  H  -0.989 -0.665   5.461 1.00 . A A .   6 O6H HE2  1 1 
        5 1163 1 1  5 .   HF11 H  -3.154 -6.109   5.464 1.00 . A A .   6 O6H HF11 1 1 
        5 1164 1 1  5 .   HF12 H  -1.493 -6.489   5.686 1.00 . A A .   6 O6H HF12 1 1 
        5 1165 1 1  5 .   HF13 H  -2.118 -6.257   4.103 1.00 . A A .   6 O6H HF13 1 1 
        5 1166 1 1  5 .   HF21 H  -3.152 -1.215   2.854 1.00 . A A .   6 O6H HF21 1 1 
        5 1167 1 1  5 .   HF22 H  -2.834 -0.092   4.113 1.00 . A A .   6 O6H HF22 1 1 
        5 1168 1 1  5 .   HF23 H  -4.189 -1.141   4.218 1.00 . A A .   6 O6H HF23 1 1 
        5 1169 1 1  5 .   HH1  H   1.295 -1.422   6.369 1.00 . A A .   6 O6H HH1  1 1 
        5 1170 1 1  5 .   HH2  H   1.425 -2.987   7.066 1.00 . A A .   6 O6H HH2  1 1 
        5 1171 1 1  5 .   HH3  H   0.444 -1.790   7.814 1.00 . A A .   6 O6H HH3  1 1 
        5 1172 1 1  5 .   N    N  -2.611 -3.600   1.570 1.00 . A A .   6 O6H N    1 1 
        5 1173 1 1  5 .   O    O  -5.135 -6.063   1.620 1.00 . A A .   6 O6H O    1 1 
        5 1174 1 1  6 PHE C    C  -6.443 -4.177  -1.277 1.00 . A A .   7 PHE C    1 1 
        5 1175 1 1  6 PHE CA   C  -6.579 -4.134   0.238 1.00 . A A .   7 PHE CA   1 1 
        5 1176 1 1  6 PHE CB   C  -7.546 -3.008   0.620 1.00 . A A .   7 PHE CB   1 1 
        5 1177 1 1  6 PHE CD1  C  -7.628 -3.408   3.101 1.00 . A A .   7 PHE CD1  1 1 
        5 1178 1 1  6 PHE CD2  C  -7.077 -1.224   2.316 1.00 . A A .   7 PHE CD2  1 1 
        5 1179 1 1  6 PHE CE1  C  -7.501 -2.971   4.406 1.00 . A A .   7 PHE CE1  1 1 
        5 1180 1 1  6 PHE CE2  C  -6.949 -0.783   3.616 1.00 . A A .   7 PHE CE2  1 1 
        5 1181 1 1  6 PHE CG   C  -7.416 -2.540   2.042 1.00 . A A .   7 PHE CG   1 1 
        5 1182 1 1  6 PHE CZ   C  -7.161 -1.657   4.663 1.00 . A A .   7 PHE CZ   1 1 
        5 1183 1 1  6 PHE H    H  -4.831 -3.078   0.798 1.00 . A A .   7 PHE H    1 1 
        5 1184 1 1  6 PHE HA   H  -6.981 -5.074   0.580 1.00 . A A .   7 PHE HA   1 1 
        5 1185 1 1  6 PHE HB2  H  -7.367 -2.158  -0.022 1.00 . A A .   7 PHE HB2  1 1 
        5 1186 1 1  6 PHE HB3  H  -8.559 -3.354   0.474 1.00 . A A .   7 PHE HB3  1 1 
        5 1187 1 1  6 PHE HD1  H  -7.893 -4.436   2.899 1.00 . A A .   7 PHE HD1  1 1 
        5 1188 1 1  6 PHE HD2  H  -6.912 -0.537   1.499 1.00 . A A .   7 PHE HD2  1 1 
        5 1189 1 1  6 PHE HE1  H  -7.665 -3.656   5.224 1.00 . A A .   7 PHE HE1  1 1 
        5 1190 1 1  6 PHE HE2  H  -6.686  0.246   3.814 1.00 . A A .   7 PHE HE2  1 1 
        5 1191 1 1  6 PHE HZ   H  -7.061 -1.316   5.681 1.00 . A A .   7 PHE HZ   1 1 
        5 1192 1 1  6 PHE N    N  -5.280 -3.941   0.874 1.00 . A A .   7 PHE N    1 1 
        5 1193 1 1  6 PHE O    O  -7.335 -4.646  -1.977 1.00 . A A .   7 PHE O    1 1 
        5 1194 1 1  7 DTR C    C  -4.726 -2.188  -3.669 1.00 . A A .   8 DTR C    1 1 
        5 1195 1 1  7 DTR CA   C  -5.109 -3.600  -3.212 1.00 . A A .   8 DTR CA   1 1 
        5 1196 1 1  7 DTR CB   C  -4.027 -4.602  -3.633 1.00 . A A .   8 DTR CB   1 1 
        5 1197 1 1  7 DTR CD1  C  -2.633 -3.909  -5.673 1.00 . A A .   8 DTR CD1  1 1 
        5 1198 1 1  7 DTR CD2  C  -4.487 -5.066  -6.173 1.00 . A A .   8 DTR CD2  1 1 
        5 1199 1 1  7 DTR CE2  C  -3.823 -4.741  -7.369 1.00 . A A .   8 DTR CE2  1 1 
        5 1200 1 1  7 DTR CE3  C  -5.683 -5.795  -6.243 1.00 . A A .   8 DTR CE3  1 1 
        5 1201 1 1  7 DTR CG   C  -3.708 -4.527  -5.096 1.00 . A A .   8 DTR CG   1 1 
        5 1202 1 1  7 DTR CH2  C  -5.479 -5.827  -8.656 1.00 . A A .   8 DTR CH2  1 1 
        5 1203 1 1  7 DTR CZ2  C  -4.311 -5.116  -8.617 1.00 . A A .   8 DTR CZ2  1 1 
        5 1204 1 1  7 DTR CZ3  C  -6.165 -6.167  -7.484 1.00 . A A .   8 DTR CZ3  1 1 
        5 1205 1 1  7 DTR H    H  -4.660 -3.288  -1.180 1.00 . A A .   8 DTR H    1 1 
        5 1206 1 1  7 DTR HA   H  -6.015 -3.924  -3.705 1.00 . A A .   8 DTR HA   1 1 
        5 1207 1 1  7 DTR HB2  H  -3.121 -4.407  -3.078 1.00 . A A .   8 DTR HB2  1 1 
        5 1208 1 1  7 DTR HB3  H  -4.370 -5.602  -3.417 1.00 . A A .   8 DTR HB3  1 1 
        5 1209 1 1  7 DTR HD1  H  -1.853 -3.401  -5.124 1.00 . A A .   8 DTR HD1  1 1 
        5 1210 1 1  7 DTR HE1  H  -2.035 -3.681  -7.681 1.00 . A A .   8 DTR HE1  1 1 
        5 1211 1 1  7 DTR HE3  H  -6.229 -6.067  -5.349 1.00 . A A .   8 DTR HE3  1 1 
        5 1212 1 1  7 DTR HH2  H  -5.892 -6.138  -9.603 1.00 . A A .   8 DTR HH2  1 1 
        5 1213 1 1  7 DTR HZ2  H  -3.796 -4.859  -9.529 1.00 . A A .   8 DTR HZ2  1 1 
        5 1214 1 1  7 DTR HZ3  H  -7.085 -6.729  -7.560 1.00 . A A .   8 DTR HZ3  1 1 
        5 1215 1 1  7 DTR N    N  -5.337 -3.649  -1.781 1.00 . A A .   8 DTR N    1 1 
        5 1216 1 1  7 DTR NE1  N  -2.696 -4.038  -7.040 1.00 . A A .   8 DTR NE1  1 1 
        5 1217 1 1  7 DTR O    O  -3.854 -1.561  -3.071 1.00 . A A .   8 DTR O    1 1 
        5 1218 1 1  8 LYS C    C  -5.654  0.780  -4.732 1.00 . A A .   9 LYS C    1 1 
        5 1219 1 1  8 LYS CA   C  -4.956 -0.435  -5.344 1.00 . A A .   9 LYS CA   1 1 
        5 1220 1 1  8 LYS CB   C  -5.186 -0.511  -6.857 1.00 . A A .   9 LYS CB   1 1 
        5 1221 1 1  8 LYS CD   C  -4.579  0.393  -9.133 1.00 . A A .   9 LYS CD   1 1 
        5 1222 1 1  8 LYS CE   C  -3.725 -0.783  -9.586 1.00 . A A .   9 LYS CE   1 1 
        5 1223 1 1  8 LYS CG   C  -4.494  0.602  -7.633 1.00 . A A .   9 LYS CG   1 1 
        5 1224 1 1  8 LYS H    H  -6.192 -2.121  -5.045 1.00 . A A .   9 LYS H    1 1 
        5 1225 1 1  8 LYS HA   H  -3.896 -0.339  -5.163 1.00 . A A .   9 LYS HA   1 1 
        5 1226 1 1  8 LYS HB2  H  -4.816 -1.458  -7.218 1.00 . A A .   9 LYS HB2  1 1 
        5 1227 1 1  8 LYS HB3  H  -6.246 -0.451  -7.050 1.00 . A A .   9 LYS HB3  1 1 
        5 1228 1 1  8 LYS HD2  H  -5.607  0.202  -9.402 1.00 . A A .   9 LYS HD2  1 1 
        5 1229 1 1  8 LYS HD3  H  -4.235  1.289  -9.628 1.00 . A A .   9 LYS HD3  1 1 
        5 1230 1 1  8 LYS HE2  H  -2.702 -0.605  -9.293 1.00 . A A .   9 LYS HE2  1 1 
        5 1231 1 1  8 LYS HE3  H  -4.088 -1.682  -9.110 1.00 . A A .   9 LYS HE3  1 1 
        5 1232 1 1  8 LYS HG2  H  -4.964  1.541  -7.389 1.00 . A A .   9 LYS HG2  1 1 
        5 1233 1 1  8 LYS HG3  H  -3.454  0.635  -7.341 1.00 . A A .   9 LYS HG3  1 1 
        5 1234 1 1  8 LYS HZ1  H  -3.127 -1.712 -11.360 1.00 . A A .   9 LYS HZ1  1 1 
        5 1235 1 1  8 LYS HZ2  H  -3.512 -0.070 -11.537 1.00 . A A .   9 LYS HZ2  1 1 
        5 1236 1 1  8 LYS HZ3  H  -4.745 -1.221 -11.354 1.00 . A A .   9 LYS HZ3  1 1 
        5 1237 1 1  8 LYS N    N  -5.390 -1.671  -4.705 1.00 . A A .   9 LYS N    1 1 
        5 1238 1 1  8 LYS NZ   N  -3.779 -0.959 -11.059 1.00 . A A .   9 LYS NZ   1 1 
        5 1239 1 1  8 LYS O    O  -5.417  1.920  -5.133 1.00 . A A .   9 LYS O    1 1 
        5 1240 1 1  9 THR C    C  -6.365  2.333  -2.081 1.00 . A A .  10 THR C    1 1 
        5 1241 1 1  9 THR CA   C  -7.244  1.605  -3.101 1.00 . A A .  10 THR CA   1 1 
        5 1242 1 1  9 THR CB   C  -8.481  1.042  -2.386 1.00 . A A .  10 THR CB   1 1 
        5 1243 1 1  9 THR CG2  C  -9.745  1.760  -2.835 1.00 . A A .  10 THR CG2  1 1 
        5 1244 1 1  9 THR H    H  -6.661 -0.392  -3.465 1.00 . A A .  10 THR H    1 1 
        5 1245 1 1  9 THR HA   H  -7.569  2.303  -3.858 1.00 . A A .  10 THR HA   1 1 
        5 1246 1 1  9 THR HB   H  -8.359  1.186  -1.323 1.00 . A A .  10 THR HB   1 1 
        5 1247 1 1  9 THR HG1  H  -9.168 -0.509  -3.429 1.00 . A A .  10 THR HG1  1 1 
        5 1248 1 1  9 THR HG21 H -10.597  1.364  -2.301 1.00 . A A .  10 THR HG21 1 1 
        5 1249 1 1  9 THR HG22 H  -9.887  1.610  -3.896 1.00 . A A .  10 THR HG22 1 1 
        5 1250 1 1  9 THR HG23 H  -9.649  2.816  -2.631 1.00 . A A .  10 THR HG23 1 1 
        5 1251 1 1  9 THR N    N  -6.505  0.534  -3.748 1.00 . A A .  10 THR N    1 1 
        5 1252 1 1  9 THR O    O  -6.442  3.554  -1.941 1.00 . A A .  10 THR O    1 1 
        5 1253 1 1  9 THR OG1  O  -8.592 -0.369  -2.658 1.00 . A A .  10 THR OG1  1 1 
        5 1254 1 1 10 PHE C    C  -3.146  2.104  -0.990 1.00 . A A .  11 PHE C    1 1 
        5 1255 1 1 10 PHE CA   C  -4.591  2.176  -0.437 1.00 . A A .  11 PHE CA   1 1 
        5 1256 1 1 10 PHE CB   C  -4.662  1.399   0.884 1.00 . A A .  11 PHE CB   1 1 
        5 1257 1 1 10 PHE CD1  C  -2.510  1.727   2.143 1.00 . A A .  11 PHE CD1  1 1 
        5 1258 1 1 10 PHE CD2  C  -4.455  2.879   2.898 1.00 . A A .  11 PHE CD2  1 1 
        5 1259 1 1 10 PHE CE1  C  -1.774  2.292   3.165 1.00 . A A .  11 PHE CE1  1 1 
        5 1260 1 1 10 PHE CE2  C  -3.723  3.447   3.923 1.00 . A A .  11 PHE CE2  1 1 
        5 1261 1 1 10 PHE CG   C  -3.858  2.015   1.997 1.00 . A A .  11 PHE CG   1 1 
        5 1262 1 1 10 PHE CZ   C  -2.382  3.155   4.056 1.00 . A A .  11 PHE CZ   1 1 
        5 1263 1 1 10 PHE H    H  -5.468  0.627  -1.568 1.00 . A A .  11 PHE H    1 1 
        5 1264 1 1 10 PHE HA   H  -4.911  3.190  -0.254 1.00 . A A .  11 PHE HA   1 1 
        5 1265 1 1 10 PHE HB2  H  -5.690  1.348   1.211 1.00 . A A .  11 PHE HB2  1 1 
        5 1266 1 1 10 PHE HB3  H  -4.292  0.397   0.724 1.00 . A A .  11 PHE HB3  1 1 
        5 1267 1 1 10 PHE HD1  H  -2.033  1.056   1.445 1.00 . A A .  11 PHE HD1  1 1 
        5 1268 1 1 10 PHE HD2  H  -5.506  3.110   2.798 1.00 . A A .  11 PHE HD2  1 1 
        5 1269 1 1 10 PHE HE1  H  -0.725  2.058   3.269 1.00 . A A .  11 PHE HE1  1 1 
        5 1270 1 1 10 PHE HE2  H  -4.200  4.121   4.618 1.00 . A A .  11 PHE HE2  1 1 
        5 1271 1 1 10 PHE HZ   H  -1.810  3.599   4.856 1.00 . A A .  11 PHE HZ   1 1 
        5 1272 1 1 10 PHE N    N  -5.504  1.589  -1.403 1.00 . A A .  11 PHE N    1 1 
        5 1273 1 1 10 PHE O    O  -2.615  0.997  -1.093 1.00 . A A .  11 PHE O    1 1 
        5 1274 1 1 11 THR C    C  -0.262  4.167  -1.053 1.00 . A A .  12 THR C    1 1 
        5 1275 1 1 11 THR CA   C  -1.119  3.166  -1.824 1.00 . A A .  12 THR CA   1 1 
        5 1276 1 1 11 THR CB   C  -1.006  3.449  -3.337 1.00 . A A .  12 THR CB   1 1 
        5 1277 1 1 11 THR CG2  C   0.425  3.261  -3.828 1.00 . A A .  12 THR CG2  1 1 
        5 1278 1 1 11 THR H    H  -2.949  4.098  -1.396 1.00 . A A .  12 THR H    1 1 
        5 1279 1 1 11 THR HA   H  -0.750  2.169  -1.633 1.00 . A A .  12 THR HA   1 1 
        5 1280 1 1 11 THR HB   H  -1.303  4.471  -3.519 1.00 . A A .  12 THR HB   1 1 
        5 1281 1 1 11 THR HG1  H  -2.305  3.063  -4.773 1.00 . A A .  12 THR HG1  1 1 
        5 1282 1 1 11 THR HG21 H   1.081  3.933  -3.291 1.00 . A A .  12 THR HG21 1 1 
        5 1283 1 1 11 THR HG22 H   0.473  3.481  -4.884 1.00 . A A .  12 THR HG22 1 1 
        5 1284 1 1 11 THR HG23 H   0.736  2.241  -3.658 1.00 . A A .  12 THR HG23 1 1 
        5 1285 1 1 11 THR N    N  -2.501  3.228  -1.376 1.00 . A A .  12 THR N    1 1 
        5 1286 1 1 11 THR O    O  -0.440  5.380  -1.179 1.00 . A A .  12 THR O    1 1 
        5 1287 1 1 11 THR OG1  O  -1.878  2.572  -4.064 1.00 . A A .  12 THR OG1  1 1 
        5 1288 1 1 12 SER C    C   2.993  4.003   0.363 1.00 . A A .  13 SER C    1 1 
        5 1289 1 1 12 SER CA   C   1.553  4.503   0.519 1.00 . A A .  13 SER CA   1 1 
        5 1290 1 1 12 SER CB   C   1.159  4.535   1.998 1.00 . A A .  13 SER CB   1 1 
        5 1291 1 1 12 SER H    H   0.684  2.683  -0.109 1.00 . A A .  13 SER H    1 1 
        5 1292 1 1 12 SER HA   H   1.474  5.502   0.117 1.00 . A A .  13 SER HA   1 1 
        5 1293 1 1 12 SER HB2  H   1.180  3.534   2.399 1.00 . A A .  13 SER HB2  1 1 
        5 1294 1 1 12 SER HB3  H   1.854  5.158   2.543 1.00 . A A .  13 SER HB3  1 1 
        5 1295 1 1 12 SER HG   H  -0.534  5.212   1.290 1.00 . A A .  13 SER HG   1 1 
        5 1296 1 1 12 SER N    N   0.635  3.656  -0.224 1.00 . A A .  13 SER N    1 1 
        5 1297 1 1 12 SER O    O   3.311  2.883   0.761 1.00 . A A .  13 SER O    1 1 
        5 1298 1 1 12 SER OG   O  -0.148  5.059   2.157 1.00 . A A .  13 SER OG   1 1 
        5 1299 1 1 13 CYS C    C   6.115  5.644   0.102 1.00 . A A .  14 CYS C    1 1 
        5 1300 1 1 13 CYS CA   C   5.258  4.482  -0.378 1.00 . A A .  14 CYS CA   1 1 
        5 1301 1 1 13 CYS CB   C   5.590  4.163  -1.838 1.00 . A A .  14 CYS CB   1 1 
        5 1302 1 1 13 CYS H    H   3.536  5.678  -0.604 1.00 . A A .  14 CYS H    1 1 
        5 1303 1 1 13 CYS HA   H   5.460  3.613   0.233 1.00 . A A .  14 CYS HA   1 1 
        5 1304 1 1 13 CYS HB2  H   5.493  5.066  -2.425 1.00 . A A .  14 CYS HB2  1 1 
        5 1305 1 1 13 CYS HB3  H   6.610  3.812  -1.896 1.00 . A A .  14 CYS HB3  1 1 
        5 1306 1 1 13 CYS N    N   3.852  4.821  -0.238 1.00 . A A .  14 CYS N    1 1 
        5 1307 1 1 13 CYS O    O   6.079  6.721  -0.496 1.00 . A A .  14 CYS O    1 1 
        5 1308 1 1 13 CYS SG   S   4.523  2.893  -2.596 1.00 . A A .  14 CYS SG   1 1 
        5 1309 1 1 14 LYS C    C   6.966  7.610   2.340 1.00 . A A .  15 LYS C    1 1 
        5 1310 1 1 14 LYS CA   C   7.756  6.444   1.745 1.00 . A A .  15 LYS CA   1 1 
        5 1311 1 1 14 LYS CB   C   8.719  6.942   0.664 1.00 . A A .  15 LYS CB   1 1 
        5 1312 1 1 14 LYS CD   C   9.964  8.986  -0.107 1.00 . A A .  15 LYS CD   1 1 
        5 1313 1 1 14 LYS CE   C   8.802  9.859  -0.583 1.00 . A A .  15 LYS CE   1 1 
        5 1314 1 1 14 LYS CG   C   9.579  8.120   1.085 1.00 . A A .  15 LYS CG   1 1 
        5 1315 1 1 14 LYS H    H   6.782  4.563   1.650 1.00 . A A .  15 LYS H    1 1 
        5 1316 1 1 14 LYS HA   H   8.327  5.978   2.534 1.00 . A A .  15 LYS HA   1 1 
        5 1317 1 1 14 LYS HB2  H   9.373  6.130   0.386 1.00 . A A .  15 LYS HB2  1 1 
        5 1318 1 1 14 LYS HB3  H   8.145  7.234  -0.201 1.00 . A A .  15 LYS HB3  1 1 
        5 1319 1 1 14 LYS HD2  H  10.785  9.626   0.177 1.00 . A A .  15 LYS HD2  1 1 
        5 1320 1 1 14 LYS HD3  H  10.274  8.342  -0.920 1.00 . A A .  15 LYS HD3  1 1 
        5 1321 1 1 14 LYS HE2  H   8.478 10.476   0.242 1.00 . A A .  15 LYS HE2  1 1 
        5 1322 1 1 14 LYS HE3  H   9.153 10.494  -1.382 1.00 . A A .  15 LYS HE3  1 1 
        5 1323 1 1 14 LYS HG2  H   9.027  8.721   1.792 1.00 . A A .  15 LYS HG2  1 1 
        5 1324 1 1 14 LYS HG3  H  10.478  7.747   1.551 1.00 . A A .  15 LYS HG3  1 1 
        5 1325 1 1 14 LYS HZ1  H   7.193  8.551  -0.286 1.00 . A A .  15 LYS HZ1  1 1 
        5 1326 1 1 14 LYS HZ2  H   7.952  8.369  -1.792 1.00 . A A .  15 LYS HZ2  1 1 
        5 1327 1 1 14 LYS HZ3  H   6.932  9.689  -1.515 1.00 . A A .  15 LYS HZ3  1 1 
        5 1328 1 1 14 LYS N    N   6.856  5.428   1.194 1.00 . A A .  15 LYS N    1 1 
        5 1329 1 1 14 LYS NZ   N   7.640  9.065  -1.077 1.00 . A A .  15 LYS NZ   1 1 
        5 1330 1 1 14 LYS O    O   6.744  7.608   3.570 1.00 . A A .  15 LYS O    1 1 
        5 1331 1 1 14 LYS OXT  O   6.570  8.520   1.578 1.00 . A A .  15 LYS OXT  1 1 
        5 1332 2 2  1 .   C1   C   8.452 -3.351  -0.952 1.00 . B A . 101 OCA C1   1 1 
        5 1333 2 2  1 .   C2   C   7.517 -3.754   0.181 1.00 . B A . 101 OCA C2   1 1 
        5 1334 2 2  1 .   C3   C   8.231 -4.329   1.391 1.00 . B A . 101 OCA C3   1 1 
        5 1335 2 2  1 .   C4   C   7.239 -4.997   2.333 1.00 . B A . 101 OCA C4   1 1 
        5 1336 2 2  1 .   C5   C   7.659 -4.867   3.787 1.00 . B A . 101 OCA C5   1 1 
        5 1337 2 2  1 .   C6   C   7.088 -3.608   4.430 1.00 . B A . 101 OCA C6   1 1 
        5 1338 2 2  1 .   C7   C   8.097 -2.466   4.441 1.00 . B A . 101 OCA C7   1 1 
        5 1339 2 2  1 .   C8   C   9.306 -2.792   5.292 1.00 . B A . 101 OCA C8   1 1 
        5 1340 2 2  1 .   H21  H   6.828 -4.495  -0.195 1.00 . B A . 101 OCA H21  1 1 
        5 1341 2 2  1 .   H22  H   6.965 -2.880   0.492 1.00 . B A . 101 OCA H22  1 1 
        5 1342 2 2  1 .   H31  H   8.957 -5.059   1.060 1.00 . B A . 101 OCA H31  1 1 
        5 1343 2 2  1 .   H32  H   8.733 -3.530   1.915 1.00 . B A . 101 OCA H32  1 1 
        5 1344 2 2  1 .   H41  H   6.273 -4.533   2.209 1.00 . B A . 101 OCA H41  1 1 
        5 1345 2 2  1 .   H42  H   7.170 -6.047   2.081 1.00 . B A . 101 OCA H42  1 1 
        5 1346 2 2  1 .   H51  H   7.302 -5.730   4.331 1.00 . B A . 101 OCA H51  1 1 
        5 1347 2 2  1 .   H52  H   8.736 -4.829   3.837 1.00 . B A . 101 OCA H52  1 1 
        5 1348 2 2  1 .   H61  H   6.215 -3.297   3.874 1.00 . B A . 101 OCA H61  1 1 
        5 1349 2 2  1 .   H62  H   6.807 -3.834   5.448 1.00 . B A . 101 OCA H62  1 1 
        5 1350 2 2  1 .   H71  H   7.626 -1.582   4.843 1.00 . B A . 101 OCA H71  1 1 
        5 1351 2 2  1 .   H72  H   8.429 -2.275   3.430 1.00 . B A . 101 OCA H72  1 1 
        5 1352 2 2  1 .   H81  H  10.174 -2.284   4.898 1.00 . B A . 101 OCA H81  1 1 
        5 1353 2 2  1 .   H82  H   9.477 -3.858   5.280 1.00 . B A . 101 OCA H82  1 1 
        5 1354 2 2  1 .   H83  H   9.130 -2.468   6.307 1.00 . B A . 101 OCA H83  1 1 
        5 1355 2 2  1 .   O1   O   8.809 -4.116  -1.852 1.00 . B A . 101 OCA O1   1 1 
        6 1356 1 1  1 PRO C    C   7.329  0.164   0.341 1.00 . A A .   2 PRO C    1 1 
        6 1357 1 1  1 PRO CA   C   8.715 -0.369   0.698 1.00 . A A .   2 PRO CA   1 1 
        6 1358 1 1  1 PRO CB   C   9.802  0.524   0.076 1.00 . A A .   2 PRO CB   1 1 
        6 1359 1 1  1 PRO CD   C   9.702 -1.560  -1.144 1.00 . A A .   2 PRO CD   1 1 
        6 1360 1 1  1 PRO CG   C  10.537 -0.332  -0.913 1.00 . A A .   2 PRO CG   1 1 
        6 1361 1 1  1 PRO HA   H   8.829 -0.382   1.772 1.00 . A A .   2 PRO HA   1 1 
        6 1362 1 1  1 PRO HB2  H   9.334  1.367  -0.410 1.00 . A A .   2 PRO HB2  1 1 
        6 1363 1 1  1 PRO HB3  H  10.462  0.877   0.854 1.00 . A A .   2 PRO HB3  1 1 
        6 1364 1 1  1 PRO HD2  H   9.027 -1.411  -1.973 1.00 . A A .   2 PRO HD2  1 1 
        6 1365 1 1  1 PRO HD3  H  10.332 -2.421  -1.315 1.00 . A A .   2 PRO HD3  1 1 
        6 1366 1 1  1 PRO HG2  H  10.665  0.207  -1.839 1.00 . A A .   2 PRO HG2  1 1 
        6 1367 1 1  1 PRO HG3  H  11.500 -0.606  -0.507 1.00 . A A .   2 PRO HG3  1 1 
        6 1368 1 1  1 PRO N    N   8.970 -1.689   0.115 1.00 . A A .   2 PRO N    1 1 
        6 1369 1 1  1 PRO O    O   6.883  1.184   0.869 1.00 . A A .   2 PRO O    1 1 
        6 1370 1 1  2 CYS C    C   4.296 -1.130  -0.442 1.00 . A A .   3 CYS C    1 1 
        6 1371 1 1  2 CYS CA   C   5.320 -0.141  -0.983 1.00 . A A .   3 CYS CA   1 1 
        6 1372 1 1  2 CYS CB   C   5.237 -0.077  -2.512 1.00 . A A .   3 CYS CB   1 1 
        6 1373 1 1  2 CYS H    H   7.059 -1.344  -0.937 1.00 . A A .   3 CYS H    1 1 
        6 1374 1 1  2 CYS HA   H   5.120  0.838  -0.578 1.00 . A A .   3 CYS HA   1 1 
        6 1375 1 1  2 CYS HB2  H   5.484 -1.046  -2.922 1.00 . A A .   3 CYS HB2  1 1 
        6 1376 1 1  2 CYS HB3  H   4.229  0.183  -2.799 1.00 . A A .   3 CYS HB3  1 1 
        6 1377 1 1  2 CYS N    N   6.652 -0.537  -0.555 1.00 . A A .   3 CYS N    1 1 
        6 1378 1 1  2 CYS O    O   4.301 -2.303  -0.812 1.00 . A A .   3 CYS O    1 1 
        6 1379 1 1  2 CYS SG   S   6.360  1.147  -3.262 1.00 . A A .   3 CYS SG   1 1 
        6 1380 1 1  3 LYS C    C   1.067 -1.237   0.629 1.00 . A A .   4 LYS C    1 1 
        6 1381 1 1  3 LYS CA   C   2.480 -1.530   1.101 1.00 . A A .   4 LYS CA   1 1 
        6 1382 1 1  3 LYS CB   C   2.570 -1.387   2.627 1.00 . A A .   4 LYS CB   1 1 
        6 1383 1 1  3 LYS CD   C   2.815  0.149   4.612 1.00 . A A .   4 LYS CD   1 1 
        6 1384 1 1  3 LYS CE   C   4.243 -0.206   5.009 1.00 . A A .   4 LYS CE   1 1 
        6 1385 1 1  3 LYS CG   C   2.603  0.058   3.112 1.00 . A A .   4 LYS CG   1 1 
        6 1386 1 1  3 LYS H    H   3.432  0.299   0.662 1.00 . A A .   4 LYS H    1 1 
        6 1387 1 1  3 LYS HA   H   2.728 -2.547   0.834 1.00 . A A .   4 LYS HA   1 1 
        6 1388 1 1  3 LYS HB2  H   1.709 -1.868   3.069 1.00 . A A .   4 LYS HB2  1 1 
        6 1389 1 1  3 LYS HB3  H   3.457 -1.882   2.977 1.00 . A A .   4 LYS HB3  1 1 
        6 1390 1 1  3 LYS HD2  H   2.607  1.159   4.934 1.00 . A A .   4 LYS HD2  1 1 
        6 1391 1 1  3 LYS HD3  H   2.134 -0.532   5.102 1.00 . A A .   4 LYS HD3  1 1 
        6 1392 1 1  3 LYS HE2  H   4.306 -0.241   6.087 1.00 . A A .   4 LYS HE2  1 1 
        6 1393 1 1  3 LYS HE3  H   4.484 -1.179   4.604 1.00 . A A .   4 LYS HE3  1 1 
        6 1394 1 1  3 LYS HG2  H   3.411  0.574   2.616 1.00 . A A .   4 LYS HG2  1 1 
        6 1395 1 1  3 LYS HG3  H   1.665  0.531   2.861 1.00 . A A .   4 LYS HG3  1 1 
        6 1396 1 1  3 LYS HZ1  H   6.183  0.571   4.860 1.00 . A A .   4 LYS HZ1  1 1 
        6 1397 1 1  3 LYS HZ2  H   4.961  1.750   4.812 1.00 . A A .   4 LYS HZ2  1 1 
        6 1398 1 1  3 LYS HZ3  H   5.251  0.774   3.461 1.00 . A A .   4 LYS HZ3  1 1 
        6 1399 1 1  3 LYS N    N   3.438 -0.662   0.451 1.00 . A A .   4 LYS N    1 1 
        6 1400 1 1  3 LYS NZ   N   5.228  0.790   4.498 1.00 . A A .   4 LYS NZ   1 1 
        6 1401 1 1  3 LYS O    O   0.550 -0.135   0.822 1.00 . A A .   4 LYS O    1 1 
        6 1402 1 1  4 ASN C    C  -1.646 -3.258   0.493 1.00 . A A .   5 ASN C    1 1 
        6 1403 1 1  4 ASN CA   C  -0.966 -2.136  -0.290 1.00 . A A .   5 ASN CA   1 1 
        6 1404 1 1  4 ASN CB   C  -1.249 -2.318  -1.790 1.00 . A A .   5 ASN CB   1 1 
        6 1405 1 1  4 ASN CG   C  -0.365 -1.458  -2.679 1.00 . A A .   5 ASN CG   1 1 
        6 1406 1 1  4 ASN H    H   0.962 -2.999  -0.308 1.00 . A A .   5 ASN H    1 1 
        6 1407 1 1  4 ASN HA   H  -1.326 -1.171   0.034 1.00 . A A .   5 ASN HA   1 1 
        6 1408 1 1  4 ASN HB2  H  -1.086 -3.350  -2.052 1.00 . A A .   5 ASN HB2  1 1 
        6 1409 1 1  4 ASN HB3  H  -2.280 -2.062  -1.986 1.00 . A A .   5 ASN HB3  1 1 
        6 1410 1 1  4 ASN HD21 H   0.931 -2.949  -2.878 1.00 . A A .   5 ASN HD21 1 1 
        6 1411 1 1  4 ASN HD22 H   1.332 -1.492  -3.709 1.00 . A A .   5 ASN HD22 1 1 
        6 1412 1 1  4 ASN N    N   0.454 -2.214  -0.019 1.00 . A A .   5 ASN N    1 1 
        6 1413 1 1  4 ASN ND2  N   0.745 -2.024  -3.134 1.00 . A A .   5 ASN ND2  1 1 
        6 1414 1 1  4 ASN O    O  -1.467 -4.430   0.168 1.00 . A A .   5 ASN O    1 1 
        6 1415 1 1  4 ASN OD1  O  -0.679 -0.307  -2.971 1.00 . A A .   5 ASN OD1  1 1 
        6 1416 1 1  5 .   C    C  -4.237 -4.548   1.595 1.00 . A A .   6 O6H C    1 1 
        6 1417 1 1  5 .   CA   C  -3.073 -3.911   2.343 1.00 . A A .   6 O6H CA   1 1 
        6 1418 1 1  5 .   CB   C  -3.534 -3.318   3.676 1.00 . A A .   6 O6H CB   1 1 
        6 1419 1 1  5 .   CD1  C  -1.688 -3.722   5.359 1.00 . A A .   6 O6H CD1  1 1 
        6 1420 1 1  5 .   CD2  C  -2.039 -1.496   4.587 1.00 . A A .   6 O6H CD2  1 1 
        6 1421 1 1  5 .   CE1  C  -0.655 -3.284   6.164 1.00 . A A .   6 O6H CE1  1 1 
        6 1422 1 1  5 .   CE2  C  -1.010 -1.047   5.387 1.00 . A A .   6 O6H CE2  1 1 
        6 1423 1 1  5 .   CF1  C  -2.040 -5.180   5.359 1.00 . A A .   6 O6H CF1  1 1 
        6 1424 1 1  5 .   CF2  C  -2.771 -0.506   3.739 1.00 . A A .   6 O6H CF2  1 1 
        6 1425 1 1  5 .   CG   C  -2.401 -2.837   4.553 1.00 . A A .   6 O6H CG   1 1 
        6 1426 1 1  5 .   CH   C   0.794 -1.458   7.044 1.00 . A A .   6 O6H CH   1 1 
        6 1427 1 1  5 .   CZ   C  -0.324 -1.945   6.174 1.00 . A A .   6 O6H CZ   1 1 
        6 1428 1 1  5 .   H1   H  -2.473 -1.970   1.787 1.00 . A A .   6 O6H H1   1 1 
        6 1429 1 1  5 .   HA   H  -2.352 -4.690   2.554 1.00 . A A .   6 O6H HA   1 1 
        6 1430 1 1  5 .   HB1  H  -4.082 -4.071   4.224 1.00 . A A .   6 O6H HB1  1 1 
        6 1431 1 1  5 .   HB2  H  -4.184 -2.478   3.483 1.00 . A A .   6 O6H HB2  1 1 
        6 1432 1 1  5 .   HE1  H  -0.112 -3.984   6.782 1.00 . A A .   6 O6H HE1  1 1 
        6 1433 1 1  5 .   HE2  H  -0.746 -0.001   5.401 1.00 . A A .   6 O6H HE2  1 1 
        6 1434 1 1  5 .   HF11 H  -2.514 -5.504   6.274 1.00 . A A .   6 O6H HF11 1 1 
        6 1435 1 1  5 .   HF12 H  -1.184 -5.827   5.237 1.00 . A A .   6 O6H HF12 1 1 
        6 1436 1 1  5 .   HF13 H  -2.723 -5.457   4.569 1.00 . A A .   6 O6H HF13 1 1 
        6 1437 1 1  5 .   HF21 H  -3.404  0.158   4.306 1.00 . A A .   6 O6H HF21 1 1 
        6 1438 1 1  5 .   HF22 H  -2.114  0.138   3.176 1.00 . A A .   6 O6H HF22 1 1 
        6 1439 1 1  5 .   HF23 H  -3.417 -0.966   3.006 1.00 . A A .   6 O6H HF23 1 1 
        6 1440 1 1  5 .   HH1  H   1.375 -2.255   7.482 1.00 . A A .   6 O6H HH1  1 1 
        6 1441 1 1  5 .   HH2  H   0.458 -0.857   7.876 1.00 . A A .   6 O6H HH2  1 1 
        6 1442 1 1  5 .   HH3  H   1.506 -0.841   6.516 1.00 . A A .   6 O6H HH3  1 1 
        6 1443 1 1  5 .   N    N  -2.389 -2.913   1.538 1.00 . A A .   6 O6H N    1 1 
        6 1444 1 1  5 .   O    O  -4.479 -5.748   1.703 1.00 . A A .   6 O6H O    1 1 
        6 1445 1 1  6 PHE C    C  -6.134 -4.222  -1.256 1.00 . A A .   7 PHE C    1 1 
        6 1446 1 1  6 PHE CA   C  -6.232 -4.155   0.262 1.00 . A A .   7 PHE CA   1 1 
        6 1447 1 1  6 PHE CB   C  -7.358 -3.200   0.676 1.00 . A A .   7 PHE CB   1 1 
        6 1448 1 1  6 PHE CD1  C  -6.764 -1.125   1.949 1.00 . A A .   7 PHE CD1  1 1 
        6 1449 1 1  6 PHE CD2  C  -7.084 -3.146   3.176 1.00 . A A .   7 PHE CD2  1 1 
        6 1450 1 1  6 PHE CE1  C  -6.468 -0.457   3.120 1.00 . A A .   7 PHE CE1  1 1 
        6 1451 1 1  6 PHE CE2  C  -6.795 -2.481   4.351 1.00 . A A .   7 PHE CE2  1 1 
        6 1452 1 1  6 PHE CG   C  -7.074 -2.474   1.962 1.00 . A A .   7 PHE CG   1 1 
        6 1453 1 1  6 PHE CZ   C  -6.482 -1.134   4.322 1.00 . A A .   7 PHE CZ   1 1 
        6 1454 1 1  6 PHE H    H  -4.661 -2.809   0.711 1.00 . A A .   7 PHE H    1 1 
        6 1455 1 1  6 PHE HA   H  -6.455 -5.143   0.640 1.00 . A A .   7 PHE HA   1 1 
        6 1456 1 1  6 PHE HB2  H  -7.499 -2.462  -0.100 1.00 . A A .   7 PHE HB2  1 1 
        6 1457 1 1  6 PHE HB3  H  -8.271 -3.764   0.804 1.00 . A A .   7 PHE HB3  1 1 
        6 1458 1 1  6 PHE HD1  H  -6.753 -0.593   1.009 1.00 . A A .   7 PHE HD1  1 1 
        6 1459 1 1  6 PHE HD2  H  -7.328 -4.198   3.198 1.00 . A A .   7 PHE HD2  1 1 
        6 1460 1 1  6 PHE HE1  H  -6.233  0.597   3.095 1.00 . A A .   7 PHE HE1  1 1 
        6 1461 1 1  6 PHE HE2  H  -6.806 -3.014   5.290 1.00 . A A .   7 PHE HE2  1 1 
        6 1462 1 1  6 PHE HZ   H  -6.239 -0.618   5.236 1.00 . A A .   7 PHE HZ   1 1 
        6 1463 1 1  6 PHE N    N  -4.970 -3.726   0.857 1.00 . A A .   7 PHE N    1 1 
        6 1464 1 1  6 PHE O    O  -6.950 -4.860  -1.913 1.00 . A A .   7 PHE O    1 1 
        6 1465 1 1  7 DTR C    C  -4.851 -2.064  -3.776 1.00 . A A .   8 DTR C    1 1 
        6 1466 1 1  7 DTR CA   C  -4.960 -3.500  -3.250 1.00 . A A .   8 DTR CA   1 1 
        6 1467 1 1  7 DTR CB   C  -3.715 -4.308  -3.644 1.00 . A A .   8 DTR CB   1 1 
        6 1468 1 1  7 DTR CD1  C  -2.128 -3.682  -5.560 1.00 . A A .   8 DTR CD1  1 1 
        6 1469 1 1  7 DTR CD2  C  -4.126 -4.432  -6.234 1.00 . A A .   8 DTR CD2  1 1 
        6 1470 1 1  7 DTR CE2  C  -3.355 -4.120  -7.369 1.00 . A A .   8 DTR CE2  1 1 
        6 1471 1 1  7 DTR CE3  C  -5.423 -4.922  -6.415 1.00 . A A .   8 DTR CE3  1 1 
        6 1472 1 1  7 DTR CG   C  -3.321 -4.148  -5.084 1.00 . A A .   8 DTR CG   1 1 
        6 1473 1 1  7 DTR CH2  C  -5.109 -4.759  -8.811 1.00 . A A .   8 DTR CH2  1 1 
        6 1474 1 1  7 DTR CZ2  C  -3.837 -4.281  -8.663 1.00 . A A .   8 DTR CZ2  1 1 
        6 1475 1 1  7 DTR CZ3  C  -5.901 -5.079  -7.701 1.00 . A A .   8 DTR CZ3  1 1 
        6 1476 1 1  7 DTR H    H  -4.538 -3.026  -1.241 1.00 . A A .   8 DTR H    1 1 
        6 1477 1 1  7 DTR HA   H  -5.796 -4.008  -3.709 1.00 . A A .   8 DTR HA   1 1 
        6 1478 1 1  7 DTR HB2  H  -2.883 -3.991  -3.035 1.00 . A A .   8 DTR HB2  1 1 
        6 1479 1 1  7 DTR HB3  H  -3.906 -5.358  -3.464 1.00 . A A .   8 DTR HB3  1 1 
        6 1480 1 1  7 DTR HD1  H  -1.302 -3.378  -4.935 1.00 . A A .   8 DTR HD1  1 1 
        6 1481 1 1  7 DTR HE1  H  -1.391 -3.381  -7.507 1.00 . A A .   8 DTR HE1  1 1 
        6 1482 1 1  7 DTR HE3  H  -6.048 -5.176  -5.571 1.00 . A A .   8 DTR HE3  1 1 
        6 1483 1 1  7 DTR HH2  H  -5.524 -4.895  -9.800 1.00 . A A .   8 DTR HH2  1 1 
        6 1484 1 1  7 DTR HZ2  H  -3.241 -4.036  -9.530 1.00 . A A .   8 DTR HZ2  1 1 
        6 1485 1 1  7 DTR HZ3  H  -6.901 -5.453  -7.862 1.00 . A A .   8 DTR HZ3  1 1 
        6 1486 1 1  7 DTR N    N  -5.151 -3.529  -1.811 1.00 . A A .   8 DTR N    1 1 
        6 1487 1 1  7 DTR NE1  N  -2.138 -3.669  -6.932 1.00 . A A .   8 DTR NE1  1 1 
        6 1488 1 1  7 DTR O    O  -3.985 -1.311  -3.334 1.00 . A A .   8 DTR O    1 1 
        6 1489 1 1  8 LYS C    C  -6.350  0.716  -4.589 1.00 . A A .   9 LYS C    1 1 
        6 1490 1 1  8 LYS CA   C  -5.613 -0.378  -5.362 1.00 . A A .   9 LYS CA   1 1 
        6 1491 1 1  8 LYS CB   C  -6.144 -0.487  -6.799 1.00 . A A .   9 LYS CB   1 1 
        6 1492 1 1  8 LYS CD   C  -4.520  1.149  -7.826 1.00 . A A .   9 LYS CD   1 1 
        6 1493 1 1  8 LYS CE   C  -3.811  0.165  -8.743 1.00 . A A .   9 LYS CE   1 1 
        6 1494 1 1  8 LYS CG   C  -5.983  0.780  -7.628 1.00 . A A .   9 LYS CG   1 1 
        6 1495 1 1  8 LYS H    H  -6.493 -2.245  -4.926 1.00 . A A .   9 LYS H    1 1 
        6 1496 1 1  8 LYS HA   H  -4.564 -0.128  -5.396 1.00 . A A .   9 LYS HA   1 1 
        6 1497 1 1  8 LYS HB2  H  -5.620 -1.284  -7.302 1.00 . A A .   9 LYS HB2  1 1 
        6 1498 1 1  8 LYS HB3  H  -7.194 -0.733  -6.761 1.00 . A A .   9 LYS HB3  1 1 
        6 1499 1 1  8 LYS HD2  H  -4.465  2.135  -8.263 1.00 . A A .   9 LYS HD2  1 1 
        6 1500 1 1  8 LYS HD3  H  -4.025  1.152  -6.865 1.00 . A A .   9 LYS HD3  1 1 
        6 1501 1 1  8 LYS HE2  H  -2.773  0.450  -8.826 1.00 . A A .   9 LYS HE2  1 1 
        6 1502 1 1  8 LYS HE3  H  -3.879 -0.825  -8.312 1.00 . A A .   9 LYS HE3  1 1 
        6 1503 1 1  8 LYS HG2  H  -6.434  0.622  -8.596 1.00 . A A .   9 LYS HG2  1 1 
        6 1504 1 1  8 LYS HG3  H  -6.486  1.593  -7.125 1.00 . A A .   9 LYS HG3  1 1 
        6 1505 1 1  8 LYS HZ1  H  -4.522  1.119 -10.462 1.00 . A A .   9 LYS HZ1  1 1 
        6 1506 1 1  8 LYS HZ2  H  -5.356 -0.310 -10.073 1.00 . A A .   9 LYS HZ2  1 1 
        6 1507 1 1  8 LYS HZ3  H  -3.806 -0.391 -10.760 1.00 . A A .   9 LYS HZ3  1 1 
        6 1508 1 1  8 LYS N    N  -5.737 -1.667  -4.693 1.00 . A A .   9 LYS N    1 1 
        6 1509 1 1  8 LYS NZ   N  -4.416  0.145 -10.101 1.00 . A A .   9 LYS NZ   1 1 
        6 1510 1 1  8 LYS O    O  -6.346  1.885  -4.975 1.00 . A A .   9 LYS O    1 1 
        6 1511 1 1  9 THR C    C  -6.706  2.094  -1.772 1.00 . A A .  10 THR C    1 1 
        6 1512 1 1  9 THR CA   C  -7.672  1.302  -2.652 1.00 . A A .  10 THR CA   1 1 
        6 1513 1 1  9 THR CB   C  -8.723  0.602  -1.770 1.00 . A A .  10 THR CB   1 1 
        6 1514 1 1  9 THR CG2  C  -9.925  0.171  -2.597 1.00 . A A .  10 THR CG2  1 1 
        6 1515 1 1  9 THR H    H  -6.961 -0.605  -3.221 1.00 . A A .  10 THR H    1 1 
        6 1516 1 1  9 THR HA   H  -8.187  1.990  -3.308 1.00 . A A .  10 THR HA   1 1 
        6 1517 1 1  9 THR HB   H  -9.056  1.299  -1.014 1.00 . A A .  10 THR HB   1 1 
        6 1518 1 1  9 THR HG1  H  -8.645 -0.745  -0.325 1.00 . A A .  10 THR HG1  1 1 
        6 1519 1 1  9 THR HG21 H  -9.604 -0.501  -3.379 1.00 . A A .  10 THR HG21 1 1 
        6 1520 1 1  9 THR HG22 H -10.389  1.042  -3.038 1.00 . A A .  10 THR HG22 1 1 
        6 1521 1 1  9 THR HG23 H -10.637 -0.334  -1.962 1.00 . A A .  10 THR HG23 1 1 
        6 1522 1 1  9 THR N    N  -6.964  0.340  -3.479 1.00 . A A .  10 THR N    1 1 
        6 1523 1 1  9 THR O    O  -6.937  3.267  -1.478 1.00 . A A .  10 THR O    1 1 
        6 1524 1 1  9 THR OG1  O  -8.140 -0.542  -1.126 1.00 . A A .  10 THR OG1  1 1 
        6 1525 1 1 10 PHE C    C  -3.197  1.876  -1.213 1.00 . A A .  11 PHE C    1 1 
        6 1526 1 1 10 PHE CA   C  -4.592  2.126  -0.579 1.00 . A A .  11 PHE CA   1 1 
        6 1527 1 1 10 PHE CB   C  -4.602  1.565   0.845 1.00 . A A .  11 PHE CB   1 1 
        6 1528 1 1 10 PHE CD1  C  -4.583  3.165   2.770 1.00 . A A .  11 PHE CD1  1 1 
        6 1529 1 1 10 PHE CD2  C  -2.490  2.485   1.855 1.00 . A A .  11 PHE CD2  1 1 
        6 1530 1 1 10 PHE CE1  C  -3.926  3.952   3.693 1.00 . A A .  11 PHE CE1  1 1 
        6 1531 1 1 10 PHE CE2  C  -1.828  3.273   2.777 1.00 . A A .  11 PHE CE2  1 1 
        6 1532 1 1 10 PHE CG   C  -3.875  2.422   1.842 1.00 . A A .  11 PHE CG   1 1 
        6 1533 1 1 10 PHE CZ   C  -2.547  4.005   3.698 1.00 . A A .  11 PHE CZ   1 1 
        6 1534 1 1 10 PHE H    H  -5.485  0.522  -1.609 1.00 . A A .  11 PHE H    1 1 
        6 1535 1 1 10 PHE HA   H  -4.837  3.176  -0.531 1.00 . A A .  11 PHE HA   1 1 
        6 1536 1 1 10 PHE HB2  H  -5.624  1.466   1.176 1.00 . A A .  11 PHE HB2  1 1 
        6 1537 1 1 10 PHE HB3  H  -4.135  0.589   0.842 1.00 . A A .  11 PHE HB3  1 1 
        6 1538 1 1 10 PHE HD1  H  -5.663  3.124   2.770 1.00 . A A .  11 PHE HD1  1 1 
        6 1539 1 1 10 PHE HD2  H  -1.926  1.914   1.131 1.00 . A A .  11 PHE HD2  1 1 
        6 1540 1 1 10 PHE HE1  H  -4.491  4.526   4.413 1.00 . A A .  11 PHE HE1  1 1 
        6 1541 1 1 10 PHE HE2  H  -0.749  3.315   2.779 1.00 . A A .  11 PHE HE2  1 1 
        6 1542 1 1 10 PHE HZ   H  -2.033  4.620   4.420 1.00 . A A .  11 PHE HZ   1 1 
        6 1543 1 1 10 PHE N    N  -5.612  1.459  -1.368 1.00 . A A .  11 PHE N    1 1 
        6 1544 1 1 10 PHE O    O  -2.726  0.742  -1.165 1.00 . A A .  11 PHE O    1 1 
        6 1545 1 1 11 THR C    C  -0.191  3.583  -1.641 1.00 . A A .  12 THR C    1 1 
        6 1546 1 1 11 THR CA   C  -1.186  2.665  -2.340 1.00 . A A .  12 THR CA   1 1 
        6 1547 1 1 11 THR CB   C  -1.137  2.907  -3.863 1.00 . A A .  12 THR CB   1 1 
        6 1548 1 1 11 THR CG2  C   0.245  2.598  -4.426 1.00 . A A .  12 THR CG2  1 1 
        6 1549 1 1 11 THR H    H  -2.936  3.760  -1.957 1.00 . A A .  12 THR H    1 1 
        6 1550 1 1 11 THR HA   H  -0.913  1.637  -2.147 1.00 . A A .  12 THR HA   1 1 
        6 1551 1 1 11 THR HB   H  -1.364  3.947  -4.054 1.00 . A A .  12 THR HB   1 1 
        6 1552 1 1 11 THR HG1  H  -2.234  1.271  -4.012 1.00 . A A .  12 THR HG1  1 1 
        6 1553 1 1 11 THR HG21 H   0.978  3.229  -3.948 1.00 . A A .  12 THR HG21 1 1 
        6 1554 1 1 11 THR HG22 H   0.249  2.785  -5.490 1.00 . A A .  12 THR HG22 1 1 
        6 1555 1 1 11 THR HG23 H   0.485  1.562  -4.242 1.00 . A A .  12 THR HG23 1 1 
        6 1556 1 1 11 THR N    N  -2.529  2.880  -1.821 1.00 . A A .  12 THR N    1 1 
        6 1557 1 1 11 THR O    O  -0.214  4.802  -1.835 1.00 . A A .  12 THR O    1 1 
        6 1558 1 1 11 THR OG1  O  -2.113  2.087  -4.519 1.00 . A A .  12 THR OG1  1 1 
        6 1559 1 1 12 SER C    C   3.052  3.256  -0.199 1.00 . A A .  13 SER C    1 1 
        6 1560 1 1 12 SER CA   C   1.624  3.791  -0.051 1.00 . A A .  13 SER CA   1 1 
        6 1561 1 1 12 SER CB   C   1.218  3.803   1.426 1.00 . A A .  13 SER CB   1 1 
        6 1562 1 1 12 SER H    H   0.680  2.025  -0.736 1.00 . A A .  13 SER H    1 1 
        6 1563 1 1 12 SER HA   H   1.584  4.802  -0.428 1.00 . A A .  13 SER HA   1 1 
        6 1564 1 1 12 SER HB2  H   1.970  4.323   1.999 1.00 . A A .  13 SER HB2  1 1 
        6 1565 1 1 12 SER HB3  H   0.272  4.313   1.530 1.00 . A A .  13 SER HB3  1 1 
        6 1566 1 1 12 SER HG   H   0.688  1.916   1.276 1.00 . A A .  13 SER HG   1 1 
        6 1567 1 1 12 SER N    N   0.675  3.002  -0.820 1.00 . A A .  13 SER N    1 1 
        6 1568 1 1 12 SER O    O   3.321  2.093   0.113 1.00 . A A .  13 SER O    1 1 
        6 1569 1 1 12 SER OG   O   1.086  2.487   1.941 1.00 . A A .  13 SER OG   1 1 
        6 1570 1 1 13 CYS C    C   6.125  4.587   0.313 1.00 . A A .  14 CYS C    1 1 
        6 1571 1 1 13 CYS CA   C   5.372  3.738  -0.701 1.00 . A A .  14 CYS CA   1 1 
        6 1572 1 1 13 CYS CB   C   5.964  3.923  -2.101 1.00 . A A .  14 CYS CB   1 1 
        6 1573 1 1 13 CYS H    H   3.690  4.970  -1.023 1.00 . A A .  14 CYS H    1 1 
        6 1574 1 1 13 CYS HA   H   5.455  2.698  -0.416 1.00 . A A .  14 CYS HA   1 1 
        6 1575 1 1 13 CYS HB2  H   5.809  4.943  -2.419 1.00 . A A .  14 CYS HB2  1 1 
        6 1576 1 1 13 CYS HB3  H   7.024  3.719  -2.065 1.00 . A A .  14 CYS HB3  1 1 
        6 1577 1 1 13 CYS N    N   3.964  4.095  -0.679 1.00 . A A .  14 CYS N    1 1 
        6 1578 1 1 13 CYS O    O   6.287  5.795   0.133 1.00 . A A .  14 CYS O    1 1 
        6 1579 1 1 13 CYS SG   S   5.232  2.833  -3.365 1.00 . A A .  14 CYS SG   1 1 
        6 1580 1 1 14 LYS C    C   8.325  3.727   3.042 1.00 . A A .  15 LYS C    1 1 
        6 1581 1 1 14 LYS CA   C   7.235  4.624   2.478 1.00 . A A .  15 LYS CA   1 1 
        6 1582 1 1 14 LYS CB   C   6.240  4.979   3.592 1.00 . A A .  15 LYS CB   1 1 
        6 1583 1 1 14 LYS CD   C   6.050  7.440   3.081 1.00 . A A .  15 LYS CD   1 1 
        6 1584 1 1 14 LYS CE   C   5.132  8.645   3.246 1.00 . A A .  15 LYS CE   1 1 
        6 1585 1 1 14 LYS CG   C   5.297  6.131   3.270 1.00 . A A .  15 LYS CG   1 1 
        6 1586 1 1 14 LYS H    H   6.459  2.970   1.428 1.00 . A A .  15 LYS H    1 1 
        6 1587 1 1 14 LYS HA   H   7.682  5.528   2.096 1.00 . A A .  15 LYS HA   1 1 
        6 1588 1 1 14 LYS HB2  H   5.638  4.108   3.805 1.00 . A A .  15 LYS HB2  1 1 
        6 1589 1 1 14 LYS HB3  H   6.796  5.241   4.481 1.00 . A A .  15 LYS HB3  1 1 
        6 1590 1 1 14 LYS HD2  H   6.838  7.499   3.815 1.00 . A A .  15 LYS HD2  1 1 
        6 1591 1 1 14 LYS HD3  H   6.476  7.458   2.089 1.00 . A A .  15 LYS HD3  1 1 
        6 1592 1 1 14 LYS HE2  H   4.733  8.636   4.248 1.00 . A A .  15 LYS HE2  1 1 
        6 1593 1 1 14 LYS HE3  H   5.714  9.544   3.102 1.00 . A A .  15 LYS HE3  1 1 
        6 1594 1 1 14 LYS HG2  H   4.764  5.902   2.357 1.00 . A A .  15 LYS HG2  1 1 
        6 1595 1 1 14 LYS HG3  H   4.593  6.245   4.081 1.00 . A A .  15 LYS HG3  1 1 
        6 1596 1 1 14 LYS HZ1  H   3.497  7.726   2.315 1.00 . A A .  15 LYS HZ1  1 1 
        6 1597 1 1 14 LYS HZ2  H   4.353  8.792   1.306 1.00 . A A .  15 LYS HZ2  1 1 
        6 1598 1 1 14 LYS HZ3  H   3.328  9.397   2.514 1.00 . A A .  15 LYS HZ3  1 1 
        6 1599 1 1 14 LYS N    N   6.568  3.945   1.379 1.00 . A A .  15 LYS N    1 1 
        6 1600 1 1 14 LYS NZ   N   4.002  8.638   2.278 1.00 . A A .  15 LYS NZ   1 1 
        6 1601 1 1 14 LYS O    O   7.981  2.749   3.737 1.00 . A A .  15 LYS O    1 1 
        6 1602 1 1 14 LYS OXT  O   9.514  4.003   2.793 1.00 . A A .  15 LYS OXT  1 1 
        6 1603 2 2  1 .   C1   C   8.607 -2.863   0.685 1.00 . B A . 101 OCA C1   1 1 
        6 1604 2 2  1 .   C2   C   7.996 -2.639   2.062 1.00 . B A . 101 OCA C2   1 1 
        6 1605 2 2  1 .   C3   C   9.035 -2.671   3.174 1.00 . B A . 101 OCA C3   1 1 
        6 1606 2 2  1 .   C4   C   8.435 -3.161   4.484 1.00 . B A . 101 OCA C4   1 1 
        6 1607 2 2  1 .   C5   C   9.394 -4.068   5.242 1.00 . B A . 101 OCA C5   1 1 
        6 1608 2 2  1 .   C6   C   9.473 -5.451   4.616 1.00 . B A . 101 OCA C6   1 1 
        6 1609 2 2  1 .   C7   C   9.673 -6.528   5.667 1.00 . B A . 101 OCA C7   1 1 
        6 1610 2 2  1 .   C8   C   9.740 -7.906   5.048 1.00 . B A . 101 OCA C8   1 1 
        6 1611 2 2  1 .   H21  H   7.506 -1.677   2.071 1.00 . B A . 101 OCA H21  1 1 
        6 1612 2 2  1 .   H22  H   7.267 -3.417   2.245 1.00 . B A . 101 OCA H22  1 1 
        6 1613 2 2  1 .   H31  H   9.424 -1.675   3.320 1.00 . B A . 101 OCA H31  1 1 
        6 1614 2 2  1 .   H32  H   9.837 -3.335   2.886 1.00 . B A . 101 OCA H32  1 1 
        6 1615 2 2  1 .   H41  H   8.202 -2.306   5.100 1.00 . B A . 101 OCA H41  1 1 
        6 1616 2 2  1 .   H42  H   7.531 -3.710   4.269 1.00 . B A . 101 OCA H42  1 1 
        6 1617 2 2  1 .   H51  H  10.379 -3.624   5.236 1.00 . B A . 101 OCA H51  1 1 
        6 1618 2 2  1 .   H52  H   9.049 -4.166   6.261 1.00 . B A . 101 OCA H52  1 1 
        6 1619 2 2  1 .   H61  H   8.553 -5.649   4.085 1.00 . B A . 101 OCA H61  1 1 
        6 1620 2 2  1 .   H62  H  10.303 -5.480   3.927 1.00 . B A . 101 OCA H62  1 1 
        6 1621 2 2  1 .   H71  H   8.846 -6.502   6.360 1.00 . B A . 101 OCA H71  1 1 
        6 1622 2 2  1 .   H72  H  10.599 -6.342   6.193 1.00 . B A . 101 OCA H72  1 1 
        6 1623 2 2  1 .   H81  H  10.658 -8.390   5.347 1.00 . B A . 101 OCA H81  1 1 
        6 1624 2 2  1 .   H82  H   9.712 -7.820   3.971 1.00 . B A . 101 OCA H82  1 1 
        6 1625 2 2  1 .   H83  H   8.898 -8.494   5.384 1.00 . B A . 101 OCA H83  1 1 
        6 1626 2 2  1 .   O1   O   8.786 -3.973   0.186 1.00 . B A . 101 OCA O1   1 1 
        7 1627 1 1  1 PRO C    C   7.555  0.124   0.588 1.00 . A A .   2 PRO C    1 1 
        7 1628 1 1  1 PRO CA   C   8.985 -0.257   0.978 1.00 . A A .   2 PRO CA   1 1 
        7 1629 1 1  1 PRO CB   C   9.929  0.939   0.793 1.00 . A A .   2 PRO CB   1 1 
        7 1630 1 1  1 PRO CD   C  10.186 -0.608  -1.063 1.00 . A A .   2 PRO CD   1 1 
        7 1631 1 1  1 PRO CG   C  10.694  0.684  -0.476 1.00 . A A .   2 PRO CG   1 1 
        7 1632 1 1  1 PRO HA   H   9.008 -0.583   2.007 1.00 . A A .   2 PRO HA   1 1 
        7 1633 1 1  1 PRO HB2  H   9.347  1.848   0.722 1.00 . A A .   2 PRO HB2  1 1 
        7 1634 1 1  1 PRO HB3  H  10.594  1.005   1.642 1.00 . A A .   2 PRO HB3  1 1 
        7 1635 1 1  1 PRO HD2  H   9.465 -0.413  -1.844 1.00 . A A .   2 PRO HD2  1 1 
        7 1636 1 1  1 PRO HD3  H  11.006 -1.200  -1.440 1.00 . A A .   2 PRO HD3  1 1 
        7 1637 1 1  1 PRO HG2  H  10.526  1.494  -1.169 1.00 . A A .   2 PRO HG2  1 1 
        7 1638 1 1  1 PRO HG3  H  11.747  0.600  -0.254 1.00 . A A .   2 PRO HG3  1 1 
        7 1639 1 1  1 PRO N    N   9.553 -1.260   0.082 1.00 . A A .   2 PRO N    1 1 
        7 1640 1 1  1 PRO O    O   6.980  1.071   1.132 1.00 . A A .   2 PRO O    1 1 
        7 1641 1 1  2 CYS C    C   4.690 -1.471  -0.312 1.00 . A A .   3 CYS C    1 1 
        7 1642 1 1  2 CYS CA   C   5.624 -0.369  -0.805 1.00 . A A .   3 CYS CA   1 1 
        7 1643 1 1  2 CYS CB   C   5.575 -0.327  -2.339 1.00 . A A .   3 CYS CB   1 1 
        7 1644 1 1  2 CYS H    H   7.483 -1.371  -0.735 1.00 . A A .   3 CYS H    1 1 
        7 1645 1 1  2 CYS HA   H   5.300  0.580  -0.407 1.00 . A A .   3 CYS HA   1 1 
        7 1646 1 1  2 CYS HB2  H   5.592 -1.338  -2.715 1.00 . A A .   3 CYS HB2  1 1 
        7 1647 1 1  2 CYS HB3  H   4.651  0.143  -2.642 1.00 . A A .   3 CYS HB3  1 1 
        7 1648 1 1  2 CYS N    N   6.979 -0.629  -0.342 1.00 . A A .   3 CYS N    1 1 
        7 1649 1 1  2 CYS O    O   4.887 -2.646  -0.626 1.00 . A A .   3 CYS O    1 1 
        7 1650 1 1  2 CYS SG   S   6.946  0.575  -3.148 1.00 . A A .   3 CYS SG   1 1 
        7 1651 1 1  3 LYS C    C   1.312 -1.641   0.734 1.00 . A A .   4 LYS C    1 1 
        7 1652 1 1  3 LYS CA   C   2.742 -2.082   0.985 1.00 . A A .   4 LYS CA   1 1 
        7 1653 1 1  3 LYS CB   C   2.959 -2.312   2.484 1.00 . A A .   4 LYS CB   1 1 
        7 1654 1 1  3 LYS CD   C   2.453 -4.791   2.381 1.00 . A A .   4 LYS CD   1 1 
        7 1655 1 1  3 LYS CE   C   3.909 -5.184   2.572 1.00 . A A .   4 LYS CE   1 1 
        7 1656 1 1  3 LYS CG   C   2.134 -3.461   3.055 1.00 . A A .   4 LYS CG   1 1 
        7 1657 1 1  3 LYS H    H   3.564 -0.149   0.693 1.00 . A A .   4 LYS H    1 1 
        7 1658 1 1  3 LYS HA   H   2.915 -3.011   0.460 1.00 . A A .   4 LYS HA   1 1 
        7 1659 1 1  3 LYS HB2  H   4.003 -2.521   2.661 1.00 . A A .   4 LYS HB2  1 1 
        7 1660 1 1  3 LYS HB3  H   2.686 -1.410   3.015 1.00 . A A .   4 LYS HB3  1 1 
        7 1661 1 1  3 LYS HD2  H   1.827 -5.558   2.808 1.00 . A A .   4 LYS HD2  1 1 
        7 1662 1 1  3 LYS HD3  H   2.249 -4.704   1.322 1.00 . A A .   4 LYS HD3  1 1 
        7 1663 1 1  3 LYS HE2  H   4.532 -4.472   2.053 1.00 . A A .   4 LYS HE2  1 1 
        7 1664 1 1  3 LYS HE3  H   4.140 -5.160   3.627 1.00 . A A .   4 LYS HE3  1 1 
        7 1665 1 1  3 LYS HG2  H   2.347 -3.548   4.109 1.00 . A A .   4 LYS HG2  1 1 
        7 1666 1 1  3 LYS HG3  H   1.085 -3.239   2.916 1.00 . A A .   4 LYS HG3  1 1 
        7 1667 1 1  3 LYS HZ1  H   5.210 -6.765   2.152 1.00 . A A .   4 LYS HZ1  1 1 
        7 1668 1 1  3 LYS HZ2  H   3.940 -6.613   1.038 1.00 . A A .   4 LYS HZ2  1 1 
        7 1669 1 1  3 LYS HZ3  H   3.645 -7.258   2.580 1.00 . A A .   4 LYS HZ3  1 1 
        7 1670 1 1  3 LYS N    N   3.685 -1.101   0.468 1.00 . A A .   4 LYS N    1 1 
        7 1671 1 1  3 LYS NZ   N   4.194 -6.546   2.046 1.00 . A A .   4 LYS NZ   1 1 
        7 1672 1 1  3 LYS O    O   0.868 -0.612   1.244 1.00 . A A .   4 LYS O    1 1 
        7 1673 1 1  4 ASN C    C  -1.615 -3.270   0.397 1.00 . A A .   5 ASN C    1 1 
        7 1674 1 1  4 ASN CA   C  -0.813 -2.156  -0.278 1.00 . A A .   5 ASN CA   1 1 
        7 1675 1 1  4 ASN CB   C  -1.145 -2.117  -1.772 1.00 . A A .   5 ASN CB   1 1 
        7 1676 1 1  4 ASN CG   C  -0.122 -1.344  -2.588 1.00 . A A .   5 ASN CG   1 1 
        7 1677 1 1  4 ASN H    H   1.030 -3.170  -0.521 1.00 . A A .   5 ASN H    1 1 
        7 1678 1 1  4 ASN HA   H  -1.050 -1.200   0.164 1.00 . A A .   5 ASN HA   1 1 
        7 1679 1 1  4 ASN HB2  H  -1.186 -3.123  -2.147 1.00 . A A .   5 ASN HB2  1 1 
        7 1680 1 1  4 ASN HB3  H  -2.110 -1.651  -1.905 1.00 . A A .   5 ASN HB3  1 1 
        7 1681 1 1  4 ASN HD21 H   0.842 -3.024  -3.020 1.00 . A A .   5 ASN HD21 1 1 
        7 1682 1 1  4 ASN HD22 H   1.512 -1.580  -3.687 1.00 . A A .   5 ASN HD22 1 1 
        7 1683 1 1  4 ASN N    N   0.598 -2.410  -0.066 1.00 . A A .   5 ASN N    1 1 
        7 1684 1 1  4 ASN ND2  N   0.841 -2.052  -3.156 1.00 . A A .   5 ASN ND2  1 1 
        7 1685 1 1  4 ASN O    O  -1.579 -4.414  -0.059 1.00 . A A .   5 ASN O    1 1 
        7 1686 1 1  4 ASN OD1  O  -0.200 -0.126  -2.718 1.00 . A A .   5 ASN OD1  1 1 
        7 1687 1 1  5 .   C    C  -4.271 -4.456   1.474 1.00 . A A .   6 O6H C    1 1 
        7 1688 1 1  5 .   CA   C  -3.051 -3.965   2.240 1.00 . A A .   6 O6H CA   1 1 
        7 1689 1 1  5 .   CB   C  -3.475 -3.430   3.613 1.00 . A A .   6 O6H CB   1 1 
        7 1690 1 1  5 .   CD1  C  -1.510 -3.754   5.172 1.00 . A A .   6 O6H CD1  1 1 
        7 1691 1 1  5 .   CD2  C  -2.063 -1.539   4.487 1.00 . A A .   6 O6H CD2  1 1 
        7 1692 1 1  5 .   CE1  C  -0.459 -3.260   5.925 1.00 . A A .   6 O6H CE1  1 1 
        7 1693 1 1  5 .   CE2  C  -1.020 -1.035   5.234 1.00 . A A .   6 O6H CE2  1 1 
        7 1694 1 1  5 .   CF1  C  -1.763 -5.234   5.154 1.00 . A A .   6 O6H CF1  1 1 
        7 1695 1 1  5 .   CF2  C  -2.920 -0.590   3.712 1.00 . A A .   6 O6H CF2  1 1 
        7 1696 1 1  5 .   CG   C  -2.331 -2.901   4.439 1.00 . A A .   6 O6H CG   1 1 
        7 1697 1 1  5 .   CH   C   0.915 -1.352   6.759 1.00 . A A .   6 O6H CH   1 1 
        7 1698 1 1  5 .   CZ   C  -0.222 -1.899   5.949 1.00 . A A .   6 O6H CZ   1 1 
        7 1699 1 1  5 .   H1   H  -2.325 -2.032   1.810 1.00 . A A .   6 O6H H1   1 1 
        7 1700 1 1  5 .   HA   H  -2.387 -4.803   2.393 1.00 . A A .   6 O6H HA   1 1 
        7 1701 1 1  5 .   HB1  H  -3.948 -4.225   4.170 1.00 . A A .   6 O6H HB1  1 1 
        7 1702 1 1  5 .   HB2  H  -4.183 -2.626   3.473 1.00 . A A .   6 O6H HB2  1 1 
        7 1703 1 1  5 .   HE1  H   0.171 -3.933   6.488 1.00 . A A .   6 O6H HE1  1 1 
        7 1704 1 1  5 .   HE2  H  -0.831  0.029   5.256 1.00 . A A .   6 O6H HE2  1 1 
        7 1705 1 1  5 .   HF11 H  -1.089 -5.791   5.787 1.00 . A A .   6 O6H HF11 1 1 
        7 1706 1 1  5 .   HF12 H  -1.663 -5.674   4.173 1.00 . A A .   6 O6H HF12 1 1 
        7 1707 1 1  5 .   HF13 H  -2.755 -5.504   5.487 1.00 . A A .   6 O6H HF13 1 1 
        7 1708 1 1  5 .   HF21 H  -3.237  0.269   4.284 1.00 . A A .   6 O6H HF21 1 1 
        7 1709 1 1  5 .   HF22 H  -3.831 -1.038   3.342 1.00 . A A .   6 O6H HF22 1 1 
        7 1710 1 1  5 .   HF23 H  -2.428 -0.186   2.840 1.00 . A A .   6 O6H HF23 1 1 
        7 1711 1 1  5 .   HH1  H   0.989 -0.274   6.718 1.00 . A A .   6 O6H HH1  1 1 
        7 1712 1 1  5 .   HH2  H   0.850 -1.593   7.810 1.00 . A A .   6 O6H HH2  1 1 
        7 1713 1 1  5 .   HH3  H   1.881 -1.716   6.442 1.00 . A A .   6 O6H HH3  1 1 
        7 1714 1 1  5 .   N    N  -2.310 -2.958   1.491 1.00 . A A .   6 O6H N    1 1 
        7 1715 1 1  5 .   O    O  -4.605 -5.639   1.514 1.00 . A A .   6 O6H O    1 1 
        7 1716 1 1  6 PHE C    C  -6.172 -3.880  -1.309 1.00 . A A .   7 PHE C    1 1 
        7 1717 1 1  6 PHE CA   C  -6.251 -3.843   0.211 1.00 . A A .   7 PHE CA   1 1 
        7 1718 1 1  6 PHE CB   C  -7.300 -2.822   0.662 1.00 . A A .   7 PHE CB   1 1 
        7 1719 1 1  6 PHE CD1  C  -7.465 -3.460   3.092 1.00 . A A .   7 PHE CD1  1 1 
        7 1720 1 1  6 PHE CD2  C  -6.860 -1.219   2.542 1.00 . A A .   7 PHE CD2  1 1 
        7 1721 1 1  6 PHE CE1  C  -7.363 -3.158   4.438 1.00 . A A .   7 PHE CE1  1 1 
        7 1722 1 1  6 PHE CE2  C  -6.761 -0.912   3.885 1.00 . A A .   7 PHE CE2  1 1 
        7 1723 1 1  6 PHE CG   C  -7.213 -2.494   2.129 1.00 . A A .   7 PHE CG   1 1 
        7 1724 1 1  6 PHE CZ   C  -7.011 -1.883   4.835 1.00 . A A .   7 PHE CZ   1 1 
        7 1725 1 1  6 PHE H    H  -4.588 -2.634   0.719 1.00 . A A .   7 PHE H    1 1 
        7 1726 1 1  6 PHE HA   H  -6.547 -4.822   0.563 1.00 . A A .   7 PHE HA   1 1 
        7 1727 1 1  6 PHE HB2  H  -7.165 -1.907   0.106 1.00 . A A .   7 PHE HB2  1 1 
        7 1728 1 1  6 PHE HB3  H  -8.285 -3.218   0.466 1.00 . A A .   7 PHE HB3  1 1 
        7 1729 1 1  6 PHE HD1  H  -7.741 -4.458   2.783 1.00 . A A .   7 PHE HD1  1 1 
        7 1730 1 1  6 PHE HD2  H  -6.664 -0.457   1.802 1.00 . A A .   7 PHE HD2  1 1 
        7 1731 1 1  6 PHE HE1  H  -7.562 -3.919   5.179 1.00 . A A .   7 PHE HE1  1 1 
        7 1732 1 1  6 PHE HE2  H  -6.489  0.087   4.192 1.00 . A A .   7 PHE HE2  1 1 
        7 1733 1 1  6 PHE HZ   H  -6.924 -1.647   5.885 1.00 . A A .   7 PHE HZ   1 1 
        7 1734 1 1  6 PHE N    N  -4.955 -3.536   0.806 1.00 . A A .   7 PHE N    1 1 
        7 1735 1 1  6 PHE O    O  -7.047 -4.435  -1.971 1.00 . A A .   7 PHE O    1 1 
        7 1736 1 1  7 DTR C    C  -4.788 -1.840  -3.846 1.00 . A A .   8 DTR C    1 1 
        7 1737 1 1  7 DTR CA   C  -4.959 -3.262  -3.304 1.00 . A A .   8 DTR CA   1 1 
        7 1738 1 1  7 DTR CB   C  -3.755 -4.128  -3.689 1.00 . A A .   8 DTR CB   1 1 
        7 1739 1 1  7 DTR CD1  C  -2.713 -3.862  -6.018 1.00 . A A .   8 DTR CD1  1 1 
        7 1740 1 1  7 DTR CD2  C  -4.528 -5.169  -5.965 1.00 . A A .   8 DTR CD2  1 1 
        7 1741 1 1  7 DTR CE2  C  -4.060 -5.109  -7.291 1.00 . A A .   8 DTR CE2  1 1 
        7 1742 1 1  7 DTR CE3  C  -5.664 -5.935  -5.688 1.00 . A A .   8 DTR CE3  1 1 
        7 1743 1 1  7 DTR CG   C  -3.650 -4.369  -5.166 1.00 . A A .   8 DTR CG   1 1 
        7 1744 1 1  7 DTR CH2  C  -5.797 -6.526  -8.033 1.00 . A A .   8 DTR CH2  1 1 
        7 1745 1 1  7 DTR CZ2  C  -4.688 -5.785  -8.334 1.00 . A A .   8 DTR CZ2  1 1 
        7 1746 1 1  7 DTR CZ3  C  -6.287 -6.604  -6.724 1.00 . A A .   8 DTR CZ3  1 1 
        7 1747 1 1  7 DTR H    H  -4.497 -2.794  -1.299 1.00 . A A .   8 DTR H    1 1 
        7 1748 1 1  7 DTR HA   H  -5.824 -3.738  -3.749 1.00 . A A .   8 DTR HA   1 1 
        7 1749 1 1  7 DTR HB2  H  -2.850 -3.637  -3.366 1.00 . A A .   8 DTR HB2  1 1 
        7 1750 1 1  7 DTR HB3  H  -3.836 -5.087  -3.196 1.00 . A A .   8 DTR HB3  1 1 
        7 1751 1 1  7 DTR HD1  H  -1.906 -3.210  -5.717 1.00 . A A .   8 DTR HD1  1 1 
        7 1752 1 1  7 DTR HE1  H  -2.409 -4.088  -8.089 1.00 . A A .   8 DTR HE1  1 1 
        7 1753 1 1  7 DTR HE3  H  -6.056 -6.006  -4.685 1.00 . A A .   8 DTR HE3  1 1 
        7 1754 1 1  7 DTR HH2  H  -6.316 -7.066  -8.813 1.00 . A A .   8 DTR HH2  1 1 
        7 1755 1 1  7 DTR HZ2  H  -4.322 -5.735  -9.349 1.00 . A A .   8 DTR HZ2  1 1 
        7 1756 1 1  7 DTR HZ3  H  -7.165 -7.199  -6.527 1.00 . A A .   8 DTR HZ3  1 1 
        7 1757 1 1  7 DTR N    N  -5.144 -3.258  -1.865 1.00 . A A .   8 DTR N    1 1 
        7 1758 1 1  7 DTR NE1  N  -2.950 -4.307  -7.297 1.00 . A A .   8 DTR NE1  1 1 
        7 1759 1 1  7 DTR O    O  -3.965 -1.082  -3.340 1.00 . A A .   8 DTR O    1 1 
        7 1760 1 1  8 LYS C    C  -6.282  0.885  -4.833 1.00 . A A .   9 LYS C    1 1 
        7 1761 1 1  8 LYS CA   C  -5.413 -0.169  -5.506 1.00 . A A .   9 LYS CA   1 1 
        7 1762 1 1  8 LYS CB   C  -5.754 -0.273  -6.994 1.00 . A A .   9 LYS CB   1 1 
        7 1763 1 1  8 LYS CD   C  -7.319 -1.149  -8.757 1.00 . A A .   9 LYS CD   1 1 
        7 1764 1 1  8 LYS CE   C  -6.273 -2.127  -9.275 1.00 . A A .   9 LYS CE   1 1 
        7 1765 1 1  8 LYS CG   C  -7.127 -0.867  -7.275 1.00 . A A .   9 LYS CG   1 1 
        7 1766 1 1  8 LYS H    H  -6.259 -2.075  -5.198 1.00 . A A .   9 LYS H    1 1 
        7 1767 1 1  8 LYS HA   H  -4.378  0.123  -5.407 1.00 . A A .   9 LYS HA   1 1 
        7 1768 1 1  8 LYS HB2  H  -5.719  0.715  -7.428 1.00 . A A .   9 LYS HB2  1 1 
        7 1769 1 1  8 LYS HB3  H  -5.013 -0.893  -7.477 1.00 . A A .   9 LYS HB3  1 1 
        7 1770 1 1  8 LYS HD2  H  -8.301 -1.572  -8.908 1.00 . A A .   9 LYS HD2  1 1 
        7 1771 1 1  8 LYS HD3  H  -7.236 -0.222  -9.306 1.00 . A A .   9 LYS HD3  1 1 
        7 1772 1 1  8 LYS HE2  H  -5.293 -1.710  -9.100 1.00 . A A .   9 LYS HE2  1 1 
        7 1773 1 1  8 LYS HE3  H  -6.369 -3.055  -8.729 1.00 . A A .   9 LYS HE3  1 1 
        7 1774 1 1  8 LYS HG2  H  -7.230 -1.790  -6.727 1.00 . A A .   9 LYS HG2  1 1 
        7 1775 1 1  8 LYS HG3  H  -7.882 -0.165  -6.951 1.00 . A A .   9 LYS HG3  1 1 
        7 1776 1 1  8 LYS HZ1  H  -5.585 -2.920 -11.079 1.00 . A A .   9 LYS HZ1  1 1 
        7 1777 1 1  8 LYS HZ2  H  -6.509 -1.508 -11.257 1.00 . A A .   9 LYS HZ2  1 1 
        7 1778 1 1  8 LYS HZ3  H  -7.271 -2.982 -10.902 1.00 . A A .   9 LYS HZ3  1 1 
        7 1779 1 1  8 LYS N    N  -5.569 -1.469  -4.865 1.00 . A A .   9 LYS N    1 1 
        7 1780 1 1  8 LYS NZ   N  -6.421 -2.402 -10.728 1.00 . A A .   9 LYS NZ   1 1 
        7 1781 1 1  8 LYS O    O  -6.283  2.049  -5.228 1.00 . A A .   9 LYS O    1 1 
        7 1782 1 1  9 THR C    C  -6.988  2.165  -2.024 1.00 . A A .  10 THR C    1 1 
        7 1783 1 1  9 THR CA   C  -7.834  1.393  -3.038 1.00 . A A .  10 THR CA   1 1 
        7 1784 1 1  9 THR CB   C  -8.956  0.633  -2.307 1.00 . A A .  10 THR CB   1 1 
        7 1785 1 1  9 THR CG2  C -10.119  0.345  -3.247 1.00 . A A .  10 THR CG2  1 1 
        7 1786 1 1  9 THR H    H  -7.021 -0.481  -3.578 1.00 . A A .  10 THR H    1 1 
        7 1787 1 1  9 THR HA   H  -8.291  2.093  -3.724 1.00 . A A .  10 THR HA   1 1 
        7 1788 1 1  9 THR HB   H  -9.314  1.245  -1.491 1.00 . A A .  10 THR HB   1 1 
        7 1789 1 1  9 THR HG1  H  -9.152 -1.081  -1.344 1.00 . A A .  10 THR HG1  1 1 
        7 1790 1 1  9 THR HG21 H  -9.772 -0.250  -4.078 1.00 . A A .  10 THR HG21 1 1 
        7 1791 1 1  9 THR HG22 H -10.523  1.278  -3.614 1.00 . A A .  10 THR HG22 1 1 
        7 1792 1 1  9 THR HG23 H -10.888 -0.194  -2.712 1.00 . A A .  10 THR HG23 1 1 
        7 1793 1 1  9 THR N    N  -7.014  0.472  -3.808 1.00 . A A .  10 THR N    1 1 
        7 1794 1 1  9 THR O    O  -7.191  3.361  -1.816 1.00 . A A .  10 THR O    1 1 
        7 1795 1 1  9 THR OG1  O  -8.440 -0.599  -1.777 1.00 . A A .  10 THR OG1  1 1 
        7 1796 1 1 10 PHE C    C  -3.663  1.809  -0.893 1.00 . A A .  11 PHE C    1 1 
        7 1797 1 1 10 PHE CA   C  -5.126  2.093  -0.457 1.00 . A A .  11 PHE CA   1 1 
        7 1798 1 1 10 PHE CB   C  -5.373  1.483   0.928 1.00 . A A .  11 PHE CB   1 1 
        7 1799 1 1 10 PHE CD1  C  -3.346  2.413   2.095 1.00 . A A .  11 PHE CD1  1 1 
        7 1800 1 1 10 PHE CD2  C  -5.480  2.711   3.115 1.00 . A A .  11 PHE CD2  1 1 
        7 1801 1 1 10 PHE CE1  C  -2.747  3.073   3.146 1.00 . A A .  11 PHE CE1  1 1 
        7 1802 1 1 10 PHE CE2  C  -4.884  3.376   4.169 1.00 . A A .  11 PHE CE2  1 1 
        7 1803 1 1 10 PHE CG   C  -4.718  2.222   2.065 1.00 . A A .  11 PHE CG   1 1 
        7 1804 1 1 10 PHE CZ   C  -3.515  3.556   4.183 1.00 . A A .  11 PHE CZ   1 1 
        7 1805 1 1 10 PHE H    H  -5.912  0.533  -1.630 1.00 . A A .  11 PHE H    1 1 
        7 1806 1 1 10 PHE HA   H  -5.349  3.147  -0.415 1.00 . A A .  11 PHE HA   1 1 
        7 1807 1 1 10 PHE HB2  H  -6.436  1.464   1.117 1.00 . A A .  11 PHE HB2  1 1 
        7 1808 1 1 10 PHE HB3  H  -4.999  0.469   0.933 1.00 . A A .  11 PHE HB3  1 1 
        7 1809 1 1 10 PHE HD1  H  -2.743  2.040   1.279 1.00 . A A .  11 PHE HD1  1 1 
        7 1810 1 1 10 PHE HD2  H  -6.551  2.570   3.104 1.00 . A A .  11 PHE HD2  1 1 
        7 1811 1 1 10 PHE HE1  H  -1.677  3.212   3.155 1.00 . A A .  11 PHE HE1  1 1 
        7 1812 1 1 10 PHE HE2  H  -5.487  3.753   4.981 1.00 . A A .  11 PHE HE2  1 1 
        7 1813 1 1 10 PHE HZ   H  -3.044  4.071   5.006 1.00 . A A .  11 PHE HZ   1 1 
        7 1814 1 1 10 PHE N    N  -6.027  1.480  -1.419 1.00 . A A .  11 PHE N    1 1 
        7 1815 1 1 10 PHE O    O  -3.250  0.649  -0.836 1.00 . A A .  11 PHE O    1 1 
        7 1816 1 1 11 THR C    C  -0.506  3.419  -1.075 1.00 . A A .  12 THR C    1 1 
        7 1817 1 1 11 THR CA   C  -1.519  2.516  -1.787 1.00 . A A .  12 THR CA   1 1 
        7 1818 1 1 11 THR CB   C  -1.394  2.655  -3.327 1.00 . A A .  12 THR CB   1 1 
        7 1819 1 1 11 THR CG2  C  -1.785  4.049  -3.805 1.00 . A A .  12 THR CG2  1 1 
        7 1820 1 1 11 THR H    H  -3.173  3.740  -1.359 1.00 . A A .  12 THR H    1 1 
        7 1821 1 1 11 THR HA   H  -1.303  1.490  -1.525 1.00 . A A .  12 THR HA   1 1 
        7 1822 1 1 11 THR HB   H  -2.062  1.938  -3.784 1.00 . A A .  12 THR HB   1 1 
        7 1823 1 1 11 THR HG1  H   0.162  1.450  -3.468 1.00 . A A .  12 THR HG1  1 1 
        7 1824 1 1 11 THR HG21 H  -1.139  4.783  -3.346 1.00 . A A .  12 THR HG21 1 1 
        7 1825 1 1 11 THR HG22 H  -2.810  4.248  -3.529 1.00 . A A .  12 THR HG22 1 1 
        7 1826 1 1 11 THR HG23 H  -1.685  4.101  -4.879 1.00 . A A .  12 THR HG23 1 1 
        7 1827 1 1 11 THR N    N  -2.870  2.805  -1.339 1.00 . A A .  12 THR N    1 1 
        7 1828 1 1 11 THR O    O  -0.555  4.650  -1.183 1.00 . A A .  12 THR O    1 1 
        7 1829 1 1 11 THR OG1  O  -0.055  2.355  -3.743 1.00 . A A .  12 THR OG1  1 1 
        7 1830 1 1 12 SER C    C   2.799  2.957   0.193 1.00 . A A .  13 SER C    1 1 
        7 1831 1 1 12 SER CA   C   1.406  3.553   0.415 1.00 . A A .  13 SER CA   1 1 
        7 1832 1 1 12 SER CB   C   1.083  3.589   1.907 1.00 . A A .  13 SER CB   1 1 
        7 1833 1 1 12 SER H    H   0.355  1.829  -0.217 1.00 . A A .  13 SER H    1 1 
        7 1834 1 1 12 SER HA   H   1.387  4.565   0.038 1.00 . A A .  13 SER HA   1 1 
        7 1835 1 1 12 SER HB2  H   0.986  2.579   2.278 1.00 . A A .  13 SER HB2  1 1 
        7 1836 1 1 12 SER HB3  H   1.880  4.092   2.436 1.00 . A A .  13 SER HB3  1 1 
        7 1837 1 1 12 SER HG   H  -0.692  4.199   1.356 1.00 . A A .  13 SER HG   1 1 
        7 1838 1 1 12 SER N    N   0.383  2.807  -0.303 1.00 . A A .  13 SER N    1 1 
        7 1839 1 1 12 SER O    O   3.054  1.803   0.544 1.00 . A A .  13 SER O    1 1 
        7 1840 1 1 12 SER OG   O  -0.130  4.282   2.135 1.00 . A A .  13 SER OG   1 1 
        7 1841 1 1 13 CYS C    C   5.956  4.511  -0.065 1.00 . A A .  14 CYS C    1 1 
        7 1842 1 1 13 CYS CA   C   5.083  3.351  -0.522 1.00 . A A .  14 CYS CA   1 1 
        7 1843 1 1 13 CYS CB   C   5.441  2.947  -1.952 1.00 . A A .  14 CYS CB   1 1 
        7 1844 1 1 13 CYS H    H   3.406  4.586  -0.809 1.00 . A A .  14 CYS H    1 1 
        7 1845 1 1 13 CYS HA   H   5.249  2.510   0.136 1.00 . A A .  14 CYS HA   1 1 
        7 1846 1 1 13 CYS HB2  H   4.765  2.171  -2.282 1.00 . A A .  14 CYS HB2  1 1 
        7 1847 1 1 13 CYS HB3  H   5.343  3.807  -2.600 1.00 . A A .  14 CYS HB3  1 1 
        7 1848 1 1 13 CYS N    N   3.690  3.731  -0.417 1.00 . A A .  14 CYS N    1 1 
        7 1849 1 1 13 CYS O    O   5.888  5.606  -0.630 1.00 . A A .  14 CYS O    1 1 
        7 1850 1 1 13 CYS SG   S   7.140  2.313  -2.117 1.00 . A A .  14 CYS SG   1 1 
        7 1851 1 1 14 LYS C    C   9.005  5.232   1.019 1.00 . A A .  15 LYS C    1 1 
        7 1852 1 1 14 LYS CA   C   7.577  5.322   1.542 1.00 . A A .  15 LYS CA   1 1 
        7 1853 1 1 14 LYS CB   C   7.573  5.214   3.067 1.00 . A A .  15 LYS CB   1 1 
        7 1854 1 1 14 LYS CD   C   8.799  5.890   5.157 1.00 . A A .  15 LYS CD   1 1 
        7 1855 1 1 14 LYS CE   C   9.634  4.617   5.130 1.00 . A A .  15 LYS CE   1 1 
        7 1856 1 1 14 LYS CG   C   8.375  6.306   3.758 1.00 . A A .  15 LYS CG   1 1 
        7 1857 1 1 14 LYS H    H   6.807  3.370   1.332 1.00 . A A .  15 LYS H    1 1 
        7 1858 1 1 14 LYS HA   H   7.158  6.276   1.255 1.00 . A A .  15 LYS HA   1 1 
        7 1859 1 1 14 LYS HB2  H   6.553  5.269   3.418 1.00 . A A .  15 LYS HB2  1 1 
        7 1860 1 1 14 LYS HB3  H   7.991  4.258   3.349 1.00 . A A .  15 LYS HB3  1 1 
        7 1861 1 1 14 LYS HD2  H   9.385  6.683   5.596 1.00 . A A .  15 LYS HD2  1 1 
        7 1862 1 1 14 LYS HD3  H   7.916  5.718   5.753 1.00 . A A .  15 LYS HD3  1 1 
        7 1863 1 1 14 LYS HE2  H  10.034  4.447   6.118 1.00 . A A .  15 LYS HE2  1 1 
        7 1864 1 1 14 LYS HE3  H   8.996  3.789   4.853 1.00 . A A .  15 LYS HE3  1 1 
        7 1865 1 1 14 LYS HG2  H   9.259  6.517   3.173 1.00 . A A .  15 LYS HG2  1 1 
        7 1866 1 1 14 LYS HG3  H   7.767  7.196   3.825 1.00 . A A .  15 LYS HG3  1 1 
        7 1867 1 1 14 LYS HZ1  H  11.395  3.886   4.275 1.00 . A A .  15 LYS HZ1  1 1 
        7 1868 1 1 14 LYS HZ2  H  11.308  5.579   4.318 1.00 . A A .  15 LYS HZ2  1 1 
        7 1869 1 1 14 LYS HZ3  H  10.395  4.708   3.181 1.00 . A A .  15 LYS HZ3  1 1 
        7 1870 1 1 14 LYS N    N   6.754  4.275   0.962 1.00 . A A .  15 LYS N    1 1 
        7 1871 1 1 14 LYS NZ   N  10.762  4.705   4.161 1.00 . A A .  15 LYS NZ   1 1 
        7 1872 1 1 14 LYS O    O   9.821  4.513   1.637 1.00 . A A .  15 LYS O    1 1 
        7 1873 1 1 14 LYS OXT  O   9.309  5.879  -0.003 1.00 . A A .  15 LYS OXT  1 1 
        7 1874 2 2  1 .   C1   C   9.528 -2.594   0.305 1.00 . B A . 101 OCA C1   1 1 
        7 1875 2 2  1 .   C2   C   8.926 -2.906   1.669 1.00 . B A . 101 OCA C2   1 1 
        7 1876 2 2  1 .   C3   C   9.972 -2.962   2.774 1.00 . B A . 101 OCA C3   1 1 
        7 1877 2 2  1 .   C4   C   9.341 -3.131   4.148 1.00 . B A . 101 OCA C4   1 1 
        7 1878 2 2  1 .   C5   C   8.441 -4.356   4.219 1.00 . B A . 101 OCA C5   1 1 
        7 1879 2 2  1 .   C6   C   7.052 -3.997   4.728 1.00 . B A . 101 OCA C6   1 1 
        7 1880 2 2  1 .   C7   C   6.450 -5.112   5.570 1.00 . B A . 101 OCA C7   1 1 
        7 1881 2 2  1 .   C8   C   7.253 -5.373   6.827 1.00 . B A . 101 OCA C8   1 1 
        7 1882 2 2  1 .   H21  H   8.204 -2.139   1.910 1.00 . B A . 101 OCA H21  1 1 
        7 1883 2 2  1 .   H22  H   8.427 -3.863   1.614 1.00 . B A . 101 OCA H22  1 1 
        7 1884 2 2  1 .   H31  H  10.630 -3.798   2.589 1.00 . B A . 101 OCA H31  1 1 
        7 1885 2 2  1 .   H32  H  10.540 -2.045   2.762 1.00 . B A . 101 OCA H32  1 1 
        7 1886 2 2  1 .   H41  H  10.127 -3.232   4.883 1.00 . B A . 101 OCA H41  1 1 
        7 1887 2 2  1 .   H42  H   8.752 -2.254   4.370 1.00 . B A . 101 OCA H42  1 1 
        7 1888 2 2  1 .   H51  H   8.354 -4.783   3.231 1.00 . B A . 101 OCA H51  1 1 
        7 1889 2 2  1 .   H52  H   8.885 -5.079   4.888 1.00 . B A . 101 OCA H52  1 1 
        7 1890 2 2  1 .   H61  H   7.121 -3.104   5.330 1.00 . B A . 101 OCA H61  1 1 
        7 1891 2 2  1 .   H62  H   6.407 -3.813   3.881 1.00 . B A . 101 OCA H62  1 1 
        7 1892 2 2  1 .   H71  H   6.422 -6.020   4.985 1.00 . B A . 101 OCA H71  1 1 
        7 1893 2 2  1 .   H72  H   5.447 -4.833   5.859 1.00 . B A . 101 OCA H72  1 1 
        7 1894 2 2  1 .   H81  H   7.318 -6.438   7.000 1.00 . B A . 101 OCA H81  1 1 
        7 1895 2 2  1 .   H82  H   6.769 -4.901   7.669 1.00 . B A . 101 OCA H82  1 1 
        7 1896 2 2  1 .   H83  H   8.247 -4.967   6.710 1.00 . B A . 101 OCA H83  1 1 
        7 1897 2 2  1 .   O1   O   9.966 -3.449  -0.466 1.00 . B A . 101 OCA O1   1 1 
        8 1898 1 1  1 PRO C    C   7.245 -0.219   0.939 1.00 . A A .   2 PRO C    1 1 
        8 1899 1 1  1 PRO CA   C   8.539 -0.998   1.171 1.00 . A A .   2 PRO CA   1 1 
        8 1900 1 1  1 PRO CB   C   9.753 -0.122   0.883 1.00 . A A .   2 PRO CB   1 1 
        8 1901 1 1  1 PRO CD   C   9.660 -1.800  -0.838 1.00 . A A .   2 PRO CD   1 1 
        8 1902 1 1  1 PRO CG   C  10.076 -0.381  -0.549 1.00 . A A .   2 PRO CG   1 1 
        8 1903 1 1  1 PRO HA   H   8.571 -1.334   2.196 1.00 . A A .   2 PRO HA   1 1 
        8 1904 1 1  1 PRO HB2  H   9.498  0.914   1.052 1.00 . A A .   2 PRO HB2  1 1 
        8 1905 1 1  1 PRO HB3  H  10.569 -0.408   1.528 1.00 . A A .   2 PRO HB3  1 1 
        8 1906 1 1  1 PRO HD2  H   9.188 -1.864  -1.806 1.00 . A A .   2 PRO HD2  1 1 
        8 1907 1 1  1 PRO HD3  H  10.518 -2.458  -0.794 1.00 . A A .   2 PRO HD3  1 1 
        8 1908 1 1  1 PRO HG2  H   9.524  0.303  -1.177 1.00 . A A .   2 PRO HG2  1 1 
        8 1909 1 1  1 PRO HG3  H  11.137 -0.264  -0.711 1.00 . A A .   2 PRO HG3  1 1 
        8 1910 1 1  1 PRO N    N   8.699 -2.120   0.234 1.00 . A A .   2 PRO N    1 1 
        8 1911 1 1  1 PRO O    O   6.899  0.677   1.709 1.00 . A A .   2 PRO O    1 1 
        8 1912 1 1  2 CYS C    C   4.226 -1.164  -0.250 1.00 . A A .   3 CYS C    1 1 
        8 1913 1 1  2 CYS CA   C   5.222 -0.021  -0.377 1.00 . A A .   3 CYS CA   1 1 
        8 1914 1 1  2 CYS CB   C   5.112  0.630  -1.761 1.00 . A A .   3 CYS CB   1 1 
        8 1915 1 1  2 CYS H    H   6.959 -1.146  -0.811 1.00 . A A .   3 CYS H    1 1 
        8 1916 1 1  2 CYS HA   H   5.014  0.717   0.383 1.00 . A A .   3 CYS HA   1 1 
        8 1917 1 1  2 CYS HB2  H   5.856  1.409  -1.846 1.00 . A A .   3 CYS HB2  1 1 
        8 1918 1 1  2 CYS HB3  H   5.295 -0.119  -2.517 1.00 . A A .   3 CYS HB3  1 1 
        8 1919 1 1  2 CYS N    N   6.557 -0.541  -0.144 1.00 . A A .   3 CYS N    1 1 
        8 1920 1 1  2 CYS O    O   4.220 -2.081  -1.068 1.00 . A A .   3 CYS O    1 1 
        8 1921 1 1  2 CYS SG   S   3.486  1.381  -2.100 1.00 . A A .   3 CYS SG   1 1 
        8 1922 1 1  3 LYS C    C   1.069 -1.854   0.832 1.00 . A A .   4 LYS C    1 1 
        8 1923 1 1  3 LYS CA   C   2.515 -2.238   1.090 1.00 . A A .   4 LYS CA   1 1 
        8 1924 1 1  3 LYS CB   C   2.699 -2.689   2.547 1.00 . A A .   4 LYS CB   1 1 
        8 1925 1 1  3 LYS CD   C   1.803 -5.007   2.049 1.00 . A A .   4 LYS CD   1 1 
        8 1926 1 1  3 LYS CE   C   3.197 -5.611   1.950 1.00 . A A .   4 LYS CE   1 1 
        8 1927 1 1  3 LYS CG   C   1.757 -3.807   2.987 1.00 . A A .   4 LYS CG   1 1 
        8 1928 1 1  3 LYS H    H   3.396 -0.335   1.371 1.00 . A A .   4 LYS H    1 1 
        8 1929 1 1  3 LYS HA   H   2.776 -3.056   0.437 1.00 . A A .   4 LYS HA   1 1 
        8 1930 1 1  3 LYS HB2  H   3.714 -3.036   2.677 1.00 . A A .   4 LYS HB2  1 1 
        8 1931 1 1  3 LYS HB3  H   2.539 -1.840   3.194 1.00 . A A .   4 LYS HB3  1 1 
        8 1932 1 1  3 LYS HD2  H   1.124 -5.762   2.414 1.00 . A A .   4 LYS HD2  1 1 
        8 1933 1 1  3 LYS HD3  H   1.490 -4.689   1.064 1.00 . A A .   4 LYS HD3  1 1 
        8 1934 1 1  3 LYS HE2  H   3.889 -4.843   1.633 1.00 . A A .   4 LYS HE2  1 1 
        8 1935 1 1  3 LYS HE3  H   3.489 -5.978   2.923 1.00 . A A .   4 LYS HE3  1 1 
        8 1936 1 1  3 LYS HG2  H   2.040 -4.132   3.978 1.00 . A A .   4 LYS HG2  1 1 
        8 1937 1 1  3 LYS HG3  H   0.747 -3.421   3.010 1.00 . A A .   4 LYS HG3  1 1 
        8 1938 1 1  3 LYS HZ1  H   2.689 -7.543   1.331 1.00 . A A .   4 LYS HZ1  1 1 
        8 1939 1 1  3 LYS HZ2  H   4.226 -7.040   0.826 1.00 . A A .   4 LYS HZ2  1 1 
        8 1940 1 1  3 LYS HZ3  H   2.847 -6.434   0.058 1.00 . A A .   4 LYS HZ3  1 1 
        8 1941 1 1  3 LYS N    N   3.411 -1.129   0.795 1.00 . A A .   4 LYS N    1 1 
        8 1942 1 1  3 LYS NZ   N   3.245 -6.733   0.975 1.00 . A A .   4 LYS NZ   1 1 
        8 1943 1 1  3 LYS O    O   0.562 -0.873   1.379 1.00 . A A .   4 LYS O    1 1 
        8 1944 1 1  4 ASN C    C  -1.782 -3.604   0.378 1.00 . A A .   5 ASN C    1 1 
        8 1945 1 1  4 ASN CA   C  -1.003 -2.454  -0.261 1.00 . A A .   5 ASN CA   1 1 
        8 1946 1 1  4 ASN CB   C  -1.269 -2.443  -1.772 1.00 . A A .   5 ASN CB   1 1 
        8 1947 1 1  4 ASN CG   C  -0.402 -1.457  -2.535 1.00 . A A .   5 ASN CG   1 1 
        8 1948 1 1  4 ASN H    H   0.888 -3.376  -0.449 1.00 . A A .   5 ASN H    1 1 
        8 1949 1 1  4 ASN HA   H  -1.305 -1.509   0.164 1.00 . A A .   5 ASN HA   1 1 
        8 1950 1 1  4 ASN HB2  H  -1.077 -3.431  -2.165 1.00 . A A .   5 ASN HB2  1 1 
        8 1951 1 1  4 ASN HB3  H  -2.305 -2.192  -1.945 1.00 . A A .   5 ASN HB3  1 1 
        8 1952 1 1  4 ASN HD21 H  -1.777 -0.035  -2.330 1.00 . A A .   5 ASN HD21 1 1 
        8 1953 1 1  4 ASN HD22 H  -0.354  0.401  -3.203 1.00 . A A .   5 ASN HD22 1 1 
        8 1954 1 1  4 ASN N    N   0.408 -2.644   0.002 1.00 . A A .   5 ASN N    1 1 
        8 1955 1 1  4 ASN ND2  N  -0.890 -0.241  -2.705 1.00 . A A .   5 ASN ND2  1 1 
        8 1956 1 1  4 ASN O    O  -1.686 -4.740  -0.078 1.00 . A A .   5 ASN O    1 1 
        8 1957 1 1  4 ASN OD1  O   0.696 -1.792  -2.982 1.00 . A A .   5 ASN OD1  1 1 
        8 1958 1 1  5 .   C    C  -4.457 -4.869   1.298 1.00 . A A .   6 O6H C    1 1 
        8 1959 1 1  5 .   CA   C  -3.286 -4.369   2.136 1.00 . A A .   6 O6H CA   1 1 
        8 1960 1 1  5 .   CB   C  -3.785 -3.889   3.505 1.00 . A A .   6 O6H CB   1 1 
        8 1961 1 1  5 .   CD1  C  -2.459 -2.131   4.725 1.00 . A A .   6 O6H CD1  1 1 
        8 1962 1 1  5 .   CD2  C  -1.858 -4.412   5.063 1.00 . A A .   6 O6H CD2  1 1 
        8 1963 1 1  5 .   CE1  C  -1.453 -1.730   5.580 1.00 . A A .   6 O6H CE1  1 1 
        8 1964 1 1  5 .   CE2  C  -0.848 -4.022   5.922 1.00 . A A .   6 O6H CE2  1 1 
        8 1965 1 1  5 .   CF1  C  -3.329 -1.090   4.089 1.00 . A A .   6 O6H CF1  1 1 
        8 1966 1 1  5 .   CF2  C  -2.065 -5.877   4.803 1.00 . A A .   6 O6H CF2  1 1 
        8 1967 1 1  5 .   CG   C  -2.682 -3.471   4.448 1.00 . A A .   6 O6H CG   1 1 
        8 1968 1 1  5 .   CH   C   0.442 -2.252   7.101 1.00 . A A .   6 O6H CH   1 1 
        8 1969 1 1  5 .   CZ   C  -0.653 -2.680   6.175 1.00 . A A .   6 O6H CZ   1 1 
        8 1970 1 1  5 .   H1   H  -2.569 -2.411   1.789 1.00 . A A .   6 O6H H1   1 1 
        8 1971 1 1  5 .   HA   H  -2.611 -5.196   2.294 1.00 . A A .   6 O6H HA   1 1 
        8 1972 1 1  5 .   HB1  H  -4.339 -4.686   3.979 1.00 . A A .   6 O6H HB1  1 1 
        8 1973 1 1  5 .   HB2  H  -4.436 -3.040   3.366 1.00 . A A .   6 O6H HB2  1 1 
        8 1974 1 1  5 .   HE1  H  -1.295 -0.682   5.782 1.00 . A A .   6 O6H HE1  1 1 
        8 1975 1 1  5 .   HE2  H  -0.216 -4.761   6.393 1.00 . A A .   6 O6H HE2  1 1 
        8 1976 1 1  5 .   HF11 H  -3.684 -1.367   3.107 1.00 . A A .   6 O6H HF11 1 1 
        8 1977 1 1  5 .   HF12 H  -2.832 -0.142   3.955 1.00 . A A .   6 O6H HF12 1 1 
        8 1978 1 1  5 .   HF13 H  -4.217 -0.869   4.661 1.00 . A A .   6 O6H HF13 1 1 
        8 1979 1 1  5 .   HF21 H  -1.292 -6.500   5.226 1.00 . A A .   6 O6H HF21 1 1 
        8 1980 1 1  5 .   HF22 H  -2.991 -6.257   5.208 1.00 . A A .   6 O6H HF22 1 1 
        8 1981 1 1  5 .   HF23 H  -2.092 -6.126   3.752 1.00 . A A .   6 O6H HF23 1 1 
        8 1982 1 1  5 .   HH1  H   1.145 -1.571   6.643 1.00 . A A .   6 O6H HH1  1 1 
        8 1983 1 1  5 .   HH2  H   1.037 -3.075   7.468 1.00 . A A .   6 O6H HH2  1 1 
        8 1984 1 1  5 .   HH3  H   0.082 -1.741   7.981 1.00 . A A .   6 O6H HH3  1 1 
        8 1985 1 1  5 .   N    N  -2.534 -3.325   1.445 1.00 . A A .   6 O6H N    1 1 
        8 1986 1 1  5 .   O    O  -4.752 -6.064   1.278 1.00 . A A .   6 O6H O    1 1 
        8 1987 1 1  6 PHE C    C  -6.188 -4.267  -1.578 1.00 . A A .   7 PHE C    1 1 
        8 1988 1 1  6 PHE CA   C  -6.376 -4.283  -0.066 1.00 . A A .   7 PHE CA   1 1 
        8 1989 1 1  6 PHE CB   C  -7.482 -3.295   0.322 1.00 . A A .   7 PHE CB   1 1 
        8 1990 1 1  6 PHE CD1  C  -7.146 -1.532   2.073 1.00 . A A .   7 PHE CD1  1 1 
        8 1991 1 1  6 PHE CD2  C  -7.629 -3.755   2.790 1.00 . A A .   7 PHE CD2  1 1 
        8 1992 1 1  6 PHE CE1  C  -7.079 -1.119   3.389 1.00 . A A .   7 PHE CE1  1 1 
        8 1993 1 1  6 PHE CE2  C  -7.565 -3.346   4.109 1.00 . A A .   7 PHE CE2  1 1 
        8 1994 1 1  6 PHE CG   C  -7.423 -2.854   1.758 1.00 . A A .   7 PHE CG   1 1 
        8 1995 1 1  6 PHE CZ   C  -7.288 -2.026   4.407 1.00 . A A .   7 PHE CZ   1 1 
        8 1996 1 1  6 PHE H    H  -4.788 -3.036   0.579 1.00 . A A .   7 PHE H    1 1 
        8 1997 1 1  6 PHE HA   H  -6.670 -5.276   0.239 1.00 . A A .   7 PHE HA   1 1 
        8 1998 1 1  6 PHE HB2  H  -7.405 -2.416  -0.298 1.00 . A A .   7 PHE HB2  1 1 
        8 1999 1 1  6 PHE HB3  H  -8.444 -3.761   0.158 1.00 . A A .   7 PHE HB3  1 1 
        8 2000 1 1  6 PHE HD1  H  -6.984 -0.822   1.278 1.00 . A A .   7 PHE HD1  1 1 
        8 2001 1 1  6 PHE HD2  H  -7.845 -4.788   2.557 1.00 . A A .   7 PHE HD2  1 1 
        8 2002 1 1  6 PHE HE1  H  -6.865 -0.086   3.619 1.00 . A A .   7 PHE HE1  1 1 
        8 2003 1 1  6 PHE HE2  H  -7.729 -4.058   4.905 1.00 . A A .   7 PHE HE2  1 1 
        8 2004 1 1  6 PHE HZ   H  -7.230 -1.704   5.437 1.00 . A A .   7 PHE HZ   1 1 
        8 2005 1 1  6 PHE N    N  -5.130 -3.952   0.616 1.00 . A A .   7 PHE N    1 1 
        8 2006 1 1  6 PHE O    O  -6.992 -4.828  -2.321 1.00 . A A .   7 PHE O    1 1 
        8 2007 1 1  7 DTR C    C  -4.666 -2.065  -3.907 1.00 . A A .   8 DTR C    1 1 
        8 2008 1 1  7 DTR CA   C  -4.838 -3.522  -3.441 1.00 . A A .   8 DTR CA   1 1 
        8 2009 1 1  7 DTR CB   C  -3.583 -4.358  -3.747 1.00 . A A .   8 DTR CB   1 1 
        8 2010 1 1  7 DTR CD1  C  -1.699 -3.538  -5.261 1.00 . A A .   8 DTR CD1  1 1 
        8 2011 1 1  7 DTR CD2  C  -3.567 -4.114  -6.352 1.00 . A A .   8 DTR CD2  1 1 
        8 2012 1 1  7 DTR CE2  C  -2.625 -3.655  -7.287 1.00 . A A .   8 DTR CE2  1 1 
        8 2013 1 1  7 DTR CE3  C  -4.820 -4.537  -6.808 1.00 . A A .   8 DTR CE3  1 1 
        8 2014 1 1  7 DTR CG   C  -2.957 -4.021  -5.061 1.00 . A A .   8 DTR CG   1 1 
        8 2015 1 1  7 DTR CH2  C  -4.136 -4.016  -9.067 1.00 . A A .   8 DTR CH2  1 1 
        8 2016 1 1  7 DTR CZ2  C  -2.900 -3.598  -8.647 1.00 . A A .   8 DTR CZ2  1 1 
        8 2017 1 1  7 DTR CZ3  C  -5.090 -4.488  -8.161 1.00 . A A .   8 DTR CZ3  1 1 
        8 2018 1 1  7 DTR H    H  -4.557 -3.142  -1.394 1.00 . A A .   8 DTR H    1 1 
        8 2019 1 1  7 DTR HA   H  -5.645 -3.998  -3.983 1.00 . A A .   8 DTR HA   1 1 
        8 2020 1 1  7 DTR HB2  H  -2.849 -4.187  -2.975 1.00 . A A .   8 DTR HB2  1 1 
        8 2021 1 1  7 DTR HB3  H  -3.850 -5.405  -3.760 1.00 . A A .   8 DTR HB3  1 1 
        8 2022 1 1  7 DTR HD1  H  -0.982 -3.362  -4.471 1.00 . A A .   8 DTR HD1  1 1 
        8 2023 1 1  7 DTR HE1  H  -0.652 -2.973  -6.990 1.00 . A A .   8 DTR HE1  1 1 
        8 2024 1 1  7 DTR HE3  H  -5.568 -4.903  -6.121 1.00 . A A .   8 DTR HE3  1 1 
        8 2025 1 1  7 DTR HH2  H  -4.387 -3.996 -10.117 1.00 . A A .   8 DTR HH2  1 1 
        8 2026 1 1  7 DTR HZ2  H  -2.189 -3.212  -9.350 1.00 . A A .   8 DTR HZ2  1 1 
        8 2027 1 1  7 DTR HZ3  H  -6.053 -4.809  -8.530 1.00 . A A .   8 DTR HZ3  1 1 
        8 2028 1 1  7 DTR N    N  -5.143 -3.595  -2.028 1.00 . A A .   8 DTR N    1 1 
        8 2029 1 1  7 DTR NE1  N  -1.487 -3.317  -6.596 1.00 . A A .   8 DTR NE1  1 1 
        8 2030 1 1  7 DTR O    O  -3.797 -1.356  -3.404 1.00 . A A .   8 DTR O    1 1 
        8 2031 1 1  8 LYS C    C  -6.103  0.796  -4.615 1.00 . A A .   9 LYS C    1 1 
        8 2032 1 1  8 LYS CA   C  -5.364 -0.270  -5.423 1.00 . A A .   9 LYS CA   1 1 
        8 2033 1 1  8 LYS CB   C  -5.895 -0.261  -6.867 1.00 . A A .   9 LYS CB   1 1 
        8 2034 1 1  8 LYS CD   C  -3.915 -0.182  -8.422 1.00 . A A .   9 LYS CD   1 1 
        8 2035 1 1  8 LYS CE   C  -2.805  0.007  -7.405 1.00 . A A .   9 LYS CE   1 1 
        8 2036 1 1  8 LYS CG   C  -5.053 -1.032  -7.868 1.00 . A A .   9 LYS CG   1 1 
        8 2037 1 1  8 LYS H    H  -6.283 -2.156  -5.112 1.00 . A A .   9 LYS H    1 1 
        8 2038 1 1  8 LYS HA   H  -4.312 -0.033  -5.434 1.00 . A A .   9 LYS HA   1 1 
        8 2039 1 1  8 LYS HB2  H  -6.889 -0.677  -6.877 1.00 . A A .   9 LYS HB2  1 1 
        8 2040 1 1  8 LYS HB3  H  -5.941  0.758  -7.206 1.00 . A A .   9 LYS HB3  1 1 
        8 2041 1 1  8 LYS HD2  H  -3.506 -0.669  -9.296 1.00 . A A .   9 LYS HD2  1 1 
        8 2042 1 1  8 LYS HD3  H  -4.306  0.787  -8.699 1.00 . A A .   9 LYS HD3  1 1 
        8 2043 1 1  8 LYS HE2  H  -3.236  0.363  -6.490 1.00 . A A .   9 LYS HE2  1 1 
        8 2044 1 1  8 LYS HE3  H  -2.339 -0.943  -7.227 1.00 . A A .   9 LYS HE3  1 1 
        8 2045 1 1  8 LYS HG2  H  -4.634 -1.899  -7.379 1.00 . A A .   9 LYS HG2  1 1 
        8 2046 1 1  8 LYS HG3  H  -5.686 -1.349  -8.685 1.00 . A A .   9 LYS HG3  1 1 
        8 2047 1 1  8 LYS HZ1  H  -1.539  0.803  -8.867 1.00 . A A .   9 LYS HZ1  1 1 
        8 2048 1 1  8 LYS HZ2  H  -0.902  0.859  -7.298 1.00 . A A .   9 LYS HZ2  1 1 
        8 2049 1 1  8 LYS HZ3  H  -2.118  1.951  -7.757 1.00 . A A .   9 LYS HZ3  1 1 
        8 2050 1 1  8 LYS N    N  -5.524 -1.597  -4.825 1.00 . A A .   9 LYS N    1 1 
        8 2051 1 1  8 LYS NZ   N  -1.772  0.973  -7.864 1.00 . A A .   9 LYS NZ   1 1 
        8 2052 1 1  8 LYS O    O  -6.081  1.977  -4.964 1.00 . A A .   9 LYS O    1 1 
        8 2053 1 1  9 THR C    C  -6.618  2.091  -1.766 1.00 . A A .  10 THR C    1 1 
        8 2054 1 1  9 THR CA   C  -7.522  1.290  -2.707 1.00 . A A .  10 THR CA   1 1 
        8 2055 1 1  9 THR CB   C  -8.566  0.517  -1.874 1.00 . A A .  10 THR CB   1 1 
        8 2056 1 1  9 THR CG2  C  -9.538  1.473  -1.196 1.00 . A A .  10 THR CG2  1 1 
        8 2057 1 1  9 THR H    H  -6.715 -0.574  -3.301 1.00 . A A .  10 THR H    1 1 
        8 2058 1 1  9 THR HA   H  -8.045  1.974  -3.361 1.00 . A A .  10 THR HA   1 1 
        8 2059 1 1  9 THR HB   H  -8.052 -0.052  -1.112 1.00 . A A .  10 THR HB   1 1 
        8 2060 1 1  9 THR HG1  H -10.199 -0.488  -2.370 1.00 . A A .  10 THR HG1  1 1 
        8 2061 1 1  9 THR HG21 H -10.261  0.909  -0.627 1.00 . A A .  10 THR HG21 1 1 
        8 2062 1 1  9 THR HG22 H -10.048  2.058  -1.946 1.00 . A A .  10 THR HG22 1 1 
        8 2063 1 1  9 THR HG23 H  -8.993  2.131  -0.535 1.00 . A A .  10 THR HG23 1 1 
        8 2064 1 1  9 THR N    N  -6.744  0.377  -3.534 1.00 . A A .  10 THR N    1 1 
        8 2065 1 1  9 THR O    O  -6.833  3.282  -1.545 1.00 . A A .  10 THR O    1 1 
        8 2066 1 1  9 THR OG1  O  -9.295 -0.386  -2.719 1.00 . A A .  10 THR OG1  1 1 
        8 2067 1 1 10 PHE C    C  -3.247  2.052  -0.874 1.00 . A A .  11 PHE C    1 1 
        8 2068 1 1 10 PHE CA   C  -4.685  2.072  -0.297 1.00 . A A .  11 PHE CA   1 1 
        8 2069 1 1 10 PHE CB   C  -4.695  1.314   1.033 1.00 . A A .  11 PHE CB   1 1 
        8 2070 1 1 10 PHE CD1  C  -2.510  1.674   2.233 1.00 . A A .  11 PHE CD1  1 1 
        8 2071 1 1 10 PHE CD2  C  -4.437  2.845   3.011 1.00 . A A .  11 PHE CD2  1 1 
        8 2072 1 1 10 PHE CE1  C  -1.748  2.260   3.225 1.00 . A A .  11 PHE CE1  1 1 
        8 2073 1 1 10 PHE CE2  C  -3.679  3.435   4.006 1.00 . A A .  11 PHE CE2  1 1 
        8 2074 1 1 10 PHE CG   C  -3.862  1.960   2.112 1.00 . A A .  11 PHE CG   1 1 
        8 2075 1 1 10 PHE CZ   C  -2.333  3.141   4.113 1.00 . A A .  11 PHE CZ   1 1 
        8 2076 1 1 10 PHE H    H  -5.437  0.505  -1.491 1.00 . A A .  11 PHE H    1 1 
        8 2077 1 1 10 PHE HA   H  -5.043  3.074  -0.119 1.00 . A A .  11 PHE HA   1 1 
        8 2078 1 1 10 PHE HB2  H  -5.712  1.251   1.393 1.00 . A A .  11 PHE HB2  1 1 
        8 2079 1 1 10 PHE HB3  H  -4.315  0.316   0.871 1.00 . A A .  11 PHE HB3  1 1 
        8 2080 1 1 10 PHE HD1  H  -2.049  0.987   1.537 1.00 . A A .  11 PHE HD1  1 1 
        8 2081 1 1 10 PHE HD2  H  -5.489  3.076   2.928 1.00 . A A .  11 PHE HD2  1 1 
        8 2082 1 1 10 PHE HE1  H  -0.696  2.029   3.308 1.00 . A A .  11 PHE HE1  1 1 
        8 2083 1 1 10 PHE HE2  H  -4.139  4.124   4.698 1.00 . A A .  11 PHE HE2  1 1 
        8 2084 1 1 10 PHE HZ   H  -1.740  3.600   4.892 1.00 . A A .  11 PHE HZ   1 1 
        8 2085 1 1 10 PHE N    N  -5.596  1.435  -1.233 1.00 . A A .  11 PHE N    1 1 
        8 2086 1 1 10 PHE O    O  -2.677  0.965  -0.976 1.00 . A A .  11 PHE O    1 1 
        8 2087 1 1 11 THR C    C  -0.417  4.152  -0.999 1.00 . A A .  12 THR C    1 1 
        8 2088 1 1 11 THR CA   C  -1.291  3.180  -1.778 1.00 . A A .  12 THR CA   1 1 
        8 2089 1 1 11 THR CB   C  -1.254  3.527  -3.279 1.00 . A A .  12 THR CB   1 1 
        8 2090 1 1 11 THR CG2  C   0.174  3.746  -3.772 1.00 . A A .  12 THR CG2  1 1 
        8 2091 1 1 11 THR H    H  -3.127  4.056  -1.271 1.00 . A A .  12 THR H    1 1 
        8 2092 1 1 11 THR HA   H  -0.902  2.180  -1.653 1.00 . A A .  12 THR HA   1 1 
        8 2093 1 1 11 THR HB   H  -1.814  4.439  -3.433 1.00 . A A .  12 THR HB   1 1 
        8 2094 1 1 11 THR HG1  H  -1.876  2.713  -4.962 1.00 . A A .  12 THR HG1  1 1 
        8 2095 1 1 11 THR HG21 H   0.601  4.599  -3.267 1.00 . A A .  12 THR HG21 1 1 
        8 2096 1 1 11 THR HG22 H   0.163  3.927  -4.836 1.00 . A A .  12 THR HG22 1 1 
        8 2097 1 1 11 THR HG23 H   0.770  2.872  -3.562 1.00 . A A .  12 THR HG23 1 1 
        8 2098 1 1 11 THR N    N  -2.652  3.194  -1.280 1.00 . A A .  12 THR N    1 1 
        8 2099 1 1 11 THR O    O  -0.611  5.370  -1.056 1.00 . A A .  12 THR O    1 1 
        8 2100 1 1 11 THR OG1  O  -1.871  2.475  -4.027 1.00 . A A .  12 THR OG1  1 1 
        8 2101 1 1 12 SER C    C   2.908  3.817   0.182 1.00 . A A .  13 SER C    1 1 
        8 2102 1 1 12 SER CA   C   1.519  4.403   0.445 1.00 . A A .  13 SER CA   1 1 
        8 2103 1 1 12 SER CB   C   1.238  4.450   1.948 1.00 . A A .  13 SER CB   1 1 
        8 2104 1 1 12 SER H    H   0.520  2.629  -0.111 1.00 . A A .  13 SER H    1 1 
        8 2105 1 1 12 SER HA   H   1.472  5.405   0.044 1.00 . A A .  13 SER HA   1 1 
        8 2106 1 1 12 SER HB2  H   1.339  3.457   2.363 1.00 . A A .  13 SER HB2  1 1 
        8 2107 1 1 12 SER HB3  H   1.943  5.114   2.424 1.00 . A A .  13 SER HB3  1 1 
        8 2108 1 1 12 SER HG   H  -0.521  5.087   1.365 1.00 . A A .  13 SER HG   1 1 
        8 2109 1 1 12 SER N    N   0.510  3.604  -0.228 1.00 . A A .  13 SER N    1 1 
        8 2110 1 1 12 SER O    O   3.234  2.736   0.678 1.00 . A A .  13 SER O    1 1 
        8 2111 1 1 12 SER OG   O  -0.076  4.920   2.202 1.00 . A A .  13 SER OG   1 1 
        8 2112 1 1 13 CYS C    C   6.105  4.981  -0.386 1.00 . A A .  14 CYS C    1 1 
        8 2113 1 1 13 CYS CA   C   5.050  4.032  -0.937 1.00 . A A .  14 CYS CA   1 1 
        8 2114 1 1 13 CYS CB   C   5.216  3.902  -2.457 1.00 . A A .  14 CYS CB   1 1 
        8 2115 1 1 13 CYS H    H   3.412  5.368  -0.988 1.00 . A A .  14 CYS H    1 1 
        8 2116 1 1 13 CYS HA   H   5.179  3.060  -0.483 1.00 . A A .  14 CYS HA   1 1 
        8 2117 1 1 13 CYS HB2  H   5.242  4.890  -2.890 1.00 . A A .  14 CYS HB2  1 1 
        8 2118 1 1 13 CYS HB3  H   6.153  3.404  -2.665 1.00 . A A .  14 CYS HB3  1 1 
        8 2119 1 1 13 CYS N    N   3.718  4.513  -0.607 1.00 . A A .  14 CYS N    1 1 
        8 2120 1 1 13 CYS O    O   6.181  6.139  -0.790 1.00 . A A .  14 CYS O    1 1 
        8 2121 1 1 13 CYS SG   S   3.894  2.968  -3.307 1.00 . A A .  14 CYS SG   1 1 
        8 2122 1 1 14 LYS C    C   9.317  4.909   0.517 1.00 . A A .  15 LYS C    1 1 
        8 2123 1 1 14 LYS CA   C   7.972  5.302   1.120 1.00 . A A .  15 LYS CA   1 1 
        8 2124 1 1 14 LYS CB   C   8.007  5.155   2.646 1.00 . A A .  15 LYS CB   1 1 
        8 2125 1 1 14 LYS CD   C   8.420  3.543   4.534 1.00 . A A .  15 LYS CD   1 1 
        8 2126 1 1 14 LYS CE   C   9.913  3.233   4.525 1.00 . A A .  15 LYS CE   1 1 
        8 2127 1 1 14 LYS CG   C   7.870  3.720   3.128 1.00 . A A .  15 LYS CG   1 1 
        8 2128 1 1 14 LYS H    H   6.782  3.576   0.857 1.00 . A A .  15 LYS H    1 1 
        8 2129 1 1 14 LYS HA   H   7.772  6.334   0.876 1.00 . A A .  15 LYS HA   1 1 
        8 2130 1 1 14 LYS HB2  H   8.945  5.547   3.014 1.00 . A A .  15 LYS HB2  1 1 
        8 2131 1 1 14 LYS HB3  H   7.198  5.732   3.070 1.00 . A A .  15 LYS HB3  1 1 
        8 2132 1 1 14 LYS HD2  H   8.256  4.454   5.091 1.00 . A A .  15 LYS HD2  1 1 
        8 2133 1 1 14 LYS HD3  H   7.896  2.728   5.013 1.00 . A A .  15 LYS HD3  1 1 
        8 2134 1 1 14 LYS HE2  H  10.251  3.154   5.546 1.00 . A A .  15 LYS HE2  1 1 
        8 2135 1 1 14 LYS HE3  H  10.062  2.287   4.025 1.00 . A A .  15 LYS HE3  1 1 
        8 2136 1 1 14 LYS HG2  H   6.826  3.445   3.127 1.00 . A A .  15 LYS HG2  1 1 
        8 2137 1 1 14 LYS HG3  H   8.415  3.072   2.455 1.00 . A A .  15 LYS HG3  1 1 
        8 2138 1 1 14 LYS HZ1  H  11.734  4.052   3.912 1.00 . A A .  15 LYS HZ1  1 1 
        8 2139 1 1 14 LYS HZ2  H  10.551  5.211   4.262 1.00 . A A .  15 LYS HZ2  1 1 
        8 2140 1 1 14 LYS HZ3  H  10.466  4.319   2.819 1.00 . A A .  15 LYS HZ3  1 1 
        8 2141 1 1 14 LYS N    N   6.904  4.498   0.549 1.00 . A A .  15 LYS N    1 1 
        8 2142 1 1 14 LYS NZ   N  10.720  4.276   3.833 1.00 . A A .  15 LYS NZ   1 1 
        8 2143 1 1 14 LYS O    O   9.596  5.323  -0.628 1.00 . A A .  15 LYS O    1 1 
        8 2144 1 1 14 LYS OXT  O  10.092  4.192   1.188 1.00 . A A .  15 LYS OXT  1 1 
        8 2145 2 2  1 .   C1   C   8.067 -3.312   0.361 1.00 . B A . 101 OCA C1   1 1 
        8 2146 2 2  1 .   C2   C   7.257 -3.370   1.652 1.00 . B A . 101 OCA C2   1 1 
        8 2147 2 2  1 .   C3   C   8.057 -3.916   2.824 1.00 . B A . 101 OCA C3   1 1 
        8 2148 2 2  1 .   C4   C   7.626 -5.331   3.177 1.00 . B A . 101 OCA C4   1 1 
        8 2149 2 2  1 .   C5   C   6.977 -5.393   4.551 1.00 . B A . 101 OCA C5   1 1 
        8 2150 2 2  1 .   C6   C   7.986 -5.747   5.630 1.00 . B A . 101 OCA C6   1 1 
        8 2151 2 2  1 .   C7   C   7.370 -6.604   6.726 1.00 . B A . 101 OCA C7   1 1 
        8 2152 2 2  1 .   C8   C   6.901 -7.944   6.205 1.00 . B A . 101 OCA C8   1 1 
        8 2153 2 2  1 .   H21  H   6.398 -4.005   1.491 1.00 . B A . 101 OCA H21  1 1 
        8 2154 2 2  1 .   H22  H   6.925 -2.372   1.894 1.00 . B A . 101 OCA H22  1 1 
        8 2155 2 2  1 .   H31  H   9.104 -3.924   2.559 1.00 . B A . 101 OCA H31  1 1 
        8 2156 2 2  1 .   H32  H   7.904 -3.277   3.681 1.00 . B A . 101 OCA H32  1 1 
        8 2157 2 2  1 .   H41  H   6.915 -5.673   2.441 1.00 . B A . 101 OCA H41  1 1 
        8 2158 2 2  1 .   H42  H   8.494 -5.975   3.169 1.00 . B A . 101 OCA H42  1 1 
        8 2159 2 2  1 .   H51  H   6.544 -4.430   4.778 1.00 . B A . 101 OCA H51  1 1 
        8 2160 2 2  1 .   H52  H   6.202 -6.145   4.538 1.00 . B A . 101 OCA H52  1 1 
        8 2161 2 2  1 .   H61  H   8.802 -6.294   5.178 1.00 . B A . 101 OCA H61  1 1 
        8 2162 2 2  1 .   H62  H   8.362 -4.835   6.068 1.00 . B A . 101 OCA H62  1 1 
        8 2163 2 2  1 .   H71  H   6.520 -6.086   7.146 1.00 . B A . 101 OCA H71  1 1 
        8 2164 2 2  1 .   H72  H   8.108 -6.777   7.494 1.00 . B A . 101 OCA H72  1 1 
        8 2165 2 2  1 .   H81  H   7.729 -8.457   5.739 1.00 . B A . 101 OCA H81  1 1 
        8 2166 2 2  1 .   H82  H   6.116 -7.795   5.481 1.00 . B A . 101 OCA H82  1 1 
        8 2167 2 2  1 .   H83  H   6.527 -8.538   7.026 1.00 . B A . 101 OCA H83  1 1 
        8 2168 2 2  1 .   O1   O   8.167 -4.251  -0.430 1.00 . B A . 101 OCA O1   1 1 
        9 2169 1 1  1 PRO C    C   7.236 -0.072   0.529 1.00 . A A .   2 PRO C    1 1 
        9 2170 1 1  1 PRO CA   C   8.708 -0.437   0.726 1.00 . A A .   2 PRO CA   1 1 
        9 2171 1 1  1 PRO CB   C   9.598  0.763   0.423 1.00 . A A .   2 PRO CB   1 1 
        9 2172 1 1  1 PRO CD   C   9.815 -0.785  -1.408 1.00 . A A .   2 PRO CD   1 1 
        9 2173 1 1  1 PRO CG   C   9.840  0.682  -1.045 1.00 . A A .   2 PRO CG   1 1 
        9 2174 1 1  1 PRO HA   H   8.868 -0.763   1.742 1.00 . A A .   2 PRO HA   1 1 
        9 2175 1 1  1 PRO HB2  H   9.080  1.674   0.691 1.00 . A A .   2 PRO HB2  1 1 
        9 2176 1 1  1 PRO HB3  H  10.519  0.687   0.980 1.00 . A A .   2 PRO HB3  1 1 
        9 2177 1 1  1 PRO HD2  H   9.229 -0.940  -2.303 1.00 . A A .   2 PRO HD2  1 1 
        9 2178 1 1  1 PRO HD3  H  10.821 -1.155  -1.549 1.00 . A A .   2 PRO HD3  1 1 
        9 2179 1 1  1 PRO HG2  H   9.058  1.208  -1.573 1.00 . A A .   2 PRO HG2  1 1 
        9 2180 1 1  1 PRO HG3  H  10.803  1.109  -1.281 1.00 . A A .   2 PRO HG3  1 1 
        9 2181 1 1  1 PRO N    N   9.176 -1.433  -0.243 1.00 . A A .   2 PRO N    1 1 
        9 2182 1 1  1 PRO O    O   6.706  0.799   1.220 1.00 . A A .   2 PRO O    1 1 
        9 2183 1 1  2 CYS C    C   4.337 -1.678  -0.244 1.00 . A A .   3 CYS C    1 1 
        9 2184 1 1  2 CYS CA   C   5.181 -0.494  -0.697 1.00 . A A .   3 CYS CA   1 1 
        9 2185 1 1  2 CYS CB   C   4.976 -0.256  -2.195 1.00 . A A .   3 CYS CB   1 1 
        9 2186 1 1  2 CYS H    H   7.067 -1.415  -0.946 1.00 . A A .   3 CYS H    1 1 
        9 2187 1 1  2 CYS HA   H   4.880  0.389  -0.152 1.00 . A A .   3 CYS HA   1 1 
        9 2188 1 1  2 CYS HB2  H   5.124 -1.186  -2.723 1.00 . A A .   3 CYS HB2  1 1 
        9 2189 1 1  2 CYS HB3  H   3.966  0.090  -2.361 1.00 . A A .   3 CYS HB3  1 1 
        9 2190 1 1  2 CYS N    N   6.586 -0.742  -0.414 1.00 . A A .   3 CYS N    1 1 
        9 2191 1 1  2 CYS O    O   4.434 -2.771  -0.804 1.00 . A A .   3 CYS O    1 1 
        9 2192 1 1  2 CYS SG   S   6.111  0.976  -2.912 1.00 . A A .   3 CYS SG   1 1 
        9 2193 1 1  3 LYS C    C   1.198 -2.074   1.038 1.00 . A A .   4 LYS C    1 1 
        9 2194 1 1  3 LYS CA   C   2.633 -2.508   1.265 1.00 . A A .   4 LYS CA   1 1 
        9 2195 1 1  3 LYS CB   C   2.856 -2.812   2.753 1.00 . A A .   4 LYS CB   1 1 
        9 2196 1 1  3 LYS CD   C   2.323 -5.303   2.940 1.00 . A A .   4 LYS CD   1 1 
        9 2197 1 1  3 LYS CE   C   2.018 -5.621   1.482 1.00 . A A .   4 LYS CE   1 1 
        9 2198 1 1  3 LYS CG   C   1.924 -3.879   3.334 1.00 . A A .   4 LYS CG   1 1 
        9 2199 1 1  3 LYS H    H   3.550 -0.604   1.247 1.00 . A A .   4 LYS H    1 1 
        9 2200 1 1  3 LYS HA   H   2.820 -3.402   0.689 1.00 . A A .   4 LYS HA   1 1 
        9 2201 1 1  3 LYS HB2  H   3.868 -3.148   2.888 1.00 . A A .   4 LYS HB2  1 1 
        9 2202 1 1  3 LYS HB3  H   2.713 -1.901   3.315 1.00 . A A .   4 LYS HB3  1 1 
        9 2203 1 1  3 LYS HD2  H   3.384 -5.419   3.101 1.00 . A A .   4 LYS HD2  1 1 
        9 2204 1 1  3 LYS HD3  H   1.788 -5.999   3.570 1.00 . A A .   4 LYS HD3  1 1 
        9 2205 1 1  3 LYS HE2  H   0.971 -5.428   1.297 1.00 . A A .   4 LYS HE2  1 1 
        9 2206 1 1  3 LYS HE3  H   2.617 -4.977   0.854 1.00 . A A .   4 LYS HE3  1 1 
        9 2207 1 1  3 LYS HG2  H   1.945 -3.804   4.410 1.00 . A A .   4 LYS HG2  1 1 
        9 2208 1 1  3 LYS HG3  H   0.920 -3.687   2.983 1.00 . A A .   4 LYS HG3  1 1 
        9 2209 1 1  3 LYS HZ1  H   1.578 -7.672   1.536 1.00 . A A .   4 LYS HZ1  1 1 
        9 2210 1 1  3 LYS HZ2  H   3.237 -7.322   1.541 1.00 . A A .   4 LYS HZ2  1 1 
        9 2211 1 1  3 LYS HZ3  H   2.343 -7.166   0.107 1.00 . A A .   4 LYS HZ3  1 1 
        9 2212 1 1  3 LYS N    N   3.540 -1.475   0.794 1.00 . A A .   4 LYS N    1 1 
        9 2213 1 1  3 LYS NZ   N   2.313 -7.042   1.142 1.00 . A A .   4 LYS NZ   1 1 
        9 2214 1 1  3 LYS O    O   0.729 -1.105   1.636 1.00 . A A .   4 LYS O    1 1 
        9 2215 1 1  4 ASN C    C  -1.746 -3.598   0.485 1.00 . A A .   5 ASN C    1 1 
        9 2216 1 1  4 ASN CA   C  -0.882 -2.480  -0.099 1.00 . A A .   5 ASN CA   1 1 
        9 2217 1 1  4 ASN CB   C  -1.113 -2.366  -1.610 1.00 . A A .   5 ASN CB   1 1 
        9 2218 1 1  4 ASN CG   C  -0.171 -1.375  -2.273 1.00 . A A .   5 ASN CG   1 1 
        9 2219 1 1  4 ASN H    H   0.934 -3.530  -0.297 1.00 . A A .   5 ASN H    1 1 
        9 2220 1 1  4 ASN HA   H  -1.116 -1.536   0.366 1.00 . A A .   5 ASN HA   1 1 
        9 2221 1 1  4 ASN HB2  H  -0.965 -3.333  -2.065 1.00 . A A .   5 ASN HB2  1 1 
        9 2222 1 1  4 ASN HB3  H  -2.129 -2.042  -1.787 1.00 . A A .   5 ASN HB3  1 1 
        9 2223 1 1  4 ASN HD21 H  -0.128 -2.488  -3.915 1.00 . A A .   5 ASN HD21 1 1 
        9 2224 1 1  4 ASN HD22 H   0.829 -1.052  -3.957 1.00 . A A .   5 ASN HD22 1 1 
        9 2225 1 1  4 ASN N    N   0.505 -2.786   0.170 1.00 . A A .   5 ASN N    1 1 
        9 2226 1 1  4 ASN ND2  N   0.213 -1.666  -3.506 1.00 . A A .   5 ASN ND2  1 1 
        9 2227 1 1  4 ASN O    O  -1.716 -4.725  -0.007 1.00 . A A .   5 ASN O    1 1 
        9 2228 1 1  4 ASN OD1  O   0.221 -0.369  -1.682 1.00 . A A .   5 ASN OD1  1 1 
        9 2229 1 1  5 .   C    C  -4.480 -4.745   1.391 1.00 . A A .   6 O6H C    1 1 
        9 2230 1 1  5 .   CA   C  -3.285 -4.316   2.231 1.00 . A A .   6 O6H CA   1 1 
        9 2231 1 1  5 .   CB   C  -3.748 -3.832   3.608 1.00 . A A .   6 O6H CB   1 1 
        9 2232 1 1  5 .   CD1  C  -2.364 -2.053   4.732 1.00 . A A .   6 O6H CD1  1 1 
        9 2233 1 1  5 .   CD2  C  -1.793 -4.332   5.142 1.00 . A A .   6 O6H CD2  1 1 
        9 2234 1 1  5 .   CE1  C  -1.330 -1.638   5.545 1.00 . A A .   6 O6H CE1  1 1 
        9 2235 1 1  5 .   CE2  C  -0.756 -3.927   5.963 1.00 . A A .   6 O6H CE2  1 1 
        9 2236 1 1  5 .   CF1  C  -3.235 -1.019   4.084 1.00 . A A .   6 O6H CF1  1 1 
        9 2237 1 1  5 .   CF2  C  -2.027 -5.802   4.937 1.00 . A A .   6 O6H CF2  1 1 
        9 2238 1 1  5 .   CG   C  -2.619 -3.401   4.512 1.00 . A A .   6 O6H CG   1 1 
        9 2239 1 1  5 .   CH   C   0.592 -2.125   7.036 1.00 . A A .   6 O6H CH   1 1 
        9 2240 1 1  5 .   CZ   C  -0.532 -2.579   6.157 1.00 . A A .   6 O6H CZ   1 1 
        9 2241 1 1  5 .   H1   H  -2.484 -2.394   1.914 1.00 . A A .   6 O6H H1   1 1 
        9 2242 1 1  5 .   HA   H  -2.651 -5.177   2.371 1.00 . A A .   6 O6H HA   1 1 
        9 2243 1 1  5 .   HB1  H  -4.281 -4.633   4.101 1.00 . A A .   6 O6H HB1  1 1 
        9 2244 1 1  5 .   HB2  H  -4.413 -2.991   3.481 1.00 . A A .   6 O6H HB2  1 1 
        9 2245 1 1  5 .   HE1  H  -1.150 -0.586   5.703 1.00 . A A .   6 O6H HE1  1 1 
        9 2246 1 1  5 .   HE2  H  -0.126 -4.660   6.446 1.00 . A A .   6 O6H HE2  1 1 
        9 2247 1 1  5 .   HF11 H  -4.054 -0.700   4.709 1.00 . A A .   6 O6H HF11 1 1 
        9 2248 1 1  5 .   HF12 H  -3.690 -1.358   3.166 1.00 . A A .   6 O6H HF12 1 1 
        9 2249 1 1  5 .   HF13 H  -2.706 -0.113   3.824 1.00 . A A .   6 O6H HF13 1 1 
        9 2250 1 1  5 .   HF21 H  -1.917 -6.384   5.840 1.00 . A A .   6 O6H HF21 1 1 
        9 2251 1 1  5 .   HF22 H  -3.015 -6.032   4.568 1.00 . A A .   6 O6H HF22 1 1 
        9 2252 1 1  5 .   HF23 H  -1.347 -6.247   4.226 1.00 . A A .   6 O6H HF23 1 1 
        9 2253 1 1  5 .   HH1  H   0.263 -1.548   7.888 1.00 . A A .   6 O6H HH1  1 1 
        9 2254 1 1  5 .   HH2  H   1.171 -2.939   7.447 1.00 . A A .   6 O6H HH2  1 1 
        9 2255 1 1  5 .   HH3  H   1.305 -1.495   6.524 1.00 . A A .   6 O6H HH3  1 1 
        9 2256 1 1  5 .   N    N  -2.484 -3.305   1.556 1.00 . A A .   6 O6H N    1 1 
        9 2257 1 1  5 .   O    O  -4.854 -5.917   1.382 1.00 . A A .   6 O6H O    1 1 
        9 2258 1 1  6 PHE C    C  -6.268 -4.028  -1.440 1.00 . A A .   7 PHE C    1 1 
        9 2259 1 1  6 PHE CA   C  -6.390 -4.025   0.078 1.00 . A A .   7 PHE CA   1 1 
        9 2260 1 1  6 PHE CB   C  -7.415 -2.966   0.498 1.00 . A A .   7 PHE CB   1 1 
        9 2261 1 1  6 PHE CD1  C  -7.068 -1.266   2.304 1.00 . A A .   7 PHE CD1  1 1 
        9 2262 1 1  6 PHE CD2  C  -7.472 -3.526   2.947 1.00 . A A .   7 PHE CD2  1 1 
        9 2263 1 1  6 PHE CE1  C  -6.961 -0.903   3.630 1.00 . A A .   7 PHE CE1  1 1 
        9 2264 1 1  6 PHE CE2  C  -7.368 -3.168   4.277 1.00 . A A .   7 PHE CE2  1 1 
        9 2265 1 1  6 PHE CG   C  -7.324 -2.579   1.946 1.00 . A A .   7 PHE CG   1 1 
        9 2266 1 1  6 PHE CZ   C  -7.111 -1.856   4.619 1.00 . A A .   7 PHE CZ   1 1 
        9 2267 1 1  6 PHE H    H  -4.699 -2.896   0.673 1.00 . A A .   7 PHE H    1 1 
        9 2268 1 1  6 PHE HA   H  -6.740 -4.995   0.399 1.00 . A A .   7 PHE HA   1 1 
        9 2269 1 1  6 PHE HB2  H  -7.267 -2.074  -0.093 1.00 . A A .   7 PHE HB2  1 1 
        9 2270 1 1  6 PHE HB3  H  -8.408 -3.349   0.318 1.00 . A A .   7 PHE HB3  1 1 
        9 2271 1 1  6 PHE HD1  H  -6.954 -0.519   1.531 1.00 . A A .   7 PHE HD1  1 1 
        9 2272 1 1  6 PHE HD2  H  -7.674 -4.553   2.679 1.00 . A A .   7 PHE HD2  1 1 
        9 2273 1 1  6 PHE HE1  H  -6.763  0.125   3.893 1.00 . A A .   7 PHE HE1  1 1 
        9 2274 1 1  6 PHE HE2  H  -7.481 -3.916   5.048 1.00 . A A .   7 PHE HE2  1 1 
        9 2275 1 1  6 PHE HZ   H  -7.026 -1.576   5.657 1.00 . A A .   7 PHE HZ   1 1 
        9 2276 1 1  6 PHE N    N  -5.105 -3.783   0.725 1.00 . A A .   7 PHE N    1 1 
        9 2277 1 1  6 PHE O    O  -7.149 -4.540  -2.131 1.00 . A A .   7 PHE O    1 1 
        9 2278 1 1  7 DTR C    C  -4.990 -1.887  -3.872 1.00 . A A .   8 DTR C    1 1 
        9 2279 1 1  7 DTR CA   C  -5.055 -3.342  -3.404 1.00 . A A .   8 DTR CA   1 1 
        9 2280 1 1  7 DTR CB   C  -3.818 -4.096  -3.908 1.00 . A A .   8 DTR CB   1 1 
        9 2281 1 1  7 DTR CD1  C  -4.272 -4.776  -6.333 1.00 . A A .   8 DTR CD1  1 1 
        9 2282 1 1  7 DTR CD2  C  -2.921 -3.004  -6.119 1.00 . A A .   8 DTR CD2  1 1 
        9 2283 1 1  7 DTR CE2  C  -3.112 -3.257  -7.487 1.00 . A A .   8 DTR CE2  1 1 
        9 2284 1 1  7 DTR CE3  C  -2.105 -1.933  -5.742 1.00 . A A .   8 DTR CE3  1 1 
        9 2285 1 1  7 DTR CG   C  -3.677 -3.985  -5.396 1.00 . A A .   8 DTR CG   1 1 
        9 2286 1 1  7 DTR CH2  C  -1.731 -1.437  -8.080 1.00 . A A .   8 DTR CH2  1 1 
        9 2287 1 1  7 DTR CZ2  C  -2.523 -2.478  -8.477 1.00 . A A .   8 DTR CZ2  1 1 
        9 2288 1 1  7 DTR CZ3  C  -1.516 -1.163  -6.726 1.00 . A A .   8 DTR CZ3  1 1 
        9 2289 1 1  7 DTR H    H  -4.515 -3.070  -1.383 1.00 . A A .   8 DTR H    1 1 
        9 2290 1 1  7 DTR HA   H  -5.901 -3.843  -3.856 1.00 . A A .   8 DTR HA   1 1 
        9 2291 1 1  7 DTR HB2  H  -2.931 -3.682  -3.450 1.00 . A A .   8 DTR HB2  1 1 
        9 2292 1 1  7 DTR HB3  H  -3.905 -5.141  -3.653 1.00 . A A .   8 DTR HB3  1 1 
        9 2293 1 1  7 DTR HD1  H  -4.911 -5.615  -6.104 1.00 . A A .   8 DTR HD1  1 1 
        9 2294 1 1  7 DTR HE1  H  -4.247 -4.752  -8.440 1.00 . A A .   8 DTR HE1  1 1 
        9 2295 1 1  7 DTR HE3  H  -1.929 -1.708  -4.701 1.00 . A A .   8 DTR HE3  1 1 
        9 2296 1 1  7 DTR HH2  H  -1.250 -0.811  -8.817 1.00 . A A .   8 DTR HH2  1 1 
        9 2297 1 1  7 DTR HZ2  H  -2.687 -2.668  -9.524 1.00 . A A .   8 DTR HZ2  1 1 
        9 2298 1 1  7 DTR HZ3  H  -0.883 -0.331  -6.453 1.00 . A A .   8 DTR HZ3  1 1 
        9 2299 1 1  7 DTR N    N  -5.206 -3.440  -1.965 1.00 . A A .   8 DTR N    1 1 
        9 2300 1 1  7 DTR NE1  N  -3.940 -4.343  -7.593 1.00 . A A .   8 DTR NE1  1 1 
        9 2301 1 1  7 DTR O    O  -4.134 -1.130  -3.419 1.00 . A A .   8 DTR O    1 1 
        9 2302 1 1  8 LYS C    C  -6.420  0.914  -4.671 1.00 . A A .   9 LYS C    1 1 
        9 2303 1 1  8 LYS CA   C  -5.776 -0.223  -5.461 1.00 . A A .   9 LYS CA   1 1 
        9 2304 1 1  8 LYS CB   C  -6.410 -0.380  -6.855 1.00 . A A .   9 LYS CB   1 1 
        9 2305 1 1  8 LYS CD   C  -5.022  1.040  -8.425 1.00 . A A .   9 LYS CD   1 1 
        9 2306 1 1  8 LYS CE   C  -3.961  1.566  -7.473 1.00 . A A .   9 LYS CE   1 1 
        9 2307 1 1  8 LYS CG   C  -6.372  0.858  -7.744 1.00 . A A .   9 LYS CG   1 1 
        9 2308 1 1  8 LYS H    H  -6.716 -2.026  -4.903 1.00 . A A .   9 LYS H    1 1 
        9 2309 1 1  8 LYS HA   H  -4.722 -0.015  -5.575 1.00 . A A .   9 LYS HA   1 1 
        9 2310 1 1  8 LYS HB2  H  -5.889 -1.169  -7.375 1.00 . A A .   9 LYS HB2  1 1 
        9 2311 1 1  8 LYS HB3  H  -7.436 -0.677  -6.735 1.00 . A A .   9 LYS HB3  1 1 
        9 2312 1 1  8 LYS HD2  H  -4.696  0.087  -8.814 1.00 . A A .   9 LYS HD2  1 1 
        9 2313 1 1  8 LYS HD3  H  -5.136  1.738  -9.243 1.00 . A A .   9 LYS HD3  1 1 
        9 2314 1 1  8 LYS HE2  H  -3.835  0.855  -6.670 1.00 . A A .   9 LYS HE2  1 1 
        9 2315 1 1  8 LYS HE3  H  -3.030  1.666  -8.013 1.00 . A A .   9 LYS HE3  1 1 
        9 2316 1 1  8 LYS HG2  H  -7.134  0.764  -8.503 1.00 . A A .   9 LYS HG2  1 1 
        9 2317 1 1  8 LYS HG3  H  -6.575  1.727  -7.137 1.00 . A A .   9 LYS HG3  1 1 
        9 2318 1 1  8 LYS HZ1  H  -4.710  3.513  -7.643 1.00 . A A .   9 LYS HZ1  1 1 
        9 2319 1 1  8 LYS HZ2  H  -3.496  3.344  -6.474 1.00 . A A .   9 LYS HZ2  1 1 
        9 2320 1 1  8 LYS HZ3  H  -5.064  2.766  -6.159 1.00 . A A .   9 LYS HZ3  1 1 
        9 2321 1 1  8 LYS N    N  -5.909 -1.479  -4.744 1.00 . A A .   9 LYS N    1 1 
        9 2322 1 1  8 LYS NZ   N  -4.336  2.886  -6.896 1.00 . A A .   9 LYS NZ   1 1 
        9 2323 1 1  8 LYS O    O  -6.310  2.086  -5.037 1.00 . A A .   9 LYS O    1 1 
        9 2324 1 1  9 THR C    C  -6.638  2.234  -1.802 1.00 . A A .  10 THR C    1 1 
        9 2325 1 1  9 THR CA   C  -7.678  1.552  -2.699 1.00 . A A .  10 THR CA   1 1 
        9 2326 1 1  9 THR CB   C  -8.749  0.893  -1.812 1.00 . A A .  10 THR CB   1 1 
        9 2327 1 1  9 THR CG2  C  -9.728  1.931  -1.281 1.00 . A A .  10 THR CG2  1 1 
        9 2328 1 1  9 THR H    H  -7.138 -0.388  -3.339 1.00 . A A .  10 THR H    1 1 
        9 2329 1 1  9 THR HA   H  -8.156  2.295  -3.320 1.00 . A A .  10 THR HA   1 1 
        9 2330 1 1  9 THR HB   H  -8.260  0.418  -0.976 1.00 . A A .  10 THR HB   1 1 
        9 2331 1 1  9 THR HG1  H -10.004  0.329  -3.242 1.00 . A A .  10 THR HG1  1 1 
        9 2332 1 1  9 THR HG21 H -10.468  1.445  -0.664 1.00 . A A .  10 THR HG21 1 1 
        9 2333 1 1  9 THR HG22 H -10.215  2.424  -2.108 1.00 . A A .  10 THR HG22 1 1 
        9 2334 1 1  9 THR HG23 H  -9.191  2.660  -0.692 1.00 . A A .  10 THR HG23 1 1 
        9 2335 1 1  9 THR N    N  -7.054  0.564  -3.563 1.00 . A A .  10 THR N    1 1 
        9 2336 1 1  9 THR O    O  -6.771  3.413  -1.470 1.00 . A A .  10 THR O    1 1 
        9 2337 1 1  9 THR OG1  O  -9.460 -0.101  -2.564 1.00 . A A .  10 THR OG1  1 1 
        9 2338 1 1 10 PHE C    C  -3.162  1.763  -1.149 1.00 . A A .  11 PHE C    1 1 
        9 2339 1 1 10 PHE CA   C  -4.567  2.024  -0.544 1.00 . A A .  11 PHE CA   1 1 
        9 2340 1 1 10 PHE CB   C  -4.662  1.330   0.820 1.00 . A A .  11 PHE CB   1 1 
        9 2341 1 1 10 PHE CD1  C  -2.447  1.556   1.992 1.00 . A A .  11 PHE CD1  1 1 
        9 2342 1 1 10 PHE CD2  C  -4.275  2.883   2.757 1.00 . A A .  11 PHE CD2  1 1 
        9 2343 1 1 10 PHE CE1  C  -1.636  2.108   2.964 1.00 . A A .  11 PHE CE1  1 1 
        9 2344 1 1 10 PHE CE2  C  -3.466  3.439   3.731 1.00 . A A .  11 PHE CE2  1 1 
        9 2345 1 1 10 PHE CG   C  -3.776  1.936   1.876 1.00 . A A .  11 PHE CG   1 1 
        9 2346 1 1 10 PHE CZ   C  -2.145  3.051   3.834 1.00 . A A .  11 PHE CZ   1 1 
        9 2347 1 1 10 PHE H    H  -5.506  0.583  -1.770 1.00 . A A .  11 PHE H    1 1 
        9 2348 1 1 10 PHE HA   H  -4.760  3.074  -0.399 1.00 . A A .  11 PHE HA   1 1 
        9 2349 1 1 10 PHE HB2  H  -5.680  1.385   1.172 1.00 . A A .  11 PHE HB2  1 1 
        9 2350 1 1 10 PHE HB3  H  -4.382  0.294   0.706 1.00 . A A .  11 PHE HB3  1 1 
        9 2351 1 1 10 PHE HD1  H  -2.045  0.820   1.312 1.00 . A A .  11 PHE HD1  1 1 
        9 2352 1 1 10 PHE HD2  H  -5.308  3.188   2.677 1.00 . A A .  11 PHE HD2  1 1 
        9 2353 1 1 10 PHE HE1  H  -0.602  1.802   3.042 1.00 . A A .  11 PHE HE1  1 1 
        9 2354 1 1 10 PHE HE2  H  -3.867  4.174   4.412 1.00 . A A .  11 PHE HE2  1 1 
        9 2355 1 1 10 PHE HZ   H  -1.513  3.484   4.595 1.00 . A A .  11 PHE HZ   1 1 
        9 2356 1 1 10 PHE N    N  -5.597  1.496  -1.428 1.00 . A A .  11 PHE N    1 1 
        9 2357 1 1 10 PHE O    O  -2.755  0.604  -1.204 1.00 . A A .  11 PHE O    1 1 
        9 2358 1 1 11 THR C    C  -0.106  3.565  -1.479 1.00 . A A .  12 THR C    1 1 
        9 2359 1 1 11 THR CA   C  -1.067  2.563  -2.113 1.00 . A A .  12 THR CA   1 1 
        9 2360 1 1 11 THR CB   C  -1.007  2.693  -3.650 1.00 . A A .  12 THR CB   1 1 
        9 2361 1 1 11 THR CG2  C  -1.755  1.556  -4.328 1.00 . A A .  12 THR CG2  1 1 
        9 2362 1 1 11 THR H    H  -2.777  3.695  -1.688 1.00 . A A .  12 THR H    1 1 
        9 2363 1 1 11 THR HA   H  -0.769  1.562  -1.840 1.00 . A A .  12 THR HA   1 1 
        9 2364 1 1 11 THR HB   H   0.029  2.661  -3.961 1.00 . A A .  12 THR HB   1 1 
        9 2365 1 1 11 THR HG1  H  -1.220  4.648  -3.498 1.00 . A A .  12 THR HG1  1 1 
        9 2366 1 1 11 THR HG21 H  -1.343  0.611  -4.007 1.00 . A A .  12 THR HG21 1 1 
        9 2367 1 1 11 THR HG22 H  -1.654  1.647  -5.398 1.00 . A A .  12 THR HG22 1 1 
        9 2368 1 1 11 THR HG23 H  -2.800  1.603  -4.059 1.00 . A A .  12 THR HG23 1 1 
        9 2369 1 1 11 THR N    N  -2.419  2.786  -1.628 1.00 . A A .  12 THR N    1 1 
        9 2370 1 1 11 THR O    O  -0.178  4.764  -1.759 1.00 . A A .  12 THR O    1 1 
        9 2371 1 1 11 THR OG1  O  -1.581  3.945  -4.052 1.00 . A A .  12 THR OG1  1 1 
        9 2372 1 1 12 SER C    C   3.135  3.503   0.008 1.00 . A A .  13 SER C    1 1 
        9 2373 1 1 12 SER CA   C   1.681  3.980   0.101 1.00 . A A .  13 SER CA   1 1 
        9 2374 1 1 12 SER CB   C   1.257  4.087   1.564 1.00 . A A .  13 SER CB   1 1 
        9 2375 1 1 12 SER H    H   0.824  2.122  -0.448 1.00 . A A .  13 SER H    1 1 
        9 2376 1 1 12 SER HA   H   1.596  4.955  -0.352 1.00 . A A .  13 SER HA   1 1 
        9 2377 1 1 12 SER HB2  H   1.313  3.113   2.027 1.00 . A A .  13 SER HB2  1 1 
        9 2378 1 1 12 SER HB3  H   1.913  4.772   2.080 1.00 . A A .  13 SER HB3  1 1 
        9 2379 1 1 12 SER HG   H  -0.475  4.565   0.787 1.00 . A A .  13 SER HG   1 1 
        9 2380 1 1 12 SER N    N   0.775  3.090  -0.611 1.00 . A A .  13 SER N    1 1 
        9 2381 1 1 12 SER O    O   3.467  2.414   0.478 1.00 . A A .  13 SER O    1 1 
        9 2382 1 1 12 SER OG   O  -0.074  4.566   1.662 1.00 . A A .  13 SER OG   1 1 
        9 2383 1 1 13 CYS C    C   6.189  5.136   0.041 1.00 . A A .  14 CYS C    1 1 
        9 2384 1 1 13 CYS CA   C   5.417  4.023  -0.658 1.00 . A A .  14 CYS CA   1 1 
        9 2385 1 1 13 CYS CB   C   5.887  3.893  -2.108 1.00 . A A .  14 CYS CB   1 1 
        9 2386 1 1 13 CYS H    H   3.662  5.118  -1.067 1.00 . A A .  14 CYS H    1 1 
        9 2387 1 1 13 CYS HA   H   5.591  3.091  -0.141 1.00 . A A .  14 CYS HA   1 1 
        9 2388 1 1 13 CYS HB2  H   5.765  4.846  -2.604 1.00 . A A .  14 CYS HB2  1 1 
        9 2389 1 1 13 CYS HB3  H   6.931  3.619  -2.117 1.00 . A A .  14 CYS HB3  1 1 
        9 2390 1 1 13 CYS N    N   3.993  4.311  -0.612 1.00 . A A .  14 CYS N    1 1 
        9 2391 1 1 13 CYS O    O   6.218  6.273  -0.435 1.00 . A A .  14 CYS O    1 1 
        9 2392 1 1 13 CYS SG   S   4.974  2.648  -3.078 1.00 . A A .  14 CYS SG   1 1 
        9 2393 1 1 14 LYS C    C   8.685  5.154   2.707 1.00 . A A .  15 LYS C    1 1 
        9 2394 1 1 14 LYS CA   C   7.531  5.808   1.949 1.00 . A A .  15 LYS CA   1 1 
        9 2395 1 1 14 LYS CB   C   6.595  6.561   2.907 1.00 . A A .  15 LYS CB   1 1 
        9 2396 1 1 14 LYS CD   C   4.844  6.459   4.712 1.00 . A A .  15 LYS CD   1 1 
        9 2397 1 1 14 LYS CE   C   5.733  7.193   5.701 1.00 . A A .  15 LYS CE   1 1 
        9 2398 1 1 14 LYS CG   C   5.665  5.660   3.712 1.00 . A A .  15 LYS CG   1 1 
        9 2399 1 1 14 LYS H    H   6.711  3.905   1.528 1.00 . A A .  15 LYS H    1 1 
        9 2400 1 1 14 LYS HA   H   7.945  6.515   1.245 1.00 . A A .  15 LYS HA   1 1 
        9 2401 1 1 14 LYS HB2  H   7.196  7.128   3.601 1.00 . A A .  15 LYS HB2  1 1 
        9 2402 1 1 14 LYS HB3  H   5.988  7.243   2.331 1.00 . A A .  15 LYS HB3  1 1 
        9 2403 1 1 14 LYS HD2  H   4.245  7.180   4.177 1.00 . A A .  15 LYS HD2  1 1 
        9 2404 1 1 14 LYS HD3  H   4.199  5.783   5.254 1.00 . A A .  15 LYS HD3  1 1 
        9 2405 1 1 14 LYS HE2  H   6.363  6.473   6.202 1.00 . A A .  15 LYS HE2  1 1 
        9 2406 1 1 14 LYS HE3  H   6.352  7.892   5.157 1.00 . A A .  15 LYS HE3  1 1 
        9 2407 1 1 14 LYS HG2  H   4.995  5.154   3.034 1.00 . A A .  15 LYS HG2  1 1 
        9 2408 1 1 14 LYS HG3  H   6.259  4.931   4.245 1.00 . A A .  15 LYS HG3  1 1 
        9 2409 1 1 14 LYS HZ1  H   4.462  7.271   7.359 1.00 . A A .  15 LYS HZ1  1 1 
        9 2410 1 1 14 LYS HZ2  H   4.235  8.542   6.257 1.00 . A A .  15 LYS HZ2  1 1 
        9 2411 1 1 14 LYS HZ3  H   5.583  8.542   7.287 1.00 . A A .  15 LYS HZ3  1 1 
        9 2412 1 1 14 LYS N    N   6.781  4.821   1.185 1.00 . A A .  15 LYS N    1 1 
        9 2413 1 1 14 LYS NZ   N   4.948  7.936   6.722 1.00 . A A .  15 LYS NZ   1 1 
        9 2414 1 1 14 LYS O    O   8.499  4.757   3.876 1.00 . A A .  15 LYS O    1 1 
        9 2415 1 1 14 LYS OXT  O   9.782  5.035   2.124 1.00 . A A .  15 LYS OXT  1 1 
        9 2416 2 2  1 .   C1   C   9.052 -2.773  -0.075 1.00 . B A . 101 OCA C1   1 1 
        9 2417 2 2  1 .   C2   C   8.401 -3.098   1.265 1.00 . B A . 101 OCA C2   1 1 
        9 2418 2 2  1 .   C3   C   9.410 -3.262   2.393 1.00 . B A . 101 OCA C3   1 1 
        9 2419 2 2  1 .   C4   C   8.957 -2.546   3.656 1.00 . B A . 101 OCA C4   1 1 
        9 2420 2 2  1 .   C5   C   7.601 -3.043   4.130 1.00 . B A . 101 OCA C5   1 1 
        9 2421 2 2  1 .   C6   C   7.514 -3.069   5.648 1.00 . B A . 101 OCA C6   1 1 
        9 2422 2 2  1 .   C7   C   7.964 -4.409   6.213 1.00 . B A . 101 OCA C7   1 1 
        9 2423 2 2  1 .   C8   C   7.853 -4.450   7.723 1.00 . B A . 101 OCA C8   1 1 
        9 2424 2 2  1 .   H21  H   7.723 -2.297   1.520 1.00 . B A . 101 OCA H21  1 1 
        9 2425 2 2  1 .   H22  H   7.844 -4.018   1.163 1.00 . B A . 101 OCA H22  1 1 
        9 2426 2 2  1 .   H31  H  10.357 -2.850   2.076 1.00 . B A . 101 OCA H31  1 1 
        9 2427 2 2  1 .   H32  H   9.527 -4.313   2.609 1.00 . B A . 101 OCA H32  1 1 
        9 2428 2 2  1 .   H41  H   9.685 -2.719   4.434 1.00 . B A . 101 OCA H41  1 1 
        9 2429 2 2  1 .   H42  H   8.891 -1.486   3.452 1.00 . B A . 101 OCA H42  1 1 
        9 2430 2 2  1 .   H51  H   6.836 -2.385   3.747 1.00 . B A . 101 OCA H51  1 1 
        9 2431 2 2  1 .   H52  H   7.441 -4.043   3.752 1.00 . B A . 101 OCA H52  1 1 
        9 2432 2 2  1 .   H61  H   8.148 -2.292   6.048 1.00 . B A . 101 OCA H61  1 1 
        9 2433 2 2  1 .   H62  H   6.491 -2.891   5.943 1.00 . B A . 101 OCA H62  1 1 
        9 2434 2 2  1 .   H71  H   8.996 -4.579   5.941 1.00 . B A . 101 OCA H71  1 1 
        9 2435 2 2  1 .   H72  H   7.345 -5.192   5.802 1.00 . B A . 101 OCA H72  1 1 
        9 2436 2 2  1 .   H81  H   6.864 -4.779   8.002 1.00 . B A . 101 OCA H81  1 1 
        9 2437 2 2  1 .   H82  H   8.032 -3.463   8.124 1.00 . B A . 101 OCA H82  1 1 
        9 2438 2 2  1 .   H83  H   8.586 -5.138   8.119 1.00 . B A . 101 OCA H83  1 1 
        9 2439 2 2  1 .   O1   O   9.443 -3.625  -0.873 1.00 . B A . 101 OCA O1   1 1 
       10 2440 1 1  1 PRO C    C   7.456  0.363   0.224 1.00 . A A .   2 PRO C    1 1 
       10 2441 1 1  1 PRO CA   C   8.888 -0.040   0.574 1.00 . A A .   2 PRO CA   1 1 
       10 2442 1 1  1 PRO CB   C   9.868  1.039   0.122 1.00 . A A .   2 PRO CB   1 1 
       10 2443 1 1  1 PRO CD   C  10.146 -0.851  -1.343 1.00 . A A .   2 PRO CD   1 1 
       10 2444 1 1  1 PRO CG   C  10.234  0.655  -1.272 1.00 . A A .   2 PRO CG   1 1 
       10 2445 1 1  1 PRO HA   H   8.970 -0.177   1.642 1.00 . A A .   2 PRO HA   1 1 
       10 2446 1 1  1 PRO HB2  H   9.384  2.006   0.154 1.00 . A A .   2 PRO HB2  1 1 
       10 2447 1 1  1 PRO HB3  H  10.731  1.040   0.771 1.00 . A A .   2 PRO HB3  1 1 
       10 2448 1 1  1 PRO HD2  H   9.643 -1.155  -2.249 1.00 . A A .   2 PRO HD2  1 1 
       10 2449 1 1  1 PRO HD3  H  11.134 -1.286  -1.297 1.00 . A A .   2 PRO HD3  1 1 
       10 2450 1 1  1 PRO HG2  H   9.539  1.102  -1.968 1.00 . A A .   2 PRO HG2  1 1 
       10 2451 1 1  1 PRO HG3  H  11.240  0.981  -1.488 1.00 . A A .   2 PRO HG3  1 1 
       10 2452 1 1  1 PRO N    N   9.354 -1.226  -0.154 1.00 . A A .   2 PRO N    1 1 
       10 2453 1 1  1 PRO O    O   6.925  1.324   0.779 1.00 . A A .   2 PRO O    1 1 
       10 2454 1 1  2 CYS C    C   4.516 -1.158  -0.547 1.00 . A A .   3 CYS C    1 1 
       10 2455 1 1  2 CYS CA   C   5.462 -0.086  -1.086 1.00 . A A .   3 CYS CA   1 1 
       10 2456 1 1  2 CYS CB   C   5.352 -0.025  -2.614 1.00 . A A .   3 CYS CB   1 1 
       10 2457 1 1  2 CYS H    H   7.292 -1.147  -1.077 1.00 . A A .   3 CYS H    1 1 
       10 2458 1 1  2 CYS HA   H   5.190  0.871  -0.671 1.00 . A A .   3 CYS HA   1 1 
       10 2459 1 1  2 CYS HB2  H   5.497 -1.017  -3.011 1.00 . A A .   3 CYS HB2  1 1 
       10 2460 1 1  2 CYS HB3  H   4.361  0.317  -2.878 1.00 . A A .   3 CYS HB3  1 1 
       10 2461 1 1  2 CYS N    N   6.827 -0.384  -0.676 1.00 . A A .   3 CYS N    1 1 
       10 2462 1 1  2 CYS O    O   4.635 -2.331  -0.894 1.00 . A A .   3 CYS O    1 1 
       10 2463 1 1  2 CYS SG   S   6.556  1.077  -3.446 1.00 . A A .   3 CYS SG   1 1 
       10 2464 1 1  3 LYS C    C   1.231 -1.351   0.604 1.00 . A A .   4 LYS C    1 1 
       10 2465 1 1  3 LYS CA   C   2.675 -1.685   0.955 1.00 . A A .   4 LYS CA   1 1 
       10 2466 1 1  3 LYS CB   C   2.852 -1.614   2.477 1.00 . A A .   4 LYS CB   1 1 
       10 2467 1 1  3 LYS CD   C   3.033 -3.972   3.376 1.00 . A A .   4 LYS CD   1 1 
       10 2468 1 1  3 LYS CE   C   2.984 -4.840   2.129 1.00 . A A .   4 LYS CE   1 1 
       10 2469 1 1  3 LYS CG   C   2.160 -2.728   3.257 1.00 . A A .   4 LYS CG   1 1 
       10 2470 1 1  3 LYS H    H   3.497  0.207   0.509 1.00 . A A .   4 LYS H    1 1 
       10 2471 1 1  3 LYS HA   H   2.904 -2.681   0.613 1.00 . A A .   4 LYS HA   1 1 
       10 2472 1 1  3 LYS HB2  H   3.905 -1.652   2.704 1.00 . A A .   4 LYS HB2  1 1 
       10 2473 1 1  3 LYS HB3  H   2.455 -0.670   2.822 1.00 . A A .   4 LYS HB3  1 1 
       10 2474 1 1  3 LYS HD2  H   4.054 -3.664   3.541 1.00 . A A .   4 LYS HD2  1 1 
       10 2475 1 1  3 LYS HD3  H   2.693 -4.553   4.220 1.00 . A A .   4 LYS HD3  1 1 
       10 2476 1 1  3 LYS HE2  H   3.196 -4.225   1.268 1.00 . A A .   4 LYS HE2  1 1 
       10 2477 1 1  3 LYS HE3  H   3.736 -5.611   2.212 1.00 . A A .   4 LYS HE3  1 1 
       10 2478 1 1  3 LYS HG2  H   1.929 -2.371   4.249 1.00 . A A .   4 LYS HG2  1 1 
       10 2479 1 1  3 LYS HG3  H   1.245 -2.994   2.749 1.00 . A A .   4 LYS HG3  1 1 
       10 2480 1 1  3 LYS HZ1  H   1.684 -6.169   1.167 1.00 . A A .   4 LYS HZ1  1 1 
       10 2481 1 1  3 LYS HZ2  H   0.935 -4.767   1.741 1.00 . A A .   4 LYS HZ2  1 1 
       10 2482 1 1  3 LYS HZ3  H   1.379 -5.985   2.828 1.00 . A A .   4 LYS HZ3  1 1 
       10 2483 1 1  3 LYS N    N   3.584 -0.753   0.309 1.00 . A A .   4 LYS N    1 1 
       10 2484 1 1  3 LYS NZ   N   1.652 -5.481   1.953 1.00 . A A .   4 LYS NZ   1 1 
       10 2485 1 1  3 LYS O    O   0.731 -0.283   0.962 1.00 . A A .   4 LYS O    1 1 
       10 2486 1 1  4 ASN C    C  -1.648 -3.142   0.442 1.00 . A A .   5 ASN C    1 1 
       10 2487 1 1  4 ASN CA   C  -0.860 -2.092  -0.353 1.00 . A A .   5 ASN CA   1 1 
       10 2488 1 1  4 ASN CB   C  -1.176 -2.202  -1.853 1.00 . A A .   5 ASN CB   1 1 
       10 2489 1 1  4 ASN CG   C  -0.385 -3.284  -2.568 1.00 . A A .   5 ASN CG   1 1 
       10 2490 1 1  4 ASN H    H   1.039 -3.035  -0.464 1.00 . A A .   5 ASN H    1 1 
       10 2491 1 1  4 ASN HA   H  -1.130 -1.102  -0.023 1.00 . A A .   5 ASN HA   1 1 
       10 2492 1 1  4 ASN HB2  H  -2.226 -2.419  -1.976 1.00 . A A .   5 ASN HB2  1 1 
       10 2493 1 1  4 ASN HB3  H  -0.957 -1.255  -2.325 1.00 . A A .   5 ASN HB3  1 1 
       10 2494 1 1  4 ASN HD21 H   0.987 -1.950  -3.102 1.00 . A A .   5 ASN HD21 1 1 
       10 2495 1 1  4 ASN HD22 H   1.270 -3.572  -3.626 1.00 . A A .   5 ASN HD22 1 1 
       10 2496 1 1  4 ASN N    N   0.565 -2.250  -0.102 1.00 . A A .   5 ASN N    1 1 
       10 2497 1 1  4 ASN ND2  N   0.737 -2.898  -3.158 1.00 . A A .   5 ASN ND2  1 1 
       10 2498 1 1  4 ASN O    O  -1.568 -4.337   0.152 1.00 . A A .   5 ASN O    1 1 
       10 2499 1 1  4 ASN OD1  O  -0.788 -4.446  -2.618 1.00 . A A .   5 ASN OD1  1 1 
       10 2500 1 1  5 .   C    C  -4.352 -4.204   1.589 1.00 . A A .   6 O6H C    1 1 
       10 2501 1 1  5 .   CA   C  -3.141 -3.622   2.313 1.00 . A A .   6 O6H CA   1 1 
       10 2502 1 1  5 .   CB   C  -3.588 -2.928   3.604 1.00 . A A .   6 O6H CB   1 1 
       10 2503 1 1  5 .   CD1  C  -1.789 -3.299   5.336 1.00 . A A .   6 O6H CD1  1 1 
       10 2504 1 1  5 .   CD2  C  -2.014 -1.121   4.393 1.00 . A A .   6 O6H CD2  1 1 
       10 2505 1 1  5 .   CE1  C  -0.741 -2.857   6.119 1.00 . A A .   6 O6H CE1  1 1 
       10 2506 1 1  5 .   CE2  C  -0.969 -0.667   5.172 1.00 . A A .   6 O6H CE2  1 1 
       10 2507 1 1  5 .   CF1  C  -2.223 -4.734   5.444 1.00 . A A .   6 O6H CF1  1 1 
       10 2508 1 1  5 .   CF2  C  -2.692 -0.158   3.464 1.00 . A A .   6 O6H CF2  1 1 
       10 2509 1 1  5 .   CG   C  -2.446 -2.441   4.458 1.00 . A A .   6 O6H CG   1 1 
       10 2510 1 1  5 .   CH   C   0.804 -1.057   6.881 1.00 . A A .   6 O6H CH   1 1 
       10 2511 1 1  5 .   CZ   C  -0.336 -1.542   6.033 1.00 . A A .   6 O6H CZ   1 1 
       10 2512 1 1  5 .   H1   H  -2.395 -1.757   1.695 1.00 . A A .   6 O6H H1   1 1 
       10 2513 1 1  5 .   HA   H  -2.483 -4.436   2.577 1.00 . A A .   6 O6H HA   1 1 
       10 2514 1 1  5 .   HB1  H  -4.171 -3.619   4.192 1.00 . A A .   6 O6H HB1  1 1 
       10 2515 1 1  5 .   HB2  H  -4.197 -2.072   3.351 1.00 . A A .   6 O6H HB2  1 1 
       10 2516 1 1  5 .   HE1  H  -0.245 -3.535   6.795 1.00 . A A .   6 O6H HE1  1 1 
       10 2517 1 1  5 .   HE2  H  -0.650  0.362   5.105 1.00 . A A .   6 O6H HE2  1 1 
       10 2518 1 1  5 .   HF11 H  -2.779 -5.079   4.587 1.00 . A A .   6 O6H HF11 1 1 
       10 2519 1 1  5 .   HF12 H  -2.861 -4.926   6.294 1.00 . A A .   6 O6H HF12 1 1 
       10 2520 1 1  5 .   HF13 H  -1.398 -5.425   5.545 1.00 . A A .   6 O6H HF13 1 1 
       10 2521 1 1  5 .   HF21 H  -3.443  0.448   3.949 1.00 . A A .   6 O6H HF21 1 1 
       10 2522 1 1  5 .   HF22 H  -2.010  0.544   3.005 1.00 . A A .   6 O6H HF22 1 1 
       10 2523 1 1  5 .   HF23 H  -3.200 -0.640   2.642 1.00 . A A .   6 O6H HF23 1 1 
       10 2524 1 1  5 .   HH1  H   1.754 -1.075   6.370 1.00 . A A .   6 O6H HH1  1 1 
       10 2525 1 1  5 .   HH2  H   0.951 -1.643   7.777 1.00 . A A .   6 O6H HH2  1 1 
       10 2526 1 1  5 .   HH3  H   0.684 -0.039   7.223 1.00 . A A .   6 O6H HH3  1 1 
       10 2527 1 1  5 .   N    N  -2.376 -2.710   1.476 1.00 . A A .   6 O6H N    1 1 
       10 2528 1 1  5 .   O    O  -4.676 -5.380   1.753 1.00 . A A .   6 O6H O    1 1 
       10 2529 1 1  6 PHE C    C  -6.268 -3.902  -1.260 1.00 . A A .   7 PHE C    1 1 
       10 2530 1 1  6 PHE CA   C  -6.334 -3.743   0.254 1.00 . A A .   7 PHE CA   1 1 
       10 2531 1 1  6 PHE CB   C  -7.393 -2.701   0.634 1.00 . A A .   7 PHE CB   1 1 
       10 2532 1 1  6 PHE CD1  C  -6.818 -1.061   2.440 1.00 . A A .   7 PHE CD1  1 1 
       10 2533 1 1  6 PHE CD2  C  -7.757 -3.158   3.077 1.00 . A A .   7 PHE CD2  1 1 
       10 2534 1 1  6 PHE CE1  C  -6.736 -0.689   3.768 1.00 . A A .   7 PHE CE1  1 1 
       10 2535 1 1  6 PHE CE2  C  -7.681 -2.790   4.408 1.00 . A A .   7 PHE CE2  1 1 
       10 2536 1 1  6 PHE CG   C  -7.328 -2.298   2.080 1.00 . A A .   7 PHE CG   1 1 
       10 2537 1 1  6 PHE CZ   C  -7.168 -1.553   4.753 1.00 . A A .   7 PHE CZ   1 1 
       10 2538 1 1  6 PHE H    H  -4.667 -2.481   0.624 1.00 . A A .   7 PHE H    1 1 
       10 2539 1 1  6 PHE HA   H  -6.614 -4.693   0.685 1.00 . A A .   7 PHE HA   1 1 
       10 2540 1 1  6 PHE HB2  H  -7.253 -1.815   0.033 1.00 . A A .   7 PHE HB2  1 1 
       10 2541 1 1  6 PHE HB3  H  -8.374 -3.109   0.444 1.00 . A A .   7 PHE HB3  1 1 
       10 2542 1 1  6 PHE HD1  H  -6.481 -0.383   1.670 1.00 . A A .   7 PHE HD1  1 1 
       10 2543 1 1  6 PHE HD2  H  -8.158 -4.123   2.808 1.00 . A A .   7 PHE HD2  1 1 
       10 2544 1 1  6 PHE HE1  H  -6.333  0.279   4.033 1.00 . A A .   7 PHE HE1  1 1 
       10 2545 1 1  6 PHE HE2  H  -8.019 -3.469   5.178 1.00 . A A .   7 PHE HE2  1 1 
       10 2546 1 1  6 PHE HZ   H  -7.103 -1.265   5.791 1.00 . A A .   7 PHE HZ   1 1 
       10 2547 1 1  6 PHE N    N  -5.037 -3.368   0.817 1.00 . A A .   7 PHE N    1 1 
       10 2548 1 1  6 PHE O    O  -7.138 -4.523  -1.867 1.00 . A A .   7 PHE O    1 1 
       10 2549 1 1  7 DTR C    C  -4.891 -2.024  -3.935 1.00 . A A .   8 DTR C    1 1 
       10 2550 1 1  7 DTR CA   C  -5.104 -3.406  -3.314 1.00 . A A .   8 DTR CA   1 1 
       10 2551 1 1  7 DTR CB   C  -3.937 -4.335  -3.674 1.00 . A A .   8 DTR CB   1 1 
       10 2552 1 1  7 DTR CD1  C  -4.395 -5.341  -5.987 1.00 . A A .   8 DTR CD1  1 1 
       10 2553 1 1  7 DTR CD2  C  -2.802 -3.767  -5.972 1.00 . A A .   8 DTR CD2  1 1 
       10 2554 1 1  7 DTR CE2  C  -2.963 -4.230  -7.290 1.00 . A A .   8 DTR CE2  1 1 
       10 2555 1 1  7 DTR CE3  C  -1.852 -2.772  -5.720 1.00 . A A .   8 DTR CE3  1 1 
       10 2556 1 1  7 DTR CG   C  -3.732 -4.489  -5.152 1.00 . A A .   8 DTR CG   1 1 
       10 2557 1 1  7 DTR CH2  C  -1.290 -2.760  -8.076 1.00 . A A .   8 DTR CH2  1 1 
       10 2558 1 1  7 DTR CZ2  C  -2.211 -3.734  -8.351 1.00 . A A .   8 DTR CZ2  1 1 
       10 2559 1 1  7 DTR CZ3  C  -1.106 -2.280  -6.775 1.00 . A A .   8 DTR CZ3  1 1 
       10 2560 1 1  7 DTR H    H  -4.594 -2.818  -1.354 1.00 . A A .   8 DTR H    1 1 
       10 2561 1 1  7 DTR HA   H  -5.993 -3.872  -3.721 1.00 . A A .   8 DTR HA   1 1 
       10 2562 1 1  7 DTR HB2  H  -3.027 -3.938  -3.249 1.00 . A A .   8 DTR HB2  1 1 
       10 2563 1 1  7 DTR HB3  H  -4.127 -5.315  -3.257 1.00 . A A .   8 DTR HB3  1 1 
       10 2564 1 1  7 DTR HD1  H  -5.167 -6.027  -5.670 1.00 . A A .   8 DTR HD1  1 1 
       10 2565 1 1  7 DTR HE1  H  -4.265 -5.694  -8.059 1.00 . A A .   8 DTR HE1  1 1 
       10 2566 1 1  7 DTR HE3  H  -1.696 -2.387  -4.723 1.00 . A A .   8 DTR HE3  1 1 
       10 2567 1 1  7 DTR HH2  H  -0.683 -2.348  -8.870 1.00 . A A .   8 DTR HH2  1 1 
       10 2568 1 1  7 DTR HZ2  H  -2.345 -4.088  -9.361 1.00 . A A .   8 DTR HZ2  1 1 
       10 2569 1 1  7 DTR HZ3  H  -0.368 -1.511  -6.599 1.00 . A A .   8 DTR HZ3  1 1 
       10 2570 1 1  7 DTR N    N  -5.255 -3.317  -1.876 1.00 . A A .   8 DTR N    1 1 
       10 2571 1 1  7 DTR NE1  N  -3.940 -5.190  -7.273 1.00 . A A .   8 DTR NE1  1 1 
       10 2572 1 1  7 DTR O    O  -3.982 -1.302  -3.525 1.00 . A A .   8 DTR O    1 1 
       10 2573 1 1  8 LYS C    C  -6.174  0.786  -4.966 1.00 . A A .   9 LYS C    1 1 
       10 2574 1 1  8 LYS CA   C  -5.498 -0.400  -5.640 1.00 . A A .   9 LYS CA   1 1 
       10 2575 1 1  8 LYS CB   C  -6.011 -0.531  -7.076 1.00 . A A .   9 LYS CB   1 1 
       10 2576 1 1  8 LYS CD   C  -5.953 -1.760  -9.259 1.00 . A A .   9 LYS CD   1 1 
       10 2577 1 1  8 LYS CE   C  -5.402 -2.951 -10.024 1.00 . A A .   9 LYS CE   1 1 
       10 2578 1 1  8 LYS CG   C  -5.460 -1.733  -7.821 1.00 . A A .   9 LYS CG   1 1 
       10 2579 1 1  8 LYS H    H  -6.508 -2.182  -5.121 1.00 . A A .   9 LYS H    1 1 
       10 2580 1 1  8 LYS HA   H  -4.433 -0.225  -5.664 1.00 . A A .   9 LYS HA   1 1 
       10 2581 1 1  8 LYS HB2  H  -7.088 -0.610  -7.057 1.00 . A A .   9 LYS HB2  1 1 
       10 2582 1 1  8 LYS HB3  H  -5.733  0.357  -7.625 1.00 . A A .   9 LYS HB3  1 1 
       10 2583 1 1  8 LYS HD2  H  -7.030 -1.815  -9.259 1.00 . A A .   9 LYS HD2  1 1 
       10 2584 1 1  8 LYS HD3  H  -5.639 -0.850  -9.752 1.00 . A A .   9 LYS HD3  1 1 
       10 2585 1 1  8 LYS HE2  H  -4.323 -2.907 -10.008 1.00 . A A .   9 LYS HE2  1 1 
       10 2586 1 1  8 LYS HE3  H  -5.731 -3.859  -9.539 1.00 . A A .   9 LYS HE3  1 1 
       10 2587 1 1  8 LYS HG2  H  -4.381 -1.682  -7.819 1.00 . A A .   9 LYS HG2  1 1 
       10 2588 1 1  8 LYS HG3  H  -5.784 -2.634  -7.321 1.00 . A A .   9 LYS HG3  1 1 
       10 2589 1 1  8 LYS HZ1  H  -6.902 -3.012 -11.478 1.00 . A A .   9 LYS HZ1  1 1 
       10 2590 1 1  8 LYS HZ2  H  -5.463 -3.790 -11.938 1.00 . A A .   9 LYS HZ2  1 1 
       10 2591 1 1  8 LYS HZ3  H  -5.545 -2.098 -11.924 1.00 . A A .   9 LYS HZ3  1 1 
       10 2592 1 1  8 LYS N    N  -5.729 -1.634  -4.899 1.00 . A A .   9 LYS N    1 1 
       10 2593 1 1  8 LYS NZ   N  -5.862 -2.964 -11.438 1.00 . A A .   9 LYS NZ   1 1 
       10 2594 1 1  8 LYS O    O  -5.997  1.930  -5.387 1.00 . A A .   9 LYS O    1 1 
       10 2595 1 1  9 THR C    C  -6.717  2.256  -2.216 1.00 . A A .  10 THR C    1 1 
       10 2596 1 1  9 THR CA   C  -7.649  1.578  -3.219 1.00 . A A .  10 THR CA   1 1 
       10 2597 1 1  9 THR CB   C  -8.875  1.020  -2.473 1.00 . A A .  10 THR CB   1 1 
       10 2598 1 1  9 THR CG2  C  -9.764  2.144  -1.960 1.00 . A A .  10 THR CG2  1 1 
       10 2599 1 1  9 THR H    H  -7.094 -0.412  -3.660 1.00 . A A .  10 THR H    1 1 
       10 2600 1 1  9 THR HA   H  -7.988  2.306  -3.939 1.00 . A A .  10 THR HA   1 1 
       10 2601 1 1  9 THR HB   H  -8.532  0.437  -1.629 1.00 . A A .  10 THR HB   1 1 
       10 2602 1 1  9 THR HG1  H -10.573  0.365  -3.248 1.00 . A A .  10 THR HG1  1 1 
       10 2603 1 1  9 THR HG21 H -10.097  2.748  -2.792 1.00 . A A .  10 THR HG21 1 1 
       10 2604 1 1  9 THR HG22 H  -9.207  2.758  -1.267 1.00 . A A .  10 THR HG22 1 1 
       10 2605 1 1  9 THR HG23 H -10.621  1.721  -1.458 1.00 . A A .  10 THR HG23 1 1 
       10 2606 1 1  9 THR N    N  -6.959  0.516  -3.933 1.00 . A A .  10 THR N    1 1 
       10 2607 1 1  9 THR O    O  -6.737  3.478  -2.063 1.00 . A A .  10 THR O    1 1 
       10 2608 1 1  9 THR OG1  O  -9.628  0.175  -3.351 1.00 . A A .  10 THR OG1  1 1 
       10 2609 1 1 10 PHE C    C  -3.528  1.389  -0.887 1.00 . A A .  11 PHE C    1 1 
       10 2610 1 1 10 PHE CA   C  -4.924  2.001  -0.604 1.00 . A A .  11 PHE CA   1 1 
       10 2611 1 1 10 PHE CB   C  -5.343  1.658   0.832 1.00 . A A .  11 PHE CB   1 1 
       10 2612 1 1 10 PHE CD1  C  -3.359  2.877   1.818 1.00 . A A .  11 PHE CD1  1 1 
       10 2613 1 1 10 PHE CD2  C  -5.435  2.941   2.989 1.00 . A A .  11 PHE CD2  1 1 
       10 2614 1 1 10 PHE CE1  C  -2.777  3.653   2.800 1.00 . A A .  11 PHE CE1  1 1 
       10 2615 1 1 10 PHE CE2  C  -4.857  3.718   3.974 1.00 . A A .  11 PHE CE2  1 1 
       10 2616 1 1 10 PHE CG   C  -4.697  2.512   1.897 1.00 . A A .  11 PHE CG   1 1 
       10 2617 1 1 10 PHE CZ   C  -3.525  4.074   3.881 1.00 . A A .  11 PHE CZ   1 1 
       10 2618 1 1 10 PHE H    H  -5.937  0.494  -1.677 1.00 . A A .  11 PHE H    1 1 
       10 2619 1 1 10 PHE HA   H  -4.922  3.075  -0.708 1.00 . A A .  11 PHE HA   1 1 
       10 2620 1 1 10 PHE HB2  H  -6.413  1.775   0.922 1.00 . A A .  11 PHE HB2  1 1 
       10 2621 1 1 10 PHE HB3  H  -5.084  0.629   1.034 1.00 . A A .  11 PHE HB3  1 1 
       10 2622 1 1 10 PHE HD1  H  -2.771  2.553   0.973 1.00 . A A .  11 PHE HD1  1 1 
       10 2623 1 1 10 PHE HD2  H  -6.476  2.664   3.066 1.00 . A A .  11 PHE HD2  1 1 
       10 2624 1 1 10 PHE HE1  H  -1.736  3.930   2.725 1.00 . A A .  11 PHE HE1  1 1 
       10 2625 1 1 10 PHE HE2  H  -5.445  4.048   4.820 1.00 . A A .  11 PHE HE2  1 1 
       10 2626 1 1 10 PHE HZ   H  -3.072  4.682   4.650 1.00 . A A .  11 PHE HZ   1 1 
       10 2627 1 1 10 PHE N    N  -5.897  1.460  -1.537 1.00 . A A .  11 PHE N    1 1 
       10 2628 1 1 10 PHE O    O  -3.348  0.193  -0.642 1.00 . A A .  11 PHE O    1 1 
       10 2629 1 1 11 THR C    C  -0.246  2.729  -0.882 1.00 . A A .  12 THR C    1 1 
       10 2630 1 1 11 THR CA   C  -1.184  1.661  -1.447 1.00 . A A .  12 THR CA   1 1 
       10 2631 1 1 11 THR CB   C  -0.752  1.229  -2.874 1.00 . A A .  12 THR CB   1 1 
       10 2632 1 1 11 THR CG2  C  -0.824  2.383  -3.869 1.00 . A A .  12 THR CG2  1 1 
       10 2633 1 1 11 THR H    H  -2.738  3.018  -1.821 1.00 . A A .  12 THR H    1 1 
       10 2634 1 1 11 THR HA   H  -1.137  0.792  -0.807 1.00 . A A .  12 THR HA   1 1 
       10 2635 1 1 11 THR HB   H  -1.428  0.452  -3.208 1.00 . A A .  12 THR HB   1 1 
       10 2636 1 1 11 THR HG1  H   1.172  1.270  -3.354 1.00 . A A .  12 THR HG1  1 1 
       10 2637 1 1 11 THR HG21 H  -0.498  2.041  -4.840 1.00 . A A .  12 THR HG21 1 1 
       10 2638 1 1 11 THR HG22 H  -0.185  3.186  -3.536 1.00 . A A .  12 THR HG22 1 1 
       10 2639 1 1 11 THR HG23 H  -1.842  2.738  -3.936 1.00 . A A .  12 THR HG23 1 1 
       10 2640 1 1 11 THR N    N  -2.549  2.146  -1.414 1.00 . A A .  12 THR N    1 1 
       10 2641 1 1 11 THR O    O  -0.185  3.853  -1.385 1.00 . A A .  12 THR O    1 1 
       10 2642 1 1 11 THR OG1  O   0.579  0.692  -2.848 1.00 . A A .  12 THR OG1  1 1 
       10 2643 1 1 12 SER C    C   2.799  2.906   0.618 1.00 . A A .  13 SER C    1 1 
       10 2644 1 1 12 SER CA   C   1.346  3.326   0.840 1.00 . A A .  13 SER CA   1 1 
       10 2645 1 1 12 SER CB   C   1.028  3.401   2.337 1.00 . A A .  13 SER CB   1 1 
       10 2646 1 1 12 SER H    H   0.366  1.478   0.550 1.00 . A A .  13 SER H    1 1 
       10 2647 1 1 12 SER HA   H   1.181  4.296   0.400 1.00 . A A .  13 SER HA   1 1 
       10 2648 1 1 12 SER HB2  H   1.782  3.991   2.834 1.00 . A A .  13 SER HB2  1 1 
       10 2649 1 1 12 SER HB3  H   0.062  3.864   2.473 1.00 . A A .  13 SER HB3  1 1 
       10 2650 1 1 12 SER HG   H   1.582  1.524   2.424 1.00 . A A .  13 SER HG   1 1 
       10 2651 1 1 12 SER N    N   0.449  2.389   0.190 1.00 . A A .  13 SER N    1 1 
       10 2652 1 1 12 SER O    O   3.191  1.797   0.986 1.00 . A A .  13 SER O    1 1 
       10 2653 1 1 12 SER OG   O   1.000  2.108   2.921 1.00 . A A .  13 SER OG   1 1 
       10 2654 1 1 13 CYS C    C   5.884  4.580   0.258 1.00 . A A .  14 CYS C    1 1 
       10 2655 1 1 13 CYS CA   C   4.985  3.465  -0.258 1.00 . A A .  14 CYS CA   1 1 
       10 2656 1 1 13 CYS CB   C   5.202  3.252  -1.758 1.00 . A A .  14 CYS CB   1 1 
       10 2657 1 1 13 CYS H    H   3.251  4.668  -0.232 1.00 . A A .  14 CYS H    1 1 
       10 2658 1 1 13 CYS HA   H   5.230  2.552   0.268 1.00 . A A .  14 CYS HA   1 1 
       10 2659 1 1 13 CYS HB2  H   4.482  2.534  -2.123 1.00 . A A .  14 CYS HB2  1 1 
       10 2660 1 1 13 CYS HB3  H   5.060  4.191  -2.273 1.00 . A A .  14 CYS HB3  1 1 
       10 2661 1 1 13 CYS N    N   3.598  3.779   0.018 1.00 . A A .  14 CYS N    1 1 
       10 2662 1 1 13 CYS O    O   5.691  5.753  -0.080 1.00 . A A .  14 CYS O    1 1 
       10 2663 1 1 13 CYS SG   S   6.868  2.635  -2.175 1.00 . A A .  14 CYS SG   1 1 
       10 2664 1 1 14 LYS C    C   8.561  5.903   0.571 1.00 . A A .  15 LYS C    1 1 
       10 2665 1 1 14 LYS CA   C   7.791  5.165   1.659 1.00 . A A .  15 LYS CA   1 1 
       10 2666 1 1 14 LYS CB   C   8.777  4.470   2.604 1.00 . A A .  15 LYS CB   1 1 
       10 2667 1 1 14 LYS CD   C   9.056  6.384   4.212 1.00 . A A .  15 LYS CD   1 1 
       10 2668 1 1 14 LYS CE   C   9.822  7.688   4.371 1.00 . A A .  15 LYS CE   1 1 
       10 2669 1 1 14 LYS CG   C   9.759  5.435   3.253 1.00 . A A .  15 LYS CG   1 1 
       10 2670 1 1 14 LYS H    H   6.969  3.252   1.281 1.00 . A A .  15 LYS H    1 1 
       10 2671 1 1 14 LYS HA   H   7.214  5.881   2.221 1.00 . A A .  15 LYS HA   1 1 
       10 2672 1 1 14 LYS HB2  H   8.222  3.970   3.385 1.00 . A A .  15 LYS HB2  1 1 
       10 2673 1 1 14 LYS HB3  H   9.341  3.737   2.045 1.00 . A A .  15 LYS HB3  1 1 
       10 2674 1 1 14 LYS HD2  H   8.070  6.604   3.830 1.00 . A A .  15 LYS HD2  1 1 
       10 2675 1 1 14 LYS HD3  H   8.972  5.908   5.178 1.00 . A A .  15 LYS HD3  1 1 
       10 2676 1 1 14 LYS HE2  H   9.408  8.236   5.203 1.00 . A A .  15 LYS HE2  1 1 
       10 2677 1 1 14 LYS HE3  H  10.859  7.460   4.571 1.00 . A A .  15 LYS HE3  1 1 
       10 2678 1 1 14 LYS HG2  H  10.497  4.869   3.799 1.00 . A A .  15 LYS HG2  1 1 
       10 2679 1 1 14 LYS HG3  H  10.244  6.013   2.483 1.00 . A A .  15 LYS HG3  1 1 
       10 2680 1 1 14 LYS HZ1  H  10.133  8.018   2.328 1.00 . A A .  15 LYS HZ1  1 1 
       10 2681 1 1 14 LYS HZ2  H  10.274  9.415   3.275 1.00 . A A .  15 LYS HZ2  1 1 
       10 2682 1 1 14 LYS HZ3  H   8.742  8.768   2.942 1.00 . A A .  15 LYS HZ3  1 1 
       10 2683 1 1 14 LYS N    N   6.863  4.206   1.074 1.00 . A A .  15 LYS N    1 1 
       10 2684 1 1 14 LYS NZ   N   9.738  8.529   3.144 1.00 . A A .  15 LYS NZ   1 1 
       10 2685 1 1 14 LYS O    O   9.063  5.240  -0.358 1.00 . A A .  15 LYS O    1 1 
       10 2686 1 1 14 LYS OXT  O   8.675  7.144   0.658 1.00 . A A .  15 LYS OXT  1 1 
       10 2687 2 2  1 .   C1   C   9.107 -2.503   0.231 1.00 . B A . 101 OCA C1   1 1 
       10 2688 2 2  1 .   C2   C   8.248 -2.539   1.492 1.00 . B A . 101 OCA C2   1 1 
       10 2689 2 2  1 .   C3   C   9.062 -2.511   2.774 1.00 . B A . 101 OCA C3   1 1 
       10 2690 2 2  1 .   C4   C   8.329 -1.765   3.878 1.00 . B A . 101 OCA C4   1 1 
       10 2691 2 2  1 .   C5   C   9.293 -1.180   4.898 1.00 . B A . 101 OCA C5   1 1 
       10 2692 2 2  1 .   C6   C   9.662  0.257   4.565 1.00 . B A . 101 OCA C6   1 1 
       10 2693 2 2  1 .   C7   C  11.018  0.339   3.883 1.00 . B A . 101 OCA C7   1 1 
       10 2694 2 2  1 .   C8   C  11.403  1.766   3.565 1.00 . B A . 101 OCA C8   1 1 
       10 2695 2 2  1 .   H21  H   7.656 -3.443   1.479 1.00 . B A . 101 OCA H21  1 1 
       10 2696 2 2  1 .   H22  H   7.590 -1.682   1.483 1.00 . B A . 101 OCA H22  1 1 
       10 2697 2 2  1 .   H31  H   9.245 -3.526   3.099 1.00 . B A . 101 OCA H31  1 1 
       10 2698 2 2  1 .   H32  H  10.002 -2.017   2.581 1.00 . B A . 101 OCA H32  1 1 
       10 2699 2 2  1 .   H41  H   7.757 -0.961   3.438 1.00 . B A . 101 OCA H41  1 1 
       10 2700 2 2  1 .   H42  H   7.663 -2.450   4.380 1.00 . B A . 101 OCA H42  1 1 
       10 2701 2 2  1 .   H51  H   8.828 -1.204   5.872 1.00 . B A . 101 OCA H51  1 1 
       10 2702 2 2  1 .   H52  H  10.192 -1.777   4.910 1.00 . B A . 101 OCA H52  1 1 
       10 2703 2 2  1 .   H61  H   8.911  0.667   3.906 1.00 . B A . 101 OCA H61  1 1 
       10 2704 2 2  1 .   H62  H   9.694  0.831   5.480 1.00 . B A . 101 OCA H62  1 1 
       10 2705 2 2  1 .   H71  H  11.770 -0.081   4.536 1.00 . B A . 101 OCA H71  1 1 
       10 2706 2 2  1 .   H72  H  10.982 -0.218   2.959 1.00 . B A . 101 OCA H72  1 1 
       10 2707 2 2  1 .   H81  H  11.315  2.370   4.456 1.00 . B A . 101 OCA H81  1 1 
       10 2708 2 2  1 .   H82  H  10.744  2.153   2.800 1.00 . B A . 101 OCA H82  1 1 
       10 2709 2 2  1 .   H83  H  12.423  1.793   3.210 1.00 . B A . 101 OCA H83  1 1 
       10 2710 2 2  1 .   O1   O   9.568 -3.504  -0.317 1.00 . B A . 101 OCA O1   1 1 
       11 2711 1 1  1 PRO C    C   7.227  0.410   0.024 1.00 . A A .   2 PRO C    1 1 
       11 2712 1 1  1 PRO CA   C   8.700  0.063   0.221 1.00 . A A .   2 PRO CA   1 1 
       11 2713 1 1  1 PRO CB   C   9.567  0.871  -0.735 1.00 . A A .   2 PRO CB   1 1 
       11 2714 1 1  1 PRO CD   C   9.409 -1.392  -1.578 1.00 . A A .   2 PRO CD   1 1 
       11 2715 1 1  1 PRO CG   C   9.617  0.052  -1.985 1.00 . A A .   2 PRO CG   1 1 
       11 2716 1 1  1 PRO HA   H   8.989  0.276   1.240 1.00 . A A .   2 PRO HA   1 1 
       11 2717 1 1  1 PRO HB2  H   9.112  1.835  -0.909 1.00 . A A .   2 PRO HB2  1 1 
       11 2718 1 1  1 PRO HB3  H  10.552  1.002  -0.312 1.00 . A A .   2 PRO HB3  1 1 
       11 2719 1 1  1 PRO HD2  H   8.620 -1.836  -2.165 1.00 . A A .   2 PRO HD2  1 1 
       11 2720 1 1  1 PRO HD3  H  10.327 -1.951  -1.695 1.00 . A A .   2 PRO HD3  1 1 
       11 2721 1 1  1 PRO HG2  H   8.831  0.365  -2.655 1.00 . A A .   2 PRO HG2  1 1 
       11 2722 1 1  1 PRO HG3  H  10.581  0.169  -2.459 1.00 . A A .   2 PRO HG3  1 1 
       11 2723 1 1  1 PRO N    N   9.021 -1.314  -0.157 1.00 . A A .   2 PRO N    1 1 
       11 2724 1 1  1 PRO O    O   6.770  1.462   0.451 1.00 . A A .   2 PRO O    1 1 
       11 2725 1 1  2 CYS C    C   4.253 -1.368  -0.270 1.00 . A A .   3 CYS C    1 1 
       11 2726 1 1  2 CYS CA   C   5.079 -0.245  -0.877 1.00 . A A .   3 CYS CA   1 1 
       11 2727 1 1  2 CYS CB   C   4.807 -0.154  -2.378 1.00 . A A .   3 CYS CB   1 1 
       11 2728 1 1  2 CYS H    H   6.907 -1.302  -0.949 1.00 . A A .   3 CYS H    1 1 
       11 2729 1 1  2 CYS HA   H   4.806  0.689  -0.411 1.00 . A A .   3 CYS HA   1 1 
       11 2730 1 1  2 CYS HB2  H   5.116 -1.075  -2.847 1.00 . A A .   3 CYS HB2  1 1 
       11 2731 1 1  2 CYS HB3  H   3.749 -0.012  -2.535 1.00 . A A .   3 CYS HB3  1 1 
       11 2732 1 1  2 CYS N    N   6.492 -0.473  -0.630 1.00 . A A .   3 CYS N    1 1 
       11 2733 1 1  2 CYS O    O   4.437 -2.536  -0.612 1.00 . A A .   3 CYS O    1 1 
       11 2734 1 1  2 CYS SG   S   5.682  1.212  -3.214 1.00 . A A .   3 CYS SG   1 1 
       11 2735 1 1  3 LYS C    C   1.043 -1.730   0.965 1.00 . A A .   4 LYS C    1 1 
       11 2736 1 1  3 LYS CA   C   2.503 -2.014   1.276 1.00 . A A .   4 LYS CA   1 1 
       11 2737 1 1  3 LYS CB   C   2.716 -2.021   2.794 1.00 . A A .   4 LYS CB   1 1 
       11 2738 1 1  3 LYS CD   C   2.632 -4.523   3.010 1.00 . A A .   4 LYS CD   1 1 
       11 2739 1 1  3 LYS CE   C   2.004 -5.693   3.744 1.00 . A A .   4 LYS CE   1 1 
       11 2740 1 1  3 LYS CG   C   2.065 -3.200   3.497 1.00 . A A .   4 LYS CG   1 1 
       11 2741 1 1  3 LYS H    H   3.241 -0.074   0.877 1.00 . A A .   4 LYS H    1 1 
       11 2742 1 1  3 LYS HA   H   2.766 -2.984   0.877 1.00 . A A .   4 LYS HA   1 1 
       11 2743 1 1  3 LYS HB2  H   3.776 -2.046   3.001 1.00 . A A .   4 LYS HB2  1 1 
       11 2744 1 1  3 LYS HB3  H   2.299 -1.113   3.208 1.00 . A A .   4 LYS HB3  1 1 
       11 2745 1 1  3 LYS HD2  H   2.431 -4.624   1.954 1.00 . A A .   4 LYS HD2  1 1 
       11 2746 1 1  3 LYS HD3  H   3.698 -4.533   3.180 1.00 . A A .   4 LYS HD3  1 1 
       11 2747 1 1  3 LYS HE2  H   2.176 -5.569   4.802 1.00 . A A .   4 LYS HE2  1 1 
       11 2748 1 1  3 LYS HE3  H   0.942 -5.693   3.551 1.00 . A A .   4 LYS HE3  1 1 
       11 2749 1 1  3 LYS HG2  H   2.240 -3.114   4.559 1.00 . A A .   4 LYS HG2  1 1 
       11 2750 1 1  3 LYS HG3  H   1.003 -3.179   3.303 1.00 . A A .   4 LYS HG3  1 1 
       11 2751 1 1  3 LYS HZ1  H   2.197 -7.764   3.907 1.00 . A A .   4 LYS HZ1  1 1 
       11 2752 1 1  3 LYS HZ2  H   3.614 -6.985   3.394 1.00 . A A .   4 LYS HZ2  1 1 
       11 2753 1 1  3 LYS HZ3  H   2.319 -7.192   2.321 1.00 . A A .   4 LYS HZ3  1 1 
       11 2754 1 1  3 LYS N    N   3.350 -1.021   0.638 1.00 . A A .   4 LYS N    1 1 
       11 2755 1 1  3 LYS NZ   N   2.574 -6.996   3.311 1.00 . A A .   4 LYS NZ   1 1 
       11 2756 1 1  3 LYS O    O   0.494 -0.713   1.392 1.00 . A A .   4 LYS O    1 1 
       11 2757 1 1  4 ASN C    C  -1.769 -3.570   0.657 1.00 . A A .   5 ASN C    1 1 
       11 2758 1 1  4 ASN CA   C  -0.997 -2.474  -0.077 1.00 . A A .   5 ASN CA   1 1 
       11 2759 1 1  4 ASN CB   C  -1.247 -2.600  -1.585 1.00 . A A .   5 ASN CB   1 1 
       11 2760 1 1  4 ASN CG   C  -0.394 -1.654  -2.412 1.00 . A A .   5 ASN CG   1 1 
       11 2761 1 1  4 ASN H    H   0.918 -3.367  -0.174 1.00 . A A .   5 ASN H    1 1 
       11 2762 1 1  4 ASN HA   H  -1.317 -1.498   0.257 1.00 . A A .   5 ASN HA   1 1 
       11 2763 1 1  4 ASN HB2  H  -1.028 -3.610  -1.893 1.00 . A A .   5 ASN HB2  1 1 
       11 2764 1 1  4 ASN HB3  H  -2.287 -2.386  -1.787 1.00 . A A .   5 ASN HB3  1 1 
       11 2765 1 1  4 ASN HD21 H  -1.829 -0.277  -2.393 1.00 . A A .   5 ASN HD21 1 1 
       11 2766 1 1  4 ASN HD22 H  -0.390  0.133  -3.261 1.00 . A A .   5 ASN HD22 1 1 
       11 2767 1 1  4 ASN N    N   0.417 -2.614   0.209 1.00 . A A .   5 ASN N    1 1 
       11 2768 1 1  4 ASN ND2  N  -0.921 -0.480  -2.717 1.00 . A A .   5 ASN ND2  1 1 
       11 2769 1 1  4 ASN O    O  -1.649 -4.746   0.315 1.00 . A A .   5 ASN O    1 1 
       11 2770 1 1  4 ASN OD1  O   0.730 -1.982  -2.783 1.00 . A A .   5 ASN OD1  1 1 
       11 2771 1 1  5 .   C    C  -4.525 -4.633   1.575 1.00 . A A .   6 O6H C    1 1 
       11 2772 1 1  5 .   CA   C  -3.346 -4.161   2.414 1.00 . A A .   6 O6H CA   1 1 
       11 2773 1 1  5 .   CB   C  -3.844 -3.568   3.739 1.00 . A A .   6 O6H CB   1 1 
       11 2774 1 1  5 .   CD1  C  -2.429 -1.713   4.689 1.00 . A A .   6 O6H CD1  1 1 
       11 2775 1 1  5 .   CD2  C  -1.977 -3.942   5.402 1.00 . A A .   6 O6H CD2  1 1 
       11 2776 1 1  5 .   CE1  C  -1.411 -1.241   5.490 1.00 . A A .   6 O6H CE1  1 1 
       11 2777 1 1  5 .   CE2  C  -0.955 -3.480   6.211 1.00 . A A .   6 O6H CE2  1 1 
       11 2778 1 1  5 .   CF1  C  -3.224 -0.741   3.875 1.00 . A A .   6 O6H CF1  1 1 
       11 2779 1 1  5 .   CF2  C  -2.269 -5.415   5.367 1.00 . A A .   6 O6H CF2  1 1 
       11 2780 1 1  5 .   CG   C  -2.734 -3.068   4.627 1.00 . A A .   6 O6H CG   1 1 
       11 2781 1 1  5 .   CH   C   0.427 -1.617   7.118 1.00 . A A .   6 O6H CH   1 1 
       11 2782 1 1  5 .   CZ   C  -0.679 -2.128   6.249 1.00 . A A .   6 O6H CZ   1 1 
       11 2783 1 1  5 .   H1   H  -2.523 -2.267   1.986 1.00 . A A .   6 O6H H1   1 1 
       11 2784 1 1  5 .   HA   H  -2.724 -5.015   2.633 1.00 . A A .   6 O6H HA   1 1 
       11 2785 1 1  5 .   HB1  H  -4.388 -4.328   4.282 1.00 . A A .   6 O6H HB1  1 1 
       11 2786 1 1  5 .   HB2  H  -4.502 -2.740   3.531 1.00 . A A .   6 O6H HB2  1 1 
       11 2787 1 1  5 .   HE1  H  -1.189 -0.184   5.525 1.00 . A A .   6 O6H HE1  1 1 
       11 2788 1 1  5 .   HE2  H  -0.377 -4.172   6.807 1.00 . A A .   6 O6H HE2  1 1 
       11 2789 1 1  5 .   HF11 H  -4.079 -1.191   3.392 1.00 . A A .   6 O6H HF11 1 1 
       11 2790 1 1  5 .   HF12 H  -2.656 -0.283   3.081 1.00 . A A .   6 O6H HF12 1 1 
       11 2791 1 1  5 .   HF13 H  -3.621  0.079   4.455 1.00 . A A .   6 O6H HF13 1 1 
       11 2792 1 1  5 .   HF21 H  -1.510 -5.990   4.854 1.00 . A A .   6 O6H HF21 1 1 
       11 2793 1 1  5 .   HF22 H  -2.348 -5.861   6.347 1.00 . A A .   6 O6H HF22 1 1 
       11 2794 1 1  5 .   HF23 H  -3.196 -5.659   4.866 1.00 . A A .   6 O6H HF23 1 1 
       11 2795 1 1  5 .   HH1  H   0.283 -1.831   8.166 1.00 . A A .   6 O6H HH1  1 1 
       11 2796 1 1  5 .   HH2  H   0.555 -0.545   7.060 1.00 . A A .   6 O6H HH2  1 1 
       11 2797 1 1  5 .   HH3  H   1.392 -2.034   6.871 1.00 . A A .   6 O6H HH3  1 1 
       11 2798 1 1  5 .   N    N  -2.528 -3.199   1.689 1.00 . A A .   6 O6H N    1 1 
       11 2799 1 1  5 .   O    O  -4.872 -5.813   1.583 1.00 . A A .   6 O6H O    1 1 
       11 2800 1 1  6 PHE C    C  -6.245 -4.052  -1.325 1.00 . A A .   7 PHE C    1 1 
       11 2801 1 1  6 PHE CA   C  -6.401 -3.963   0.188 1.00 . A A .   7 PHE CA   1 1 
       11 2802 1 1  6 PHE CB   C  -7.409 -2.864   0.536 1.00 . A A .   7 PHE CB   1 1 
       11 2803 1 1  6 PHE CD1  C  -7.056 -1.221   2.391 1.00 . A A .   7 PHE CD1  1 1 
       11 2804 1 1  6 PHE CD2  C  -7.778 -3.420   2.958 1.00 . A A .   7 PHE CD2  1 1 
       11 2805 1 1  6 PHE CE1  C  -7.048 -0.874   3.728 1.00 . A A .   7 PHE CE1  1 1 
       11 2806 1 1  6 PHE CE2  C  -7.775 -3.078   4.297 1.00 . A A .   7 PHE CE2  1 1 
       11 2807 1 1  6 PHE CG   C  -7.419 -2.494   1.992 1.00 . A A .   7 PHE CG   1 1 
       11 2808 1 1  6 PHE CZ   C  -7.408 -1.803   4.682 1.00 . A A .   7 PHE CZ   1 1 
       11 2809 1 1  6 PHE H    H  -4.711 -2.823   0.757 1.00 . A A .   7 PHE H    1 1 
       11 2810 1 1  6 PHE HA   H  -6.773 -4.908   0.554 1.00 . A A .   7 PHE HA   1 1 
       11 2811 1 1  6 PHE HB2  H  -7.172 -1.978  -0.031 1.00 . A A .   7 PHE HB2  1 1 
       11 2812 1 1  6 PHE HB3  H  -8.401 -3.202   0.270 1.00 . A A .   7 PHE HB3  1 1 
       11 2813 1 1  6 PHE HD1  H  -6.776 -0.493   1.646 1.00 . A A .   7 PHE HD1  1 1 
       11 2814 1 1  6 PHE HD2  H  -8.065 -4.416   2.657 1.00 . A A .   7 PHE HD2  1 1 
       11 2815 1 1  6 PHE HE1  H  -6.766  0.127   4.027 1.00 . A A .   7 PHE HE1  1 1 
       11 2816 1 1  6 PHE HE2  H  -8.058 -3.806   5.041 1.00 . A A .   7 PHE HE2  1 1 
       11 2817 1 1  6 PHE HZ   H  -7.397 -1.536   5.727 1.00 . A A .   7 PHE HZ   1 1 
       11 2818 1 1  6 PHE N    N  -5.126 -3.704   0.844 1.00 . A A .   7 PHE N    1 1 
       11 2819 1 1  6 PHE O    O  -7.118 -4.581  -2.012 1.00 . A A .   7 PHE O    1 1 
       11 2820 1 1  7 DTR C    C  -4.679 -2.142  -3.848 1.00 . A A .   8 DTR C    1 1 
       11 2821 1 1  7 DTR CA   C  -4.906 -3.545  -3.273 1.00 . A A .   8 DTR CA   1 1 
       11 2822 1 1  7 DTR CB   C  -3.697 -4.443  -3.568 1.00 . A A .   8 DTR CB   1 1 
       11 2823 1 1  7 DTR CD1  C  -4.009 -5.558  -5.848 1.00 . A A .   8 DTR CD1  1 1 
       11 2824 1 1  7 DTR CD2  C  -2.537 -3.874  -5.849 1.00 . A A .   8 DTR CD2  1 1 
       11 2825 1 1  7 DTR CE2  C  -2.623 -4.394  -7.153 1.00 . A A .   8 DTR CE2  1 1 
       11 2826 1 1  7 DTR CE3  C  -1.671 -2.803  -5.606 1.00 . A A .   8 DTR CE3  1 1 
       11 2827 1 1  7 DTR CG   C  -3.436 -4.630  -5.030 1.00 . A A .   8 DTR CG   1 1 
       11 2828 1 1  7 DTR CH2  C  -1.037 -2.833  -7.942 1.00 . A A .   8 DTR CH2  1 1 
       11 2829 1 1  7 DTR CZ2  C  -1.877 -3.880  -8.209 1.00 . A A .   8 DTR CZ2  1 1 
       11 2830 1 1  7 DTR CZ3  C  -0.929 -2.295  -6.655 1.00 . A A .   8 DTR CZ3  1 1 
       11 2831 1 1  7 DTR H    H  -4.507 -3.074  -1.258 1.00 . A A .   8 DTR H    1 1 
       11 2832 1 1  7 DTR HA   H  -5.751 -4.021  -3.753 1.00 . A A .   8 DTR HA   1 1 
       11 2833 1 1  7 DTR HB2  H  -2.816 -3.999  -3.127 1.00 . A A .   8 DTR HB2  1 1 
       11 2834 1 1  7 DTR HB3  H  -3.862 -5.415  -3.129 1.00 . A A .   8 DTR HB3  1 1 
       11 2835 1 1  7 DTR HD1  H  -4.737 -6.287  -5.524 1.00 . A A .   8 DTR HD1  1 1 
       11 2836 1 1  7 DTR HE1  H  -3.795 -5.979  -7.901 1.00 . A A .   8 DTR HE1  1 1 
       11 2837 1 1  7 DTR HE3  H  -1.573 -2.375  -4.618 1.00 . A A .   8 DTR HE3  1 1 
       11 2838 1 1  7 DTR HH2  H  -0.438 -2.404  -8.732 1.00 . A A .   8 DTR HH2  1 1 
       11 2839 1 1  7 DTR HZ2  H  -1.951 -4.278  -9.208 1.00 . A A .   8 DTR HZ2  1 1 
       11 2840 1 1  7 DTR HZ3  H  -0.254 -1.469  -6.483 1.00 . A A .   8 DTR HZ3  1 1 
       11 2841 1 1  7 DTR N    N  -5.159 -3.503  -1.846 1.00 . A A .   8 DTR N    1 1 
       11 2842 1 1  7 DTR NE1  N  -3.529 -5.422  -7.127 1.00 . A A .   8 DTR NE1  1 1 
       11 2843 1 1  7 DTR O    O  -3.827 -1.405  -3.353 1.00 . A A .   8 DTR O    1 1 
       11 2844 1 1  8 LYS C    C  -5.934  0.662  -4.937 1.00 . A A .   9 LYS C    1 1 
       11 2845 1 1  8 LYS CA   C  -5.203 -0.509  -5.585 1.00 . A A .   9 LYS CA   1 1 
       11 2846 1 1  8 LYS CB   C  -5.659 -0.654  -7.040 1.00 . A A .   9 LYS CB   1 1 
       11 2847 1 1  8 LYS CD   C  -5.758 -2.092  -9.093 1.00 . A A .   9 LYS CD   1 1 
       11 2848 1 1  8 LYS CE   C  -5.237 -3.347  -9.777 1.00 . A A .   9 LYS CE   1 1 
       11 2849 1 1  8 LYS CG   C  -5.107 -1.886  -7.736 1.00 . A A .   9 LYS CG   1 1 
       11 2850 1 1  8 LYS H    H  -6.226 -2.300  -5.128 1.00 . A A .   9 LYS H    1 1 
       11 2851 1 1  8 LYS HA   H  -4.141 -0.320  -5.564 1.00 . A A .   9 LYS HA   1 1 
       11 2852 1 1  8 LYS HB2  H  -6.737 -0.707  -7.064 1.00 . A A .   9 LYS HB2  1 1 
       11 2853 1 1  8 LYS HB3  H  -5.339  0.214  -7.594 1.00 . A A .   9 LYS HB3  1 1 
       11 2854 1 1  8 LYS HD2  H  -6.825 -2.184  -8.958 1.00 . A A .   9 LYS HD2  1 1 
       11 2855 1 1  8 LYS HD3  H  -5.545 -1.238  -9.718 1.00 . A A .   9 LYS HD3  1 1 
       11 2856 1 1  8 LYS HE2  H  -4.181 -3.227  -9.972 1.00 . A A .   9 LYS HE2  1 1 
       11 2857 1 1  8 LYS HE3  H  -5.388 -4.190  -9.119 1.00 . A A .   9 LYS HE3  1 1 
       11 2858 1 1  8 LYS HG2  H  -4.043 -1.763  -7.872 1.00 . A A .   9 LYS HG2  1 1 
       11 2859 1 1  8 LYS HG3  H  -5.295 -2.752  -7.118 1.00 . A A .   9 LYS HG3  1 1 
       11 2860 1 1  8 LYS HZ1  H  -5.824 -2.794 -11.709 1.00 . A A .   9 LYS HZ1  1 1 
       11 2861 1 1  8 LYS HZ2  H  -6.957 -3.760 -10.891 1.00 . A A .   9 LYS HZ2  1 1 
       11 2862 1 1  8 LYS HZ3  H  -5.545 -4.456 -11.519 1.00 . A A .   9 LYS HZ3  1 1 
       11 2863 1 1  8 LYS N    N  -5.462 -1.749  -4.859 1.00 . A A .   9 LYS N    1 1 
       11 2864 1 1  8 LYS NZ   N  -5.938 -3.607 -11.063 1.00 . A A .   9 LYS NZ   1 1 
       11 2865 1 1  8 LYS O    O  -5.791  1.811  -5.355 1.00 . A A .   9 LYS O    1 1 
       11 2866 1 1  9 THR C    C  -6.606  2.161  -2.238 1.00 . A A .  10 THR C    1 1 
       11 2867 1 1  9 THR CA   C  -7.483  1.377  -3.214 1.00 . A A .  10 THR CA   1 1 
       11 2868 1 1  9 THR CB   C  -8.653  0.732  -2.454 1.00 . A A .  10 THR CB   1 1 
       11 2869 1 1  9 THR CG2  C  -9.692  1.773  -2.057 1.00 . A A .  10 THR CG2  1 1 
       11 2870 1 1  9 THR H    H  -6.773 -0.571  -3.615 1.00 . A A .  10 THR H    1 1 
       11 2871 1 1  9 THR HA   H  -7.884  2.055  -3.952 1.00 . A A .  10 THR HA   1 1 
       11 2872 1 1  9 THR HB   H  -8.271  0.262  -1.558 1.00 . A A .  10 THR HB   1 1 
       11 2873 1 1  9 THR HG1  H  -9.371  0.090  -4.183 1.00 . A A .  10 THR HG1  1 1 
       11 2874 1 1  9 THR HG21 H -10.503  1.289  -1.534 1.00 . A A .  10 THR HG21 1 1 
       11 2875 1 1  9 THR HG22 H -10.074  2.257  -2.944 1.00 . A A .  10 THR HG22 1 1 
       11 2876 1 1  9 THR HG23 H  -9.236  2.510  -1.413 1.00 . A A .  10 THR HG23 1 1 
       11 2877 1 1  9 THR N    N  -6.706  0.361  -3.905 1.00 . A A .  10 THR N    1 1 
       11 2878 1 1  9 THR O    O  -6.714  3.382  -2.132 1.00 . A A .  10 THR O    1 1 
       11 2879 1 1  9 THR OG1  O  -9.265 -0.262  -3.285 1.00 . A A .  10 THR OG1  1 1 
       11 2880 1 1 10 PHE C    C  -3.379  2.065  -1.152 1.00 . A A .  11 PHE C    1 1 
       11 2881 1 1 10 PHE CA   C  -4.826  2.100  -0.596 1.00 . A A .  11 PHE CA   1 1 
       11 2882 1 1 10 PHE CB   C  -4.879  1.350   0.739 1.00 . A A .  11 PHE CB   1 1 
       11 2883 1 1 10 PHE CD1  C  -5.051  2.727   2.833 1.00 . A A .  11 PHE CD1  1 1 
       11 2884 1 1 10 PHE CD2  C  -2.875  2.188   2.016 1.00 . A A .  11 PHE CD2  1 1 
       11 2885 1 1 10 PHE CE1  C  -4.486  3.417   3.889 1.00 . A A .  11 PHE CE1  1 1 
       11 2886 1 1 10 PHE CE2  C  -2.306  2.879   3.068 1.00 . A A .  11 PHE CE2  1 1 
       11 2887 1 1 10 PHE CG   C  -4.254  2.102   1.885 1.00 . A A .  11 PHE CG   1 1 
       11 2888 1 1 10 PHE CZ   C  -3.112  3.493   4.006 1.00 . A A .  11 PHE CZ   1 1 
       11 2889 1 1 10 PHE H    H  -5.636  0.498  -1.704 1.00 . A A .  11 PHE H    1 1 
       11 2890 1 1 10 PHE HA   H  -5.188  3.105  -0.444 1.00 . A A .  11 PHE HA   1 1 
       11 2891 1 1 10 PHE HB2  H  -5.912  1.158   0.993 1.00 . A A .  11 PHE HB2  1 1 
       11 2892 1 1 10 PHE HB3  H  -4.361  0.408   0.636 1.00 . A A .  11 PHE HB3  1 1 
       11 2893 1 1 10 PHE HD1  H  -6.125  2.668   2.743 1.00 . A A .  11 PHE HD1  1 1 
       11 2894 1 1 10 PHE HD2  H  -2.243  1.711   1.281 1.00 . A A .  11 PHE HD2  1 1 
       11 2895 1 1 10 PHE HE1  H  -5.118  3.898   4.620 1.00 . A A .  11 PHE HE1  1 1 
       11 2896 1 1 10 PHE HE2  H  -1.232  2.936   3.159 1.00 . A A .  11 PHE HE2  1 1 
       11 2897 1 1 10 PHE HZ   H  -2.669  4.031   4.829 1.00 . A A .  11 PHE HZ   1 1 
       11 2898 1 1 10 PHE N    N  -5.714  1.461  -1.551 1.00 . A A .  11 PHE N    1 1 
       11 2899 1 1 10 PHE O    O  -2.912  0.979  -1.492 1.00 . A A .  11 PHE O    1 1 
       11 2900 1 1 11 THR C    C  -0.352  3.883  -0.820 1.00 . A A .  12 THR C    1 1 
       11 2901 1 1 11 THR CA   C  -1.294  3.159  -1.773 1.00 . A A .  12 THR CA   1 1 
       11 2902 1 1 11 THR CB   C  -1.212  3.804  -3.173 1.00 . A A .  12 THR CB   1 1 
       11 2903 1 1 11 THR CG2  C   0.193  3.691  -3.754 1.00 . A A .  12 THR CG2  1 1 
       11 2904 1 1 11 THR H    H  -3.009  4.065  -0.985 1.00 . A A .  12 THR H    1 1 
       11 2905 1 1 11 THR HA   H  -0.992  2.125  -1.852 1.00 . A A .  12 THR HA   1 1 
       11 2906 1 1 11 THR HB   H  -1.469  4.850  -3.088 1.00 . A A .  12 THR HB   1 1 
       11 2907 1 1 11 THR HG1  H  -2.688  2.548  -3.543 1.00 . A A .  12 THR HG1  1 1 
       11 2908 1 1 11 THR HG21 H   0.895  4.180  -3.095 1.00 . A A .  12 THR HG21 1 1 
       11 2909 1 1 11 THR HG22 H   0.220  4.167  -4.723 1.00 . A A .  12 THR HG22 1 1 
       11 2910 1 1 11 THR HG23 H   0.459  2.650  -3.857 1.00 . A A .  12 THR HG23 1 1 
       11 2911 1 1 11 THR N    N  -2.652  3.198  -1.259 1.00 . A A .  12 THR N    1 1 
       11 2912 1 1 11 THR O    O  -0.449  5.098  -0.645 1.00 . A A .  12 THR O    1 1 
       11 2913 1 1 11 THR OG1  O  -2.148  3.163  -4.050 1.00 . A A .  12 THR OG1  1 1 
       11 2914 1 1 12 SER C    C   2.910  3.234   0.358 1.00 . A A .  13 SER C    1 1 
       11 2915 1 1 12 SER CA   C   1.506  3.713   0.724 1.00 . A A .  13 SER CA   1 1 
       11 2916 1 1 12 SER CB   C   1.177  3.338   2.171 1.00 . A A .  13 SER CB   1 1 
       11 2917 1 1 12 SER H    H   0.544  2.165  -0.334 1.00 . A A .  13 SER H    1 1 
       11 2918 1 1 12 SER HA   H   1.452  4.786   0.621 1.00 . A A .  13 SER HA   1 1 
       11 2919 1 1 12 SER HB2  H   0.152  3.607   2.384 1.00 . A A .  13 SER HB2  1 1 
       11 2920 1 1 12 SER HB3  H   1.303  2.273   2.302 1.00 . A A .  13 SER HB3  1 1 
       11 2921 1 1 12 SER HG   H   1.503  4.348   3.820 1.00 . A A .  13 SER HG   1 1 
       11 2922 1 1 12 SER N    N   0.536  3.133  -0.184 1.00 . A A .  13 SER N    1 1 
       11 2923 1 1 12 SER O    O   3.222  2.047   0.499 1.00 . A A .  13 SER O    1 1 
       11 2924 1 1 12 SER OG   O   2.027  4.014   3.085 1.00 . A A .  13 SER OG   1 1 
       11 2925 1 1 13 CYS C    C   6.062  4.706   0.297 1.00 . A A .  14 CYS C    1 1 
       11 2926 1 1 13 CYS CA   C   5.110  3.815  -0.485 1.00 . A A .  14 CYS CA   1 1 
       11 2927 1 1 13 CYS CB   C   5.353  3.970  -1.990 1.00 . A A .  14 CYS CB   1 1 
       11 2928 1 1 13 CYS H    H   3.416  5.056  -0.317 1.00 . A A .  14 CYS H    1 1 
       11 2929 1 1 13 CYS HA   H   5.287  2.787  -0.205 1.00 . A A .  14 CYS HA   1 1 
       11 2930 1 1 13 CYS HB2  H   5.069  4.966  -2.293 1.00 . A A .  14 CYS HB2  1 1 
       11 2931 1 1 13 CYS HB3  H   6.405  3.824  -2.192 1.00 . A A .  14 CYS HB3  1 1 
       11 2932 1 1 13 CYS N    N   3.737  4.139  -0.151 1.00 . A A .  14 CYS N    1 1 
       11 2933 1 1 13 CYS O    O   5.927  5.931   0.295 1.00 . A A .  14 CYS O    1 1 
       11 2934 1 1 13 CYS SG   S   4.419  2.791  -3.023 1.00 . A A .  14 CYS SG   1 1 
       11 2935 1 1 14 LYS C    C   9.399  4.379   1.278 1.00 . A A .  15 LYS C    1 1 
       11 2936 1 1 14 LYS CA   C   8.010  4.808   1.731 1.00 . A A .  15 LYS CA   1 1 
       11 2937 1 1 14 LYS CB   C   7.840  4.552   3.230 1.00 . A A .  15 LYS CB   1 1 
       11 2938 1 1 14 LYS CD   C   8.634  5.033   5.567 1.00 . A A .  15 LYS CD   1 1 
       11 2939 1 1 14 LYS CE   C   9.578  5.863   6.422 1.00 . A A .  15 LYS CE   1 1 
       11 2940 1 1 14 LYS CG   C   8.809  5.345   4.091 1.00 . A A .  15 LYS CG   1 1 
       11 2941 1 1 14 LYS H    H   7.044  3.102   0.950 1.00 . A A .  15 LYS H    1 1 
       11 2942 1 1 14 LYS HA   H   7.885  5.863   1.533 1.00 . A A .  15 LYS HA   1 1 
       11 2943 1 1 14 LYS HB2  H   6.834  4.816   3.520 1.00 . A A .  15 LYS HB2  1 1 
       11 2944 1 1 14 LYS HB3  H   7.998  3.501   3.424 1.00 . A A .  15 LYS HB3  1 1 
       11 2945 1 1 14 LYS HD2  H   7.617  5.252   5.854 1.00 . A A .  15 LYS HD2  1 1 
       11 2946 1 1 14 LYS HD3  H   8.841  3.984   5.729 1.00 . A A .  15 LYS HD3  1 1 
       11 2947 1 1 14 LYS HE2  H   9.355  6.909   6.271 1.00 . A A .  15 LYS HE2  1 1 
       11 2948 1 1 14 LYS HE3  H   9.422  5.607   7.459 1.00 . A A .  15 LYS HE3  1 1 
       11 2949 1 1 14 LYS HG2  H   9.817  5.098   3.799 1.00 . A A .  15 LYS HG2  1 1 
       11 2950 1 1 14 LYS HG3  H   8.635  6.399   3.933 1.00 . A A .  15 LYS HG3  1 1 
       11 2951 1 1 14 LYS HZ1  H  11.625  6.171   6.693 1.00 . A A .  15 LYS HZ1  1 1 
       11 2952 1 1 14 LYS HZ2  H  11.181  5.894   5.081 1.00 . A A .  15 LYS HZ2  1 1 
       11 2953 1 1 14 LYS HZ3  H  11.225  4.605   6.182 1.00 . A A .  15 LYS HZ3  1 1 
       11 2954 1 1 14 LYS N    N   7.010  4.086   0.971 1.00 . A A .  15 LYS N    1 1 
       11 2955 1 1 14 LYS NZ   N  11.000  5.615   6.071 1.00 . A A .  15 LYS NZ   1 1 
       11 2956 1 1 14 LYS O    O  10.054  5.148   0.550 1.00 . A A .  15 LYS O    1 1 
       11 2957 1 1 14 LYS OXT  O   9.813  3.255   1.623 1.00 . A A .  15 LYS OXT  1 1 
       11 2958 2 2  1 .   C1   C   9.004 -2.362   0.703 1.00 . B A . 101 OCA C1   1 1 
       11 2959 2 2  1 .   C2   C   8.620 -1.918   2.114 1.00 . B A . 101 OCA C2   1 1 
       11 2960 2 2  1 .   C3   C   7.121 -2.008   2.373 1.00 . B A . 101 OCA C3   1 1 
       11 2961 2 2  1 .   C4   C   6.645 -0.937   3.344 1.00 . B A . 101 OCA C4   1 1 
       11 2962 2 2  1 .   C5   C   5.983 -1.553   4.569 1.00 . B A . 101 OCA C5   1 1 
       11 2963 2 2  1 .   C6   C   5.715 -0.533   5.675 1.00 . B A . 101 OCA C6   1 1 
       11 2964 2 2  1 .   C7   C   6.948 -0.250   6.527 1.00 . B A . 101 OCA C7   1 1 
       11 2965 2 2  1 .   C8   C   7.891  0.736   5.874 1.00 . B A . 101 OCA C8   1 1 
       11 2966 2 2  1 .   H21  H   9.135 -2.547   2.824 1.00 . B A . 101 OCA H21  1 1 
       11 2967 2 2  1 .   H22  H   8.933 -0.893   2.250 1.00 . B A . 101 OCA H22  1 1 
       11 2968 2 2  1 .   H31  H   6.895 -2.980   2.787 1.00 . B A . 101 OCA H31  1 1 
       11 2969 2 2  1 .   H32  H   6.599 -1.883   1.437 1.00 . B A . 101 OCA H32  1 1 
       11 2970 2 2  1 .   H41  H   7.495 -0.351   3.662 1.00 . B A . 101 OCA H41  1 1 
       11 2971 2 2  1 .   H42  H   5.932 -0.300   2.842 1.00 . B A . 101 OCA H42  1 1 
       11 2972 2 2  1 .   H51  H   5.045 -1.995   4.270 1.00 . B A . 101 OCA H51  1 1 
       11 2973 2 2  1 .   H52  H   6.633 -2.322   4.960 1.00 . B A . 101 OCA H52  1 1 
       11 2974 2 2  1 .   H61  H   5.387  0.391   5.222 1.00 . B A . 101 OCA H61  1 1 
       11 2975 2 2  1 .   H62  H   4.933 -0.916   6.313 1.00 . B A . 101 OCA H62  1 1 
       11 2976 2 2  1 .   H71  H   7.482 -1.175   6.689 1.00 . B A . 101 OCA H71  1 1 
       11 2977 2 2  1 .   H72  H   6.634  0.158   7.477 1.00 . B A . 101 OCA H72  1 1 
       11 2978 2 2  1 .   H81  H   7.537  0.970   4.881 1.00 . B A . 101 OCA H81  1 1 
       11 2979 2 2  1 .   H82  H   8.879  0.301   5.809 1.00 . B A . 101 OCA H82  1 1 
       11 2980 2 2  1 .   H83  H   7.934  1.639   6.464 1.00 . B A . 101 OCA H83  1 1 
       11 2981 2 2  1 .   O1   O   9.220 -3.534   0.387 1.00 . B A . 101 OCA O1   1 1 
       12 2982 1 1  1 PRO C    C   7.251  0.301   0.044 1.00 . A A .   2 PRO C    1 1 
       12 2983 1 1  1 PRO CA   C   8.740 -0.040  -0.055 1.00 . A A .   2 PRO CA   1 1 
       12 2984 1 1  1 PRO CB   C   9.517  1.144  -0.620 1.00 . A A .   2 PRO CB   1 1 
       12 2985 1 1  1 PRO CD   C   9.141 -0.483  -2.387 1.00 . A A .   2 PRO CD   1 1 
       12 2986 1 1  1 PRO CG   C   9.459  0.973  -2.108 1.00 . A A .   2 PRO CG   1 1 
       12 2987 1 1  1 PRO HA   H   9.123 -0.299   0.920 1.00 . A A .   2 PRO HA   1 1 
       12 2988 1 1  1 PRO HB2  H   9.046  2.068  -0.309 1.00 . A A .   2 PRO HB2  1 1 
       12 2989 1 1  1 PRO HB3  H  10.534  1.115  -0.261 1.00 . A A .   2 PRO HB3  1 1 
       12 2990 1 1  1 PRO HD2  H   8.214 -0.570  -2.935 1.00 . A A .   2 PRO HD2  1 1 
       12 2991 1 1  1 PRO HD3  H   9.949 -0.947  -2.936 1.00 . A A .   2 PRO HD3  1 1 
       12 2992 1 1  1 PRO HG2  H   8.684  1.604  -2.518 1.00 . A A .   2 PRO HG2  1 1 
       12 2993 1 1  1 PRO HG3  H  10.414  1.233  -2.540 1.00 . A A .   2 PRO HG3  1 1 
       12 2994 1 1  1 PRO N    N   9.013 -1.077  -1.047 1.00 . A A .   2 PRO N    1 1 
       12 2995 1 1  1 PRO O    O   6.858  1.221   0.761 1.00 . A A .   2 PRO O    1 1 
       12 2996 1 1  2 CYS C    C   4.237 -1.324  -0.039 1.00 . A A .   3 CYS C    1 1 
       12 2997 1 1  2 CYS CA   C   4.995 -0.187  -0.714 1.00 . A A .   3 CYS CA   1 1 
       12 2998 1 1  2 CYS CB   C   4.517 -0.051  -2.163 1.00 . A A .   3 CYS CB   1 1 
       12 2999 1 1  2 CYS H    H   6.792 -1.181  -1.224 1.00 . A A .   3 CYS H    1 1 
       12 3000 1 1  2 CYS HA   H   4.802  0.735  -0.187 1.00 . A A .   3 CYS HA   1 1 
       12 3001 1 1  2 CYS HB2  H   4.531 -1.022  -2.632 1.00 . A A .   3 CYS HB2  1 1 
       12 3002 1 1  2 CYS HB3  H   3.506  0.329  -2.166 1.00 . A A .   3 CYS HB3  1 1 
       12 3003 1 1  2 CYS N    N   6.428 -0.442  -0.685 1.00 . A A .   3 CYS N    1 1 
       12 3004 1 1  2 CYS O    O   4.417 -2.489  -0.389 1.00 . A A .   3 CYS O    1 1 
       12 3005 1 1  2 CYS SG   S   5.531  1.071  -3.184 1.00 . A A .   3 CYS SG   1 1 
       12 3006 1 1  3 LYS C    C   1.075 -1.629   1.249 1.00 . A A .   4 LYS C    1 1 
       12 3007 1 1  3 LYS CA   C   2.519 -1.985   1.532 1.00 . A A .   4 LYS CA   1 1 
       12 3008 1 1  3 LYS CB   C   2.735 -2.104   3.044 1.00 . A A .   4 LYS CB   1 1 
       12 3009 1 1  3 LYS CD   C   2.013 -4.523   3.027 1.00 . A A .   4 LYS CD   1 1 
       12 3010 1 1  3 LYS CE   C   3.409 -5.101   3.199 1.00 . A A .   4 LYS CE   1 1 
       12 3011 1 1  3 LYS CG   C   1.866 -3.167   3.706 1.00 . A A .   4 LYS CG   1 1 
       12 3012 1 1  3 LYS H    H   3.360 -0.062   1.240 1.00 . A A .   4 LYS H    1 1 
       12 3013 1 1  3 LYS HA   H   2.735 -2.938   1.070 1.00 . A A .   4 LYS HA   1 1 
       12 3014 1 1  3 LYS HB2  H   3.763 -2.352   3.228 1.00 . A A .   4 LYS HB2  1 1 
       12 3015 1 1  3 LYS HB3  H   2.516 -1.153   3.504 1.00 . A A .   4 LYS HB3  1 1 
       12 3016 1 1  3 LYS HD2  H   1.298 -5.207   3.461 1.00 . A A .   4 LYS HD2  1 1 
       12 3017 1 1  3 LYS HD3  H   1.807 -4.408   1.972 1.00 . A A .   4 LYS HD3  1 1 
       12 3018 1 1  3 LYS HE2  H   3.540 -5.907   2.493 1.00 . A A .   4 LYS HE2  1 1 
       12 3019 1 1  3 LYS HE3  H   4.133 -4.325   2.994 1.00 . A A .   4 LYS HE3  1 1 
       12 3020 1 1  3 LYS HG2  H   2.158 -3.262   4.742 1.00 . A A .   4 LYS HG2  1 1 
       12 3021 1 1  3 LYS HG3  H   0.833 -2.856   3.652 1.00 . A A .   4 LYS HG3  1 1 
       12 3022 1 1  3 LYS HZ1  H   3.044 -6.467   4.735 1.00 . A A .   4 LYS HZ1  1 1 
       12 3023 1 1  3 LYS HZ2  H   3.371 -4.899   5.281 1.00 . A A .   4 LYS HZ2  1 1 
       12 3024 1 1  3 LYS HZ3  H   4.636 -5.874   4.704 1.00 . A A .   4 LYS HZ3  1 1 
       12 3025 1 1  3 LYS N    N   3.399 -0.994   0.932 1.00 . A A .   4 LYS N    1 1 
       12 3026 1 1  3 LYS NZ   N   3.630 -5.621   4.572 1.00 . A A .   4 LYS NZ   1 1 
       12 3027 1 1  3 LYS O    O   0.552 -0.648   1.779 1.00 . A A .   4 LYS O    1 1 
       12 3028 1 1  4 ASN C    C  -1.794 -3.330   0.646 1.00 . A A .   5 ASN C    1 1 
       12 3029 1 1  4 ASN CA   C  -0.950 -2.183   0.082 1.00 . A A .   5 ASN CA   1 1 
       12 3030 1 1  4 ASN CB   C  -1.111 -2.081  -1.439 1.00 . A A .   5 ASN CB   1 1 
       12 3031 1 1  4 ASN CG   C  -0.259 -0.970  -2.036 1.00 . A A .   5 ASN CG   1 1 
       12 3032 1 1  4 ASN H    H   0.910 -3.180   0.003 1.00 . A A .   5 ASN H    1 1 
       12 3033 1 1  4 ASN HA   H  -1.240 -1.246   0.529 1.00 . A A .   5 ASN HA   1 1 
       12 3034 1 1  4 ASN HB2  H  -0.817 -3.018  -1.888 1.00 . A A .   5 ASN HB2  1 1 
       12 3035 1 1  4 ASN HB3  H  -2.146 -1.882  -1.675 1.00 . A A .   5 ASN HB3  1 1 
       12 3036 1 1  4 ASN HD21 H   0.028 -2.040  -3.683 1.00 . A A .   5 ASN HD21 1 1 
       12 3037 1 1  4 ASN HD22 H   0.788 -0.490  -3.649 1.00 . A A .   5 ASN HD22 1 1 
       12 3038 1 1  4 ASN N    N   0.438 -2.418   0.408 1.00 . A A .   5 ASN N    1 1 
       12 3039 1 1  4 ASN ND2  N   0.233 -1.188  -3.244 1.00 . A A .   5 ASN ND2  1 1 
       12 3040 1 1  4 ASN O    O  -1.708 -4.460   0.162 1.00 . A A .   5 ASN O    1 1 
       12 3041 1 1  4 ASN OD1  O  -0.024  0.065  -1.408 1.00 . A A .   5 ASN OD1  1 1 
       12 3042 1 1  5 .   C    C  -4.503 -4.602   1.489 1.00 . A A .   6 O6H C    1 1 
       12 3043 1 1  5 .   CA   C  -3.364 -4.088   2.356 1.00 . A A .   6 O6H CA   1 1 
       12 3044 1 1  5 .   CB   C  -3.884 -3.594   3.710 1.00 . A A .   6 O6H CB   1 1 
       12 3045 1 1  5 .   CD1  C  -1.855 -3.966   5.180 1.00 . A A .   6 O6H CD1  1 1 
       12 3046 1 1  5 .   CD2  C  -2.680 -1.747   4.929 1.00 . A A .   6 O6H CD2  1 1 
       12 3047 1 1  5 .   CE1  C  -0.846 -3.501   6.006 1.00 . A A .   6 O6H CE1  1 1 
       12 3048 1 1  5 .   CE2  C  -1.685 -1.271   5.753 1.00 . A A .   6 O6H CE2  1 1 
       12 3049 1 1  5 .   CF1  C  -1.926 -5.436   4.886 1.00 . A A .   6 O6H CF1  1 1 
       12 3050 1 1  5 .   CF2  C  -3.666 -0.781   4.360 1.00 . A A .   6 O6H CF2  1 1 
       12 3051 1 1  5 .   CG   C  -2.791 -3.096   4.624 1.00 . A A .   6 O6H CG   1 1 
       12 3052 1 1  5 .   CH   C   0.317 -1.633   7.174 1.00 . A A .   6 O6H CH   1 1 
       12 3053 1 1  5 .   CZ   C  -0.771 -2.150   6.286 1.00 . A A .   6 O6H CZ   1 1 
       12 3054 1 1  5 .   H1   H  -2.648 -2.139   2.021 1.00 . A A .   6 O6H H1   1 1 
       12 3055 1 1  5 .   HA   H  -2.689 -4.914   2.537 1.00 . A A .   6 O6H HA   1 1 
       12 3056 1 1  5 .   HB1  H  -4.396 -4.404   4.211 1.00 . A A .   6 O6H HB1  1 1 
       12 3057 1 1  5 .   HB2  H  -4.578 -2.783   3.548 1.00 . A A .   6 O6H HB2  1 1 
       12 3058 1 1  5 .   HE1  H  -0.127 -4.187   6.428 1.00 . A A .   6 O6H HE1  1 1 
       12 3059 1 1  5 .   HE2  H  -1.619 -0.217   5.975 1.00 . A A .   6 O6H HE2  1 1 
       12 3060 1 1  5 .   HF11 H  -2.750 -5.706   4.241 1.00 . A A .   6 O6H HF11 1 1 
       12 3061 1 1  5 .   HF12 H  -2.048 -6.046   5.771 1.00 . A A .   6 O6H HF12 1 1 
       12 3062 1 1  5 .   HF13 H  -1.044 -5.818   4.398 1.00 . A A .   6 O6H HF13 1 1 
       12 3063 1 1  5 .   HF21 H  -4.473 -0.549   5.037 1.00 . A A .   6 O6H HF21 1 1 
       12 3064 1 1  5 .   HF22 H  -3.229  0.172   4.096 1.00 . A A .   6 O6H HF22 1 1 
       12 3065 1 1  5 .   HF23 H  -4.141 -1.136   3.457 1.00 . A A .   6 O6H HF23 1 1 
       12 3066 1 1  5 .   HH1  H  -0.027 -0.901   7.888 1.00 . A A .   6 O6H HH1  1 1 
       12 3067 1 1  5 .   HH2  H   1.115 -1.150   6.632 1.00 . A A .   6 O6H HH2  1 1 
       12 3068 1 1  5 .   HH3  H   0.795 -2.404   7.761 1.00 . A A .   6 O6H HH3  1 1 
       12 3069 1 1  5 .   N    N  -2.588 -3.054   1.684 1.00 . A A .   6 O6H N    1 1 
       12 3070 1 1  5 .   O    O  -4.800 -5.794   1.479 1.00 . A A .   6 O6H O    1 1 
       12 3071 1 1  6 PHE C    C  -6.139 -4.054  -1.437 1.00 . A A .   7 PHE C    1 1 
       12 3072 1 1  6 PHE CA   C  -6.376 -4.038   0.063 1.00 . A A .   7 PHE CA   1 1 
       12 3073 1 1  6 PHE CB   C  -7.491 -3.038   0.385 1.00 . A A .   7 PHE CB   1 1 
       12 3074 1 1  6 PHE CD1  C  -7.626 -3.327   2.883 1.00 . A A .   7 PHE CD1  1 1 
       12 3075 1 1  6 PHE CD2  C  -7.219 -1.147   2.008 1.00 . A A .   7 PHE CD2  1 1 
       12 3076 1 1  6 PHE CE1  C  -7.577 -2.820   4.169 1.00 . A A .   7 PHE CE1  1 1 
       12 3077 1 1  6 PHE CE2  C  -7.170 -0.636   3.289 1.00 . A A .   7 PHE CE2  1 1 
       12 3078 1 1  6 PHE CG   C  -7.446 -2.496   1.788 1.00 . A A .   7 PHE CG   1 1 
       12 3079 1 1  6 PHE CZ   C  -7.350 -1.473   4.372 1.00 . A A .   7 PHE CZ   1 1 
       12 3080 1 1  6 PHE H    H  -4.806 -2.783   0.725 1.00 . A A .   7 PHE H    1 1 
       12 3081 1 1  6 PHE HA   H  -6.682 -5.023   0.380 1.00 . A A .   7 PHE HA   1 1 
       12 3082 1 1  6 PHE HB2  H  -7.419 -2.202  -0.293 1.00 . A A .   7 PHE HB2  1 1 
       12 3083 1 1  6 PHE HB3  H  -8.447 -3.524   0.246 1.00 . A A .   7 PHE HB3  1 1 
       12 3084 1 1  6 PHE HD1  H  -7.802 -4.382   2.727 1.00 . A A .   7 PHE HD1  1 1 
       12 3085 1 1  6 PHE HD2  H  -7.077 -0.489   1.164 1.00 . A A .   7 PHE HD2  1 1 
       12 3086 1 1  6 PHE HE1  H  -7.718 -3.478   5.015 1.00 . A A .   7 PHE HE1  1 1 
       12 3087 1 1  6 PHE HE2  H  -6.990  0.419   3.442 1.00 . A A .   7 PHE HE2  1 1 
       12 3088 1 1  6 PHE HZ   H  -7.311 -1.076   5.376 1.00 . A A .   7 PHE HZ   1 1 
       12 3089 1 1  6 PHE N    N  -5.153 -3.696   0.773 1.00 . A A .   7 PHE N    1 1 
       12 3090 1 1  6 PHE O    O  -6.929 -4.618  -2.189 1.00 . A A .   7 PHE O    1 1 
       12 3091 1 1  7 DTR C    C  -4.607 -1.980  -3.826 1.00 . A A .   8 DTR C    1 1 
       12 3092 1 1  7 DTR CA   C  -4.713 -3.401  -3.274 1.00 . A A .   8 DTR CA   1 1 
       12 3093 1 1  7 DTR CB   C  -3.384 -4.136  -3.475 1.00 . A A .   8 DTR CB   1 1 
       12 3094 1 1  7 DTR CD1  C  -3.324 -5.364  -5.720 1.00 . A A .   8 DTR CD1  1 1 
       12 3095 1 1  7 DTR CD2  C  -2.250 -3.402  -5.736 1.00 . A A .   8 DTR CD2  1 1 
       12 3096 1 1  7 DTR CE2  C  -2.154 -3.976  -7.015 1.00 . A A .   8 DTR CE2  1 1 
       12 3097 1 1  7 DTR CE3  C  -1.649 -2.164  -5.512 1.00 . A A .   8 DTR CE3  1 1 
       12 3098 1 1  7 DTR CG   C  -3.008 -4.308  -4.919 1.00 . A A .   8 DTR CG   1 1 
       12 3099 1 1  7 DTR CH2  C  -0.902 -2.143  -7.814 1.00 . A A .   8 DTR CH2  1 1 
       12 3100 1 1  7 DTR CZ2  C  -1.481 -3.353  -8.064 1.00 . A A .   8 DTR CZ2  1 1 
       12 3101 1 1  7 DTR CZ3  C  -0.980 -1.548  -6.551 1.00 . A A .   8 DTR CZ3  1 1 
       12 3102 1 1  7 DTR H    H  -4.524 -2.904  -1.236 1.00 . A A .   8 DTR H    1 1 
       12 3103 1 1  7 DTR HA   H  -5.454 -3.969  -3.819 1.00 . A A .   8 DTR HA   1 1 
       12 3104 1 1  7 DTR HB2  H  -2.597 -3.579  -2.987 1.00 . A A .   8 DTR HB2  1 1 
       12 3105 1 1  7 DTR HB3  H  -3.456 -5.115  -3.027 1.00 . A A .   8 DTR HB3  1 1 
       12 3106 1 1  7 DTR HD1  H  -3.894 -6.222  -5.395 1.00 . A A .   8 DTR HD1  1 1 
       12 3107 1 1  7 DTR HE1  H  -2.912 -5.797  -7.737 1.00 . A A .   8 DTR HE1  1 1 
       12 3108 1 1  7 DTR HE3  H  -1.697 -1.688  -4.543 1.00 . A A .   8 DTR HE3  1 1 
       12 3109 1 1  7 DTR HH2  H  -0.368 -1.625  -8.598 1.00 . A A .   8 DTR HH2  1 1 
       12 3110 1 1  7 DTR HZ2  H  -1.418 -3.794  -9.046 1.00 . A A .   8 DTR HZ2  1 1 
       12 3111 1 1  7 DTR HZ3  H  -0.509 -0.591  -6.393 1.00 . A A .   8 DTR HZ3  1 1 
       12 3112 1 1  7 DTR N    N  -5.076 -3.397  -1.872 1.00 . A A .   8 DTR N    1 1 
       12 3113 1 1  7 DTR NE1  N  -2.816 -5.171  -6.980 1.00 . A A .   8 DTR NE1  1 1 
       12 3114 1 1  7 DTR O    O  -3.824 -1.181  -3.315 1.00 . A A .   8 DTR O    1 1 
       12 3115 1 1  8 LYS C    C  -6.052  0.721  -4.901 1.00 . A A .   9 LYS C    1 1 
       12 3116 1 1  8 LYS CA   C  -5.242 -0.394  -5.555 1.00 . A A .   9 LYS CA   1 1 
       12 3117 1 1  8 LYS CB   C  -5.670 -0.583  -7.011 1.00 . A A .   9 LYS CB   1 1 
       12 3118 1 1  8 LYS CD   C  -5.648 -2.064  -9.050 1.00 . A A .   9 LYS CD   1 1 
       12 3119 1 1  8 LYS CE   C  -5.075 -3.326  -9.675 1.00 . A A .   9 LYS CE   1 1 
       12 3120 1 1  8 LYS CG   C  -5.070 -1.819  -7.664 1.00 . A A .   9 LYS CG   1 1 
       12 3121 1 1  8 LYS H    H  -6.153 -2.244  -5.088 1.00 . A A .   9 LYS H    1 1 
       12 3122 1 1  8 LYS HA   H  -4.194 -0.132  -5.524 1.00 . A A .   9 LYS HA   1 1 
       12 3123 1 1  8 LYS HB2  H  -6.746 -0.665  -7.053 1.00 . A A .   9 LYS HB2  1 1 
       12 3124 1 1  8 LYS HB3  H  -5.358  0.281  -7.579 1.00 . A A .   9 LYS HB3  1 1 
       12 3125 1 1  8 LYS HD2  H  -6.721 -2.170  -8.971 1.00 . A A .   9 LYS HD2  1 1 
       12 3126 1 1  8 LYS HD3  H  -5.414 -1.221  -9.683 1.00 . A A .   9 LYS HD3  1 1 
       12 3127 1 1  8 LYS HE2  H  -4.011 -3.196  -9.802 1.00 . A A .   9 LYS HE2  1 1 
       12 3128 1 1  8 LYS HE3  H  -5.259 -4.156  -9.009 1.00 . A A .   9 LYS HE3  1 1 
       12 3129 1 1  8 LYS HG2  H  -4.003 -1.682  -7.751 1.00 . A A .   9 LYS HG2  1 1 
       12 3130 1 1  8 LYS HG3  H  -5.274 -2.680  -7.042 1.00 . A A .   9 LYS HG3  1 1 
       12 3131 1 1  8 LYS HZ1  H  -5.240 -4.461 -11.424 1.00 . A A .   9 LYS HZ1  1 1 
       12 3132 1 1  8 LYS HZ2  H  -5.558 -2.811 -11.644 1.00 . A A .   9 LYS HZ2  1 1 
       12 3133 1 1  8 LYS HZ3  H  -6.707 -3.804 -10.890 1.00 . A A .   9 LYS HZ3  1 1 
       12 3134 1 1  8 LYS N    N  -5.412 -1.645  -4.831 1.00 . A A .   9 LYS N    1 1 
       12 3135 1 1  8 LYS NZ   N  -5.686 -3.622 -11.000 1.00 . A A .   9 LYS NZ   1 1 
       12 3136 1 1  8 LYS O    O  -5.969  1.889  -5.296 1.00 . A A .   9 LYS O    1 1 
       12 3137 1 1  9 THR C    C  -6.773  2.055  -2.114 1.00 . A A .  10 THR C    1 1 
       12 3138 1 1  9 THR CA   C  -7.627  1.308  -3.146 1.00 . A A .  10 THR CA   1 1 
       12 3139 1 1  9 THR CB   C  -8.783  0.594  -2.422 1.00 . A A .  10 THR CB   1 1 
       12 3140 1 1  9 THR CG2  C  -9.831  1.590  -1.947 1.00 . A A .  10 THR CG2  1 1 
       12 3141 1 1  9 THR H    H  -6.892 -0.600  -3.666 1.00 . A A .  10 THR H    1 1 
       12 3142 1 1  9 THR HA   H  -8.047  2.017  -3.843 1.00 . A A .  10 THR HA   1 1 
       12 3143 1 1  9 THR HB   H  -8.384  0.077  -1.562 1.00 . A A .  10 THR HB   1 1 
       12 3144 1 1  9 THR HG1  H -10.032  0.089  -3.878 1.00 . A A .  10 THR HG1  1 1 
       12 3145 1 1  9 THR HG21 H -10.630  1.062  -1.448 1.00 . A A .  10 THR HG21 1 1 
       12 3146 1 1  9 THR HG22 H -10.229  2.126  -2.796 1.00 . A A .  10 THR HG22 1 1 
       12 3147 1 1  9 THR HG23 H  -9.376  2.289  -1.261 1.00 . A A .  10 THR HG23 1 1 
       12 3148 1 1  9 THR N    N  -6.828  0.351  -3.892 1.00 . A A .  10 THR N    1 1 
       12 3149 1 1  9 THR O    O  -7.069  3.194  -1.755 1.00 . A A .  10 THR O    1 1 
       12 3150 1 1  9 THR OG1  O  -9.393 -0.363  -3.301 1.00 . A A .  10 THR OG1  1 1 
       12 3151 1 1 10 PHE C    C  -3.361  1.922  -1.125 1.00 . A A .  11 PHE C    1 1 
       12 3152 1 1 10 PHE CA   C  -4.834  2.013  -0.647 1.00 . A A .  11 PHE CA   1 1 
       12 3153 1 1 10 PHE CB   C  -4.985  1.255   0.675 1.00 . A A .  11 PHE CB   1 1 
       12 3154 1 1 10 PHE CD1  C  -4.992  2.800   2.652 1.00 . A A .  11 PHE CD1  1 1 
       12 3155 1 1 10 PHE CD2  C  -2.966  1.661   2.116 1.00 . A A .  11 PHE CD2  1 1 
       12 3156 1 1 10 PHE CE1  C  -4.370  3.411   3.724 1.00 . A A .  11 PHE CE1  1 1 
       12 3157 1 1 10 PHE CE2  C  -2.338  2.271   3.186 1.00 . A A .  11 PHE CE2  1 1 
       12 3158 1 1 10 PHE CG   C  -4.299  1.919   1.837 1.00 . A A .  11 PHE CG   1 1 
       12 3159 1 1 10 PHE CZ   C  -3.041  3.147   3.991 1.00 . A A .  11 PHE CZ   1 1 
       12 3160 1 1 10 PHE H    H  -5.476  0.534  -2.009 1.00 . A A .  11 PHE H    1 1 
       12 3161 1 1 10 PHE HA   H  -5.159  3.031  -0.501 1.00 . A A .  11 PHE HA   1 1 
       12 3162 1 1 10 PHE HB2  H  -6.035  1.170   0.912 1.00 . A A .  11 PHE HB2  1 1 
       12 3163 1 1 10 PHE HB3  H  -4.566  0.264   0.562 1.00 . A A .  11 PHE HB3  1 1 
       12 3164 1 1 10 PHE HD1  H  -6.032  3.008   2.446 1.00 . A A .  11 PHE HD1  1 1 
       12 3165 1 1 10 PHE HD2  H  -2.417  0.976   1.485 1.00 . A A .  11 PHE HD2  1 1 
       12 3166 1 1 10 PHE HE1  H  -4.922  4.097   4.350 1.00 . A A .  11 PHE HE1  1 1 
       12 3167 1 1 10 PHE HE2  H  -1.299  2.063   3.390 1.00 . A A .  11 PHE HE2  1 1 
       12 3168 1 1 10 PHE HZ   H  -2.554  3.624   4.830 1.00 . A A .  11 PHE HZ   1 1 
       12 3169 1 1 10 PHE N    N  -5.702  1.417  -1.653 1.00 . A A .  11 PHE N    1 1 
       12 3170 1 1 10 PHE O    O  -2.891  0.810  -1.353 1.00 . A A .  11 PHE O    1 1 
       12 3171 1 1 11 THR C    C  -0.289  3.728  -0.918 1.00 . A A .  12 THR C    1 1 
       12 3172 1 1 11 THR CA   C  -1.254  2.929  -1.795 1.00 . A A .  12 THR CA   1 1 
       12 3173 1 1 11 THR CB   C  -1.166  3.416  -3.256 1.00 . A A .  12 THR CB   1 1 
       12 3174 1 1 11 THR CG2  C   0.245  3.258  -3.808 1.00 . A A .  12 THR CG2  1 1 
       12 3175 1 1 11 THR H    H  -2.971  3.931  -1.104 1.00 . A A .  12 THR H    1 1 
       12 3176 1 1 11 THR HA   H  -0.973  1.886  -1.768 1.00 . A A .  12 THR HA   1 1 
       12 3177 1 1 11 THR HB   H  -1.436  4.462  -3.289 1.00 . A A .  12 THR HB   1 1 
       12 3178 1 1 11 THR HG1  H  -2.295  1.835  -3.619 1.00 . A A .  12 THR HG1  1 1 
       12 3179 1 1 11 THR HG21 H   0.931  3.849  -3.217 1.00 . A A .  12 THR HG21 1 1 
       12 3180 1 1 11 THR HG22 H   0.269  3.597  -4.832 1.00 . A A .  12 THR HG22 1 1 
       12 3181 1 1 11 THR HG23 H   0.535  2.219  -3.764 1.00 . A A .  12 THR HG23 1 1 
       12 3182 1 1 11 THR N    N  -2.619  3.034  -1.305 1.00 . A A .  12 THR N    1 1 
       12 3183 1 1 11 THR O    O  -0.360  4.955  -0.861 1.00 . A A .  12 THR O    1 1 
       12 3184 1 1 11 THR OG1  O  -2.088  2.667  -4.066 1.00 . A A .  12 THR OG1  1 1 
       12 3185 1 1 12 SER C    C   3.006  3.205   0.252 1.00 . A A .  13 SER C    1 1 
       12 3186 1 1 12 SER CA   C   1.597  3.685   0.609 1.00 . A A .  13 SER CA   1 1 
       12 3187 1 1 12 SER CB   C   1.320  3.423   2.090 1.00 . A A .  13 SER CB   1 1 
       12 3188 1 1 12 SER H    H   0.577  2.046  -0.265 1.00 . A A .  13 SER H    1 1 
       12 3189 1 1 12 SER HA   H   1.526  4.746   0.427 1.00 . A A .  13 SER HA   1 1 
       12 3190 1 1 12 SER HB2  H   1.279  2.359   2.261 1.00 . A A .  13 SER HB2  1 1 
       12 3191 1 1 12 SER HB3  H   2.113  3.853   2.684 1.00 . A A .  13 SER HB3  1 1 
       12 3192 1 1 12 SER HG   H  -0.403  4.264   1.703 1.00 . A A .  13 SER HG   1 1 
       12 3193 1 1 12 SER N    N   0.596  3.029  -0.221 1.00 . A A .  13 SER N    1 1 
       12 3194 1 1 12 SER O    O   3.352  2.049   0.501 1.00 . A A .  13 SER O    1 1 
       12 3195 1 1 12 SER OG   O   0.088  3.997   2.487 1.00 . A A .  13 SER OG   1 1 
       12 3196 1 1 13 CYS C    C   6.141  4.632   0.102 1.00 . A A .  14 CYS C    1 1 
       12 3197 1 1 13 CYS CA   C   5.182  3.751  -0.685 1.00 . A A .  14 CYS CA   1 1 
       12 3198 1 1 13 CYS CB   C   5.424  3.924  -2.185 1.00 . A A .  14 CYS CB   1 1 
       12 3199 1 1 13 CYS H    H   3.461  4.975  -0.579 1.00 . A A .  14 CYS H    1 1 
       12 3200 1 1 13 CYS HA   H   5.354  2.719  -0.414 1.00 . A A .  14 CYS HA   1 1 
       12 3201 1 1 13 CYS HB2  H   5.162  4.933  -2.468 1.00 . A A .  14 CYS HB2  1 1 
       12 3202 1 1 13 CYS HB3  H   6.470  3.757  -2.396 1.00 . A A .  14 CYS HB3  1 1 
       12 3203 1 1 13 CYS N    N   3.805  4.080  -0.350 1.00 . A A .  14 CYS N    1 1 
       12 3204 1 1 13 CYS O    O   6.221  5.842  -0.131 1.00 . A A .  14 CYS O    1 1 
       12 3205 1 1 13 CYS SG   S   4.457  2.791  -3.234 1.00 . A A .  14 CYS SG   1 1 
       12 3206 1 1 14 LYS C    C   8.602  3.784   2.744 1.00 . A A .  15 LYS C    1 1 
       12 3207 1 1 14 LYS CA   C   7.780  4.754   1.901 1.00 . A A .  15 LYS CA   1 1 
       12 3208 1 1 14 LYS CB   C   7.032  5.763   2.784 1.00 . A A .  15 LYS CB   1 1 
       12 3209 1 1 14 LYS CD   C   4.938  6.304   4.092 1.00 . A A .  15 LYS CD   1 1 
       12 3210 1 1 14 LYS CE   C   4.115  7.058   3.049 1.00 . A A .  15 LYS CE   1 1 
       12 3211 1 1 14 LYS CG   C   5.795  5.203   3.475 1.00 . A A .  15 LYS CG   1 1 
       12 3212 1 1 14 LYS H    H   6.740  3.058   1.186 1.00 . A A .  15 LYS H    1 1 
       12 3213 1 1 14 LYS HA   H   8.451  5.295   1.252 1.00 . A A .  15 LYS HA   1 1 
       12 3214 1 1 14 LYS HB2  H   7.708  6.119   3.546 1.00 . A A .  15 LYS HB2  1 1 
       12 3215 1 1 14 LYS HB3  H   6.726  6.598   2.170 1.00 . A A .  15 LYS HB3  1 1 
       12 3216 1 1 14 LYS HD2  H   4.263  5.861   4.809 1.00 . A A .  15 LYS HD2  1 1 
       12 3217 1 1 14 LYS HD3  H   5.587  7.005   4.598 1.00 . A A .  15 LYS HD3  1 1 
       12 3218 1 1 14 LYS HE2  H   3.540  6.342   2.482 1.00 . A A .  15 LYS HE2  1 1 
       12 3219 1 1 14 LYS HE3  H   3.440  7.727   3.564 1.00 . A A .  15 LYS HE3  1 1 
       12 3220 1 1 14 LYS HG2  H   5.201  4.668   2.747 1.00 . A A .  15 LYS HG2  1 1 
       12 3221 1 1 14 LYS HG3  H   6.108  4.524   4.254 1.00 . A A .  15 LYS HG3  1 1 
       12 3222 1 1 14 LYS HZ1  H   5.571  8.505   2.641 1.00 . A A .  15 LYS HZ1  1 1 
       12 3223 1 1 14 LYS HZ2  H   4.349  8.409   1.468 1.00 . A A .  15 LYS HZ2  1 1 
       12 3224 1 1 14 LYS HZ3  H   5.552  7.219   1.540 1.00 . A A .  15 LYS HZ3  1 1 
       12 3225 1 1 14 LYS N    N   6.846  4.030   1.052 1.00 . A A .  15 LYS N    1 1 
       12 3226 1 1 14 LYS NZ   N   4.956  7.851   2.108 1.00 . A A .  15 LYS NZ   1 1 
       12 3227 1 1 14 LYS O    O   9.733  3.458   2.331 1.00 . A A .  15 LYS O    1 1 
       12 3228 1 1 14 LYS OXT  O   8.114  3.333   3.796 1.00 . A A .  15 LYS OXT  1 1 
       12 3229 2 2  1 .   C1   C   9.197 -2.388  -0.758 1.00 . B A . 101 OCA C1   1 1 
       12 3230 2 2  1 .   C2   C   9.229 -2.615   0.750 1.00 . B A . 101 OCA C2   1 1 
       12 3231 2 2  1 .   C3   C   7.856 -2.882   1.356 1.00 . B A . 101 OCA C3   1 1 
       12 3232 2 2  1 .   C4   C   7.956 -3.201   2.840 1.00 . B A . 101 OCA C4   1 1 
       12 3233 2 2  1 .   C5   C   7.420 -2.064   3.692 1.00 . B A . 101 OCA C5   1 1 
       12 3234 2 2  1 .   C6   C   6.015 -2.359   4.197 1.00 . B A . 101 OCA C6   1 1 
       12 3235 2 2  1 .   C7   C   5.798 -1.839   5.613 1.00 . B A . 101 OCA C7   1 1 
       12 3236 2 2  1 .   C8   C   6.675 -2.544   6.622 1.00 . B A . 101 OCA C8   1 1 
       12 3237 2 2  1 .   H21  H   9.863 -3.464   0.956 1.00 . B A . 101 OCA H21  1 1 
       12 3238 2 2  1 .   H22  H   9.645 -1.735   1.219 1.00 . B A . 101 OCA H22  1 1 
       12 3239 2 2  1 .   H31  H   7.237 -2.006   1.226 1.00 . B A . 101 OCA H31  1 1 
       12 3240 2 2  1 .   H32  H   7.406 -3.723   0.848 1.00 . B A . 101 OCA H32  1 1 
       12 3241 2 2  1 .   H41  H   7.383 -4.092   3.048 1.00 . B A . 101 OCA H41  1 1 
       12 3242 2 2  1 .   H42  H   8.992 -3.371   3.094 1.00 . B A . 101 OCA H42  1 1 
       12 3243 2 2  1 .   H51  H   8.076 -1.922   4.538 1.00 . B A . 101 OCA H51  1 1 
       12 3244 2 2  1 .   H52  H   7.396 -1.163   3.096 1.00 . B A . 101 OCA H52  1 1 
       12 3245 2 2  1 .   H61  H   5.302 -1.885   3.540 1.00 . B A . 101 OCA H61  1 1 
       12 3246 2 2  1 .   H62  H   5.858 -3.428   4.189 1.00 . B A . 101 OCA H62  1 1 
       12 3247 2 2  1 .   H71  H   6.030 -0.785   5.640 1.00 . B A . 101 OCA H71  1 1 
       12 3248 2 2  1 .   H72  H   4.767 -1.992   5.893 1.00 . B A . 101 OCA H72  1 1 
       12 3249 2 2  1 .   H81  H   6.234 -2.457   7.604 1.00 . B A . 101 OCA H81  1 1 
       12 3250 2 2  1 .   H82  H   7.656 -2.089   6.625 1.00 . B A . 101 OCA H82  1 1 
       12 3251 2 2  1 .   H83  H   6.762 -3.586   6.357 1.00 . B A . 101 OCA H83  1 1 
       12 3252 2 2  1 .   O1   O   9.258 -3.292  -1.596 1.00 . B A . 101 OCA O1   1 1 
       13 3253 1 1  1 PRO C    C   7.153 -0.311   0.782 1.00 . A A .   2 PRO C    1 1 
       13 3254 1 1  1 PRO CA   C   8.671 -0.574   0.717 1.00 . A A .   2 PRO CA   1 1 
       13 3255 1 1  1 PRO CB   C   8.969 -2.051   1.009 1.00 . A A .   2 PRO CB   1 1 
       13 3256 1 1  1 PRO CD   C   9.492 -0.711   2.969 1.00 . A A .   2 PRO CD   1 1 
       13 3257 1 1  1 PRO CG   C   9.522 -2.108   2.405 1.00 . A A .   2 PRO CG   1 1 
       13 3258 1 1  1 PRO HA   H   9.065 -0.301  -0.254 1.00 . A A .   2 PRO HA   1 1 
       13 3259 1 1  1 PRO HB2  H   8.055 -2.622   0.931 1.00 . A A .   2 PRO HB2  1 1 
       13 3260 1 1  1 PRO HB3  H   9.687 -2.420   0.289 1.00 . A A .   2 PRO HB3  1 1 
       13 3261 1 1  1 PRO HD2  H   8.629 -0.577   3.603 1.00 . A A .   2 PRO HD2  1 1 
       13 3262 1 1  1 PRO HD3  H  10.401 -0.500   3.513 1.00 . A A .   2 PRO HD3  1 1 
       13 3263 1 1  1 PRO HG2  H   8.911 -2.761   3.007 1.00 . A A .   2 PRO HG2  1 1 
       13 3264 1 1  1 PRO HG3  H  10.538 -2.476   2.376 1.00 . A A .   2 PRO HG3  1 1 
       13 3265 1 1  1 PRO N    N   9.394  0.126   1.776 1.00 . A A .   2 PRO N    1 1 
       13 3266 1 1  1 PRO O    O   6.668  0.270   1.753 1.00 . A A .   2 PRO O    1 1 
       13 3267 1 1  2 CYS C    C   4.113 -1.646  -0.016 1.00 . A A .   3 CYS C    1 1 
       13 3268 1 1  2 CYS CA   C   4.987 -0.431  -0.310 1.00 . A A .   3 CYS CA   1 1 
       13 3269 1 1  2 CYS CB   C   4.685  0.113  -1.709 1.00 . A A .   3 CYS CB   1 1 
       13 3270 1 1  2 CYS H    H   6.781 -1.367  -0.898 1.00 . A A .   3 CYS H    1 1 
       13 3271 1 1  2 CYS HA   H   4.784  0.340   0.418 1.00 . A A .   3 CYS HA   1 1 
       13 3272 1 1  2 CYS HB2  H   4.791 -0.686  -2.429 1.00 . A A .   3 CYS HB2  1 1 
       13 3273 1 1  2 CYS HB3  H   3.671  0.482  -1.734 1.00 . A A .   3 CYS HB3  1 1 
       13 3274 1 1  2 CYS N    N   6.395 -0.773  -0.216 1.00 . A A .   3 CYS N    1 1 
       13 3275 1 1  2 CYS O    O   4.239 -2.683  -0.667 1.00 . A A .   3 CYS O    1 1 
       13 3276 1 1  2 CYS SG   S   5.787  1.473  -2.225 1.00 . A A .   3 CYS SG   1 1 
       13 3277 1 1  3 LYS C    C   0.901 -2.222   0.917 1.00 . A A .   4 LYS C    1 1 
       13 3278 1 1  3 LYS CA   C   2.313 -2.594   1.322 1.00 . A A .   4 LYS CA   1 1 
       13 3279 1 1  3 LYS CB   C   2.324 -2.880   2.835 1.00 . A A .   4 LYS CB   1 1 
       13 3280 1 1  3 LYS CD   C   4.542 -2.076   3.735 1.00 . A A .   4 LYS CD   1 1 
       13 3281 1 1  3 LYS CE   C   5.246 -1.082   4.647 1.00 . A A .   4 LYS CE   1 1 
       13 3282 1 1  3 LYS CG   C   3.039 -1.834   3.688 1.00 . A A .   4 LYS CG   1 1 
       13 3283 1 1  3 LYS H    H   3.181 -0.674   1.461 1.00 . A A .   4 LYS H    1 1 
       13 3284 1 1  3 LYS HA   H   2.612 -3.482   0.786 1.00 . A A .   4 LYS HA   1 1 
       13 3285 1 1  3 LYS HB2  H   1.301 -2.937   3.176 1.00 . A A .   4 LYS HB2  1 1 
       13 3286 1 1  3 LYS HB3  H   2.794 -3.835   3.007 1.00 . A A .   4 LYS HB3  1 1 
       13 3287 1 1  3 LYS HD2  H   4.725 -3.075   4.102 1.00 . A A .   4 LYS HD2  1 1 
       13 3288 1 1  3 LYS HD3  H   4.941 -1.979   2.736 1.00 . A A .   4 LYS HD3  1 1 
       13 3289 1 1  3 LYS HE2  H   6.300 -1.320   4.667 1.00 . A A .   4 LYS HE2  1 1 
       13 3290 1 1  3 LYS HE3  H   5.111 -0.087   4.246 1.00 . A A .   4 LYS HE3  1 1 
       13 3291 1 1  3 LYS HG2  H   2.857 -0.857   3.264 1.00 . A A .   4 LYS HG2  1 1 
       13 3292 1 1  3 LYS HG3  H   2.643 -1.871   4.694 1.00 . A A .   4 LYS HG3  1 1 
       13 3293 1 1  3 LYS HZ1  H   5.354 -0.604   6.678 1.00 . A A .   4 LYS HZ1  1 1 
       13 3294 1 1  3 LYS HZ2  H   4.637 -2.111   6.366 1.00 . A A .   4 LYS HZ2  1 1 
       13 3295 1 1  3 LYS HZ3  H   3.773 -0.679   6.076 1.00 . A A .   4 LYS HZ3  1 1 
       13 3296 1 1  3 LYS N    N   3.227 -1.516   0.965 1.00 . A A .   4 LYS N    1 1 
       13 3297 1 1  3 LYS NZ   N   4.717 -1.122   6.036 1.00 . A A .   4 LYS NZ   1 1 
       13 3298 1 1  3 LYS O    O   0.392 -1.177   1.319 1.00 . A A .   4 LYS O    1 1 
       13 3299 1 1  4 ASN C    C  -1.962 -3.923   0.468 1.00 . A A .   5 ASN C    1 1 
       13 3300 1 1  4 ASN CA   C  -1.130 -2.836  -0.216 1.00 . A A .   5 ASN CA   1 1 
       13 3301 1 1  4 ASN CB   C  -1.340 -2.906  -1.738 1.00 . A A .   5 ASN CB   1 1 
       13 3302 1 1  4 ASN CG   C  -0.697 -1.758  -2.512 1.00 . A A .   5 ASN CG   1 1 
       13 3303 1 1  4 ASN H    H   0.741 -3.831  -0.263 1.00 . A A .   5 ASN H    1 1 
       13 3304 1 1  4 ASN HA   H  -1.413 -1.857   0.141 1.00 . A A .   5 ASN HA   1 1 
       13 3305 1 1  4 ASN HB2  H  -0.921 -3.829  -2.105 1.00 . A A .   5 ASN HB2  1 1 
       13 3306 1 1  4 ASN HB3  H  -2.402 -2.897  -1.943 1.00 . A A .   5 ASN HB3  1 1 
       13 3307 1 1  4 ASN HD21 H   0.619 -1.440  -1.063 1.00 . A A .   5 ASN HD21 1 1 
       13 3308 1 1  4 ASN HD22 H   0.747 -0.405  -2.438 1.00 . A A .   5 ASN HD22 1 1 
       13 3309 1 1  4 ASN N    N   0.269 -3.057   0.111 1.00 . A A .   5 ASN N    1 1 
       13 3310 1 1  4 ASN ND2  N   0.326 -1.137  -1.948 1.00 . A A .   5 ASN ND2  1 1 
       13 3311 1 1  4 ASN O    O  -1.896 -5.090   0.081 1.00 . A A .   5 ASN O    1 1 
       13 3312 1 1  4 ASN OD1  O  -1.126 -1.425  -3.615 1.00 . A A .   5 ASN OD1  1 1 
       13 3313 1 1  5 .   C    C  -4.747 -4.975   1.380 1.00 . A A .   6 O6H C    1 1 
       13 3314 1 1  5 .   CA   C  -3.558 -4.510   2.210 1.00 . A A .   6 O6H CA   1 1 
       13 3315 1 1  5 .   CB   C  -4.024 -3.938   3.550 1.00 . A A .   6 O6H CB   1 1 
       13 3316 1 1  5 .   CD1  C  -2.331 -4.656   5.285 1.00 . A A .   6 O6H CD1  1 1 
       13 3317 1 1  5 .   CD2  C  -2.370 -2.364   4.631 1.00 . A A .   6 O6H CD2  1 1 
       13 3318 1 1  5 .   CE1  C  -1.288 -4.393   6.155 1.00 . A A .   6 O6H CE1  1 1 
       13 3319 1 1  5 .   CE2  C  -1.333 -2.091   5.496 1.00 . A A .   6 O6H CE2  1 1 
       13 3320 1 1  5 .   CF1  C  -2.864 -6.060   5.189 1.00 . A A .   6 O6H CF1  1 1 
       13 3321 1 1  5 .   CF2  C  -2.944 -1.246   3.816 1.00 . A A .   6 O6H CF2  1 1 
       13 3322 1 1  5 .   CG   C  -2.892 -3.649   4.505 1.00 . A A .   6 O6H CG   1 1 
       13 3323 1 1  5 .   CH   C   0.335 -2.809   7.190 1.00 . A A .   6 O6H CH   1 1 
       13 3324 1 1  5 .   CZ   C  -0.795 -3.107   6.254 1.00 . A A .   6 O6H CZ   1 1 
       13 3325 1 1  5 .   H1   H  -2.710 -2.623   1.801 1.00 . A A .   6 O6H H1   1 1 
       13 3326 1 1  5 .   HA   H  -2.939 -5.372   2.412 1.00 . A A .   6 O6H HA   1 1 
       13 3327 1 1  5 .   HB1  H  -4.688 -4.646   4.024 1.00 . A A .   6 O6H HB1  1 1 
       13 3328 1 1  5 .   HB2  H  -4.556 -3.013   3.376 1.00 . A A .   6 O6H HB2  1 1 
       13 3329 1 1  5 .   HE1  H  -0.864 -5.186   6.752 1.00 . A A .   6 O6H HE1  1 1 
       13 3330 1 1  5 .   HE2  H  -0.944 -1.086   5.578 1.00 . A A .   6 O6H HE2  1 1 
       13 3331 1 1  5 .   HF11 H  -2.112 -6.786   4.921 1.00 . A A .   6 O6H HF11 1 1 
       13 3332 1 1  5 .   HF12 H  -3.644 -6.172   4.451 1.00 . A A .   6 O6H HF12 1 1 
       13 3333 1 1  5 .   HF13 H  -3.292 -6.420   6.113 1.00 . A A .   6 O6H HF13 1 1 
       13 3334 1 1  5 .   HF21 H  -3.665 -0.648   4.357 1.00 . A A .   6 O6H HF21 1 1 
       13 3335 1 1  5 .   HF22 H  -2.199 -0.547   3.468 1.00 . A A .   6 O6H HF22 1 1 
       13 3336 1 1  5 .   HF23 H  -3.458 -1.581   2.929 1.00 . A A .   6 O6H HF23 1 1 
       13 3337 1 1  5 .   HH1  H   0.839 -1.879   6.969 1.00 . A A .   6 O6H HH1  1 1 
       13 3338 1 1  5 .   HH2  H   0.027 -2.727   8.222 1.00 . A A .   6 O6H HH2  1 1 
       13 3339 1 1  5 .   HH3  H   1.111 -3.560   7.181 1.00 . A A .   6 O6H HH3  1 1 
       13 3340 1 1  5 .   N    N  -2.724 -3.554   1.496 1.00 . A A .   6 O6H N    1 1 
       13 3341 1 1  5 .   O    O  -5.134 -6.141   1.424 1.00 . A A .   6 O6H O    1 1 
       13 3342 1 1  6 PHE C    C  -6.435 -4.292  -1.532 1.00 . A A .   7 PHE C    1 1 
       13 3343 1 1  6 PHE CA   C  -6.615 -4.300  -0.022 1.00 . A A .   7 PHE CA   1 1 
       13 3344 1 1  6 PHE CB   C  -7.659 -3.248   0.379 1.00 . A A .   7 PHE CB   1 1 
       13 3345 1 1  6 PHE CD1  C  -6.901 -1.325   1.800 1.00 . A A .   7 PHE CD1  1 1 
       13 3346 1 1  6 PHE CD2  C  -7.594 -3.329   2.894 1.00 . A A .   7 PHE CD2  1 1 
       13 3347 1 1  6 PHE CE1  C  -6.620 -0.750   3.024 1.00 . A A .   7 PHE CE1  1 1 
       13 3348 1 1  6 PHE CE2  C  -7.320 -2.755   4.121 1.00 . A A .   7 PHE CE2  1 1 
       13 3349 1 1  6 PHE CG   C  -7.389 -2.619   1.719 1.00 . A A .   7 PHE CG   1 1 
       13 3350 1 1  6 PHE CZ   C  -6.829 -1.466   4.185 1.00 . A A .   7 PHE CZ   1 1 
       13 3351 1 1  6 PHE H    H  -4.940 -3.158   0.583 1.00 . A A .   7 PHE H    1 1 
       13 3352 1 1  6 PHE HA   H  -6.963 -5.276   0.284 1.00 . A A .   7 PHE HA   1 1 
       13 3353 1 1  6 PHE HB2  H  -7.668 -2.463  -0.361 1.00 . A A .   7 PHE HB2  1 1 
       13 3354 1 1  6 PHE HB3  H  -8.633 -3.714   0.417 1.00 . A A .   7 PHE HB3  1 1 
       13 3355 1 1  6 PHE HD1  H  -6.737 -0.761   0.892 1.00 . A A .   7 PHE HD1  1 1 
       13 3356 1 1  6 PHE HD2  H  -7.978 -4.336   2.844 1.00 . A A .   7 PHE HD2  1 1 
       13 3357 1 1  6 PHE HE1  H  -6.244  0.262   3.073 1.00 . A A .   7 PHE HE1  1 1 
       13 3358 1 1  6 PHE HE2  H  -7.487 -3.317   5.029 1.00 . A A .   7 PHE HE2  1 1 
       13 3359 1 1  6 PHE HZ   H  -6.596 -1.023   5.141 1.00 . A A .   7 PHE HZ   1 1 
       13 3360 1 1  6 PHE N    N  -5.350 -4.041   0.657 1.00 . A A .   7 PHE N    1 1 
       13 3361 1 1  6 PHE O    O  -7.272 -4.803  -2.272 1.00 . A A .   7 PHE O    1 1 
       13 3362 1 1  7 DTR C    C  -4.765 -2.044  -3.715 1.00 . A A .   8 DTR C    1 1 
       13 3363 1 1  7 DTR CA   C  -5.113 -3.499  -3.397 1.00 . A A .   8 DTR CA   1 1 
       13 3364 1 1  7 DTR CB   C  -3.994 -4.426  -3.887 1.00 . A A .   8 DTR CB   1 1 
       13 3365 1 1  7 DTR CD1  C  -2.550 -3.764  -5.905 1.00 . A A .   8 DTR CD1  1 1 
       13 3366 1 1  7 DTR CD2  C  -4.588 -4.529  -6.435 1.00 . A A .   8 DTR CD2  1 1 
       13 3367 1 1  7 DTR CE2  C  -3.911 -4.197  -7.622 1.00 . A A .   8 DTR CE2  1 1 
       13 3368 1 1  7 DTR CE3  C  -5.890 -5.031  -6.520 1.00 . A A .   8 DTR CE3  1 1 
       13 3369 1 1  7 DTR CG   C  -3.699 -4.250  -5.347 1.00 . A A .   8 DTR CG   1 1 
       13 3370 1 1  7 DTR CH2  C  -5.771 -4.843  -8.928 1.00 . A A .   8 DTR CH2  1 1 
       13 3371 1 1  7 DTR CZ2  C  -4.494 -4.350  -8.877 1.00 . A A .   8 DTR CZ2  1 1 
       13 3372 1 1  7 DTR CZ3  C  -6.467 -5.181  -7.765 1.00 . A A .   8 DTR CZ3  1 1 
       13 3373 1 1  7 DTR H    H  -4.697 -3.336  -1.343 1.00 . A A .   8 DTR H    1 1 
       13 3374 1 1  7 DTR HA   H  -6.005 -3.802  -3.927 1.00 . A A .   8 DTR HA   1 1 
       13 3375 1 1  7 DTR HB2  H  -3.090 -4.216  -3.334 1.00 . A A .   8 DTR HB2  1 1 
       13 3376 1 1  7 DTR HB3  H  -4.285 -5.452  -3.724 1.00 . A A .   8 DTR HB3  1 1 
       13 3377 1 1  7 DTR HD1  H  -1.682 -3.456  -5.342 1.00 . A A .   8 DTR HD1  1 1 
       13 3378 1 1  7 DTR HE1  H  -1.976 -3.429  -7.905 1.00 . A A .   8 DTR HE1  1 1 
       13 3379 1 1  7 DTR HE3  H  -6.443 -5.300  -5.633 1.00 . A A .   8 DTR HE3  1 1 
       13 3380 1 1  7 DTR HH2  H  -6.263 -4.975  -9.879 1.00 . A A .   8 DTR HH2  1 1 
       13 3381 1 1  7 DTR HZ2  H  -3.972 -4.093  -9.785 1.00 . A A .   8 DTR HZ2  1 1 
       13 3382 1 1  7 DTR HZ3  H  -7.472 -5.566  -7.848 1.00 . A A .   8 DTR HZ3  1 1 
       13 3383 1 1  7 DTR N    N  -5.354 -3.675  -1.981 1.00 . A A .   8 DTR N    1 1 
       13 3384 1 1  7 DTR NE1  N  -2.670 -3.734  -7.274 1.00 . A A .   8 DTR NE1  1 1 
       13 3385 1 1  7 DTR O    O  -3.901 -1.461  -3.065 1.00 . A A .   8 DTR O    1 1 
       13 3386 1 1  8 LYS C    C  -5.811  0.956  -4.337 1.00 . A A .   9 LYS C    1 1 
       13 3387 1 1  8 LYS CA   C  -5.095 -0.115  -5.155 1.00 . A A .   9 LYS CA   1 1 
       13 3388 1 1  8 LYS CB   C  -5.427  0.015  -6.648 1.00 . A A .   9 LYS CB   1 1 
       13 3389 1 1  8 LYS CD   C  -3.354  1.346  -7.215 1.00 . A A .   9 LYS CD   1 1 
       13 3390 1 1  8 LYS CE   C  -2.695  0.247  -8.035 1.00 . A A .   9 LYS CE   1 1 
       13 3391 1 1  8 LYS CG   C  -4.875  1.281  -7.295 1.00 . A A .   9 LYS CG   1 1 
       13 3392 1 1  8 LYS H    H  -6.234 -1.883  -5.078 1.00 . A A .   9 LYS H    1 1 
       13 3393 1 1  8 LYS HA   H  -4.032  0.002  -5.020 1.00 . A A .   9 LYS HA   1 1 
       13 3394 1 1  8 LYS HB2  H  -5.017 -0.838  -7.168 1.00 . A A .   9 LYS HB2  1 1 
       13 3395 1 1  8 LYS HB3  H  -6.501  0.015  -6.766 1.00 . A A .   9 LYS HB3  1 1 
       13 3396 1 1  8 LYS HD2  H  -3.023  2.304  -7.589 1.00 . A A .   9 LYS HD2  1 1 
       13 3397 1 1  8 LYS HD3  H  -3.054  1.240  -6.182 1.00 . A A .   9 LYS HD3  1 1 
       13 3398 1 1  8 LYS HE2  H  -2.975 -0.712  -7.620 1.00 . A A .   9 LYS HE2  1 1 
       13 3399 1 1  8 LYS HE3  H  -3.047  0.316  -9.054 1.00 . A A .   9 LYS HE3  1 1 
       13 3400 1 1  8 LYS HG2  H  -5.173  1.301  -8.333 1.00 . A A .   9 LYS HG2  1 1 
       13 3401 1 1  8 LYS HG3  H  -5.289  2.140  -6.786 1.00 . A A .   9 LYS HG3  1 1 
       13 3402 1 1  8 LYS HZ1  H  -0.834  0.112  -7.083 1.00 . A A .   9 LYS HZ1  1 1 
       13 3403 1 1  8 LYS HZ2  H  -0.925  1.336  -8.254 1.00 . A A .   9 LYS HZ2  1 1 
       13 3404 1 1  8 LYS HZ3  H  -0.793 -0.279  -8.731 1.00 . A A .   9 LYS HZ3  1 1 
       13 3405 1 1  8 LYS N    N  -5.460 -1.437  -4.677 1.00 . A A .   9 LYS N    1 1 
       13 3406 1 1  8 LYS NZ   N  -1.211  0.362  -8.024 1.00 . A A .   9 LYS NZ   1 1 
       13 3407 1 1  8 LYS O    O  -5.635  2.156  -4.557 1.00 . A A .   9 LYS O    1 1 
       13 3408 1 1  9 THR C    C  -6.454  2.023  -1.446 1.00 . A A .  10 THR C    1 1 
       13 3409 1 1  9 THR CA   C  -7.354  1.416  -2.531 1.00 . A A .  10 THR CA   1 1 
       13 3410 1 1  9 THR CB   C  -8.524  0.664  -1.873 1.00 . A A .  10 THR CB   1 1 
       13 3411 1 1  9 THR CG2  C  -9.747  1.559  -1.754 1.00 . A A .  10 THR CG2  1 1 
       13 3412 1 1  9 THR H    H  -6.703 -0.455  -3.248 1.00 . A A .  10 THR H    1 1 
       13 3413 1 1  9 THR HA   H  -7.753  2.207  -3.152 1.00 . A A .  10 THR HA   1 1 
       13 3414 1 1  9 THR HB   H  -8.222  0.348  -0.887 1.00 . A A .  10 THR HB   1 1 
       13 3415 1 1  9 THR HG1  H  -9.777 -0.744  -2.506 1.00 . A A .  10 THR HG1  1 1 
       13 3416 1 1  9 THR HG21 H -10.546  1.012  -1.276 1.00 . A A .  10 THR HG21 1 1 
       13 3417 1 1  9 THR HG22 H -10.062  1.870  -2.740 1.00 . A A .  10 THR HG22 1 1 
       13 3418 1 1  9 THR HG23 H  -9.499  2.428  -1.165 1.00 . A A .  10 THR HG23 1 1 
       13 3419 1 1  9 THR N    N  -6.595  0.510  -3.371 1.00 . A A .  10 THR N    1 1 
       13 3420 1 1  9 THR O    O  -6.768  3.070  -0.880 1.00 . A A .  10 THR O    1 1 
       13 3421 1 1  9 THR OG1  O  -8.852 -0.493  -2.662 1.00 . A A .  10 THR OG1  1 1 
       13 3422 1 1 10 PHE C    C  -2.927  1.843  -1.032 1.00 . A A .  11 PHE C    1 1 
       13 3423 1 1 10 PHE CA   C  -4.300  1.949  -0.317 1.00 . A A .  11 PHE CA   1 1 
       13 3424 1 1 10 PHE CB   C  -4.238  1.181   1.010 1.00 . A A .  11 PHE CB   1 1 
       13 3425 1 1 10 PHE CD1  C  -3.829  2.622   3.024 1.00 . A A .  11 PHE CD1  1 1 
       13 3426 1 1 10 PHE CD2  C  -1.953  1.560   2.004 1.00 . A A .  11 PHE CD2  1 1 
       13 3427 1 1 10 PHE CE1  C  -2.996  3.190   3.970 1.00 . A A .  11 PHE CE1  1 1 
       13 3428 1 1 10 PHE CE2  C  -1.115  2.128   2.944 1.00 . A A .  11 PHE CE2  1 1 
       13 3429 1 1 10 PHE CG   C  -3.321  1.801   2.031 1.00 . A A .  11 PHE CG   1 1 
       13 3430 1 1 10 PHE CZ   C  -1.638  2.943   3.929 1.00 . A A .  11 PHE CZ   1 1 
       13 3431 1 1 10 PHE H    H  -5.171  0.488  -1.567 1.00 . A A .  11 PHE H    1 1 
       13 3432 1 1 10 PHE HA   H  -4.575  2.972  -0.106 1.00 . A A .  11 PHE HA   1 1 
       13 3433 1 1 10 PHE HB2  H  -5.228  1.137   1.438 1.00 . A A .  11 PHE HB2  1 1 
       13 3434 1 1 10 PHE HB3  H  -3.888  0.176   0.817 1.00 . A A .  11 PHE HB3  1 1 
       13 3435 1 1 10 PHE HD1  H  -4.890  2.816   3.059 1.00 . A A .  11 PHE HD1  1 1 
       13 3436 1 1 10 PHE HD2  H  -1.545  0.926   1.232 1.00 . A A .  11 PHE HD2  1 1 
       13 3437 1 1 10 PHE HE1  H  -3.407  3.829   4.738 1.00 . A A .  11 PHE HE1  1 1 
       13 3438 1 1 10 PHE HE2  H  -0.053  1.934   2.910 1.00 . A A .  11 PHE HE2  1 1 
       13 3439 1 1 10 PHE HZ   H  -0.984  3.386   4.668 1.00 . A A .  11 PHE HZ   1 1 
       13 3440 1 1 10 PHE N    N  -5.324  1.369  -1.172 1.00 . A A .  11 PHE N    1 1 
       13 3441 1 1 10 PHE O    O  -2.420  0.731  -1.182 1.00 . A A .  11 PHE O    1 1 
       13 3442 1 1 11 THR C    C  -0.109  3.991  -1.399 1.00 . A A .  12 THR C    1 1 
       13 3443 1 1 11 THR CA   C  -0.964  2.887  -2.017 1.00 . A A .  12 THR CA   1 1 
       13 3444 1 1 11 THR CB   C  -0.945  2.994  -3.556 1.00 . A A .  12 THR CB   1 1 
       13 3445 1 1 11 THR CG2  C   0.471  2.885  -4.103 1.00 . A A .  12 THR CG2  1 1 
       13 3446 1 1 11 THR H    H  -2.795  3.805  -1.564 1.00 . A A .  12 THR H    1 1 
       13 3447 1 1 11 THR HA   H  -0.547  1.928  -1.742 1.00 . A A .  12 THR HA   1 1 
       13 3448 1 1 11 THR HB   H  -1.357  3.949  -3.846 1.00 . A A .  12 THR HB   1 1 
       13 3449 1 1 11 THR HG1  H  -1.944  1.297  -3.430 1.00 . A A .  12 THR HG1  1 1 
       13 3450 1 1 11 THR HG21 H   0.449  2.959  -5.181 1.00 . A A .  12 THR HG21 1 1 
       13 3451 1 1 11 THR HG22 H   0.895  1.935  -3.817 1.00 . A A .  12 THR HG22 1 1 
       13 3452 1 1 11 THR HG23 H   1.073  3.685  -3.701 1.00 . A A .  12 THR HG23 1 1 
       13 3453 1 1 11 THR N    N  -2.321  2.946  -1.507 1.00 . A A .  12 THR N    1 1 
       13 3454 1 1 11 THR O    O  -0.365  5.173  -1.619 1.00 . A A .  12 THR O    1 1 
       13 3455 1 1 11 THR OG1  O  -1.752  1.949  -4.115 1.00 . A A .  12 THR OG1  1 1 
       13 3456 1 1 12 SER C    C   3.244  4.243  -0.458 1.00 . A A .  13 SER C    1 1 
       13 3457 1 1 12 SER CA   C   1.808  4.587  -0.058 1.00 . A A .  13 SER CA   1 1 
       13 3458 1 1 12 SER CB   C   1.684  4.639   1.465 1.00 . A A .  13 SER CB   1 1 
       13 3459 1 1 12 SER H    H   0.990  2.668  -0.386 1.00 . A A .  13 SER H    1 1 
       13 3460 1 1 12 SER HA   H   1.545  5.554  -0.461 1.00 . A A .  13 SER HA   1 1 
       13 3461 1 1 12 SER HB2  H   1.892  3.661   1.874 1.00 . A A .  13 SER HB2  1 1 
       13 3462 1 1 12 SER HB3  H   2.392  5.353   1.859 1.00 . A A .  13 SER HB3  1 1 
       13 3463 1 1 12 SER HG   H  -0.002  5.605   1.176 1.00 . A A .  13 SER HG   1 1 
       13 3464 1 1 12 SER N    N   0.881  3.615  -0.609 1.00 . A A .  13 SER N    1 1 
       13 3465 1 1 12 SER O    O   3.792  3.236  -0.006 1.00 . A A .  13 SER O    1 1 
       13 3466 1 1 12 SER OG   O   0.376  5.028   1.856 1.00 . A A .  13 SER OG   1 1 
       13 3467 1 1 13 CYS C    C   5.940  6.235  -1.592 1.00 . A A .  14 CYS C    1 1 
       13 3468 1 1 13 CYS CA   C   5.224  4.895  -1.704 1.00 . A A .  14 CYS CA   1 1 
       13 3469 1 1 13 CYS CB   C   5.344  4.339  -3.125 1.00 . A A .  14 CYS CB   1 1 
       13 3470 1 1 13 CYS H    H   3.308  5.776  -1.753 1.00 . A A .  14 CYS H    1 1 
       13 3471 1 1 13 CYS HA   H   5.675  4.199  -1.012 1.00 . A A .  14 CYS HA   1 1 
       13 3472 1 1 13 CYS HB2  H   4.850  5.013  -3.809 1.00 . A A .  14 CYS HB2  1 1 
       13 3473 1 1 13 CYS HB3  H   6.389  4.269  -3.387 1.00 . A A .  14 CYS HB3  1 1 
       13 3474 1 1 13 CYS N    N   3.829  5.050  -1.334 1.00 . A A .  14 CYS N    1 1 
       13 3475 1 1 13 CYS O    O   5.682  7.153  -2.371 1.00 . A A .  14 CYS O    1 1 
       13 3476 1 1 13 CYS SG   S   4.601  2.686  -3.341 1.00 . A A .  14 CYS SG   1 1 
       13 3477 1 1 14 LYS C    C   9.036  7.302  -0.271 1.00 . A A .  15 LYS C    1 1 
       13 3478 1 1 14 LYS CA   C   7.545  7.585  -0.366 1.00 . A A .  15 LYS CA   1 1 
       13 3479 1 1 14 LYS CB   C   7.060  8.258   0.922 1.00 . A A .  15 LYS CB   1 1 
       13 3480 1 1 14 LYS CD   C   5.344  9.787  -0.151 1.00 . A A .  15 LYS CD   1 1 
       13 3481 1 1 14 LYS CE   C   5.828 11.166   0.297 1.00 . A A .  15 LYS CE   1 1 
       13 3482 1 1 14 LYS CG   C   5.604  8.700   0.889 1.00 . A A .  15 LYS CG   1 1 
       13 3483 1 1 14 LYS H    H   6.983  5.583  -0.025 1.00 . A A .  15 LYS H    1 1 
       13 3484 1 1 14 LYS HA   H   7.369  8.247  -1.200 1.00 . A A .  15 LYS HA   1 1 
       13 3485 1 1 14 LYS HB2  H   7.181  7.567   1.743 1.00 . A A .  15 LYS HB2  1 1 
       13 3486 1 1 14 LYS HB3  H   7.672  9.130   1.108 1.00 . A A .  15 LYS HB3  1 1 
       13 3487 1 1 14 LYS HD2  H   5.854  9.523  -1.066 1.00 . A A .  15 LYS HD2  1 1 
       13 3488 1 1 14 LYS HD3  H   4.279  9.835  -0.338 1.00 . A A .  15 LYS HD3  1 1 
       13 3489 1 1 14 LYS HE2  H   5.436 11.905  -0.385 1.00 . A A .  15 LYS HE2  1 1 
       13 3490 1 1 14 LYS HE3  H   5.446 11.360   1.287 1.00 . A A .  15 LYS HE3  1 1 
       13 3491 1 1 14 LYS HG2  H   4.989  7.844   0.657 1.00 . A A .  15 LYS HG2  1 1 
       13 3492 1 1 14 LYS HG3  H   5.337  9.079   1.864 1.00 . A A .  15 LYS HG3  1 1 
       13 3493 1 1 14 LYS HZ1  H   7.707 10.688   1.087 1.00 . A A .  15 LYS HZ1  1 1 
       13 3494 1 1 14 LYS HZ2  H   7.597 12.269   0.488 1.00 . A A .  15 LYS HZ2  1 1 
       13 3495 1 1 14 LYS HZ3  H   7.714 10.963  -0.587 1.00 . A A .  15 LYS HZ3  1 1 
       13 3496 1 1 14 LYS N    N   6.816  6.352  -0.608 1.00 . A A .  15 LYS N    1 1 
       13 3497 1 1 14 LYS NZ   N   7.313 11.277   0.323 1.00 . A A .  15 LYS NZ   1 1 
       13 3498 1 1 14 LYS O    O   9.486  6.818   0.785 1.00 . A A .  15 LYS O    1 1 
       13 3499 1 1 14 LYS OXT  O   9.755  7.563  -1.255 1.00 . A A .  15 LYS OXT  1 1 
       13 3500 2 2  1 .   C1   C   9.907  1.373   1.659 1.00 . B A . 101 OCA C1   1 1 
       13 3501 2 2  1 .   C2   C   9.593  1.970   0.287 1.00 . B A . 101 OCA C2   1 1 
       13 3502 2 2  1 .   C3   C   8.289  2.767   0.258 1.00 . B A . 101 OCA C3   1 1 
       13 3503 2 2  1 .   C4   C   8.161  3.701   1.452 1.00 . B A . 101 OCA C4   1 1 
       13 3504 2 2  1 .   C5   C   6.710  4.061   1.728 1.00 . B A . 101 OCA C5   1 1 
       13 3505 2 2  1 .   C6   C   6.120  3.216   2.844 1.00 . B A . 101 OCA C6   1 1 
       13 3506 2 2  1 .   C7   C   5.125  4.009   3.673 1.00 . B A . 101 OCA C7   1 1 
       13 3507 2 2  1 .   C8   C   4.522  3.171   4.776 1.00 . B A . 101 OCA C8   1 1 
       13 3508 2 2  1 .   H21  H   9.518  1.162  -0.427 1.00 . B A . 101 OCA H21  1 1 
       13 3509 2 2  1 .   H22  H  10.404  2.623   0.001 1.00 . B A . 101 OCA H22  1 1 
       13 3510 2 2  1 .   H31  H   7.460  2.077   0.265 1.00 . B A . 101 OCA H31  1 1 
       13 3511 2 2  1 .   H32  H   8.260  3.355  -0.649 1.00 . B A . 101 OCA H32  1 1 
       13 3512 2 2  1 .   H41  H   8.573  3.213   2.325 1.00 . B A . 101 OCA H41  1 1 
       13 3513 2 2  1 .   H42  H   8.715  4.606   1.250 1.00 . B A . 101 OCA H42  1 1 
       13 3514 2 2  1 .   H51  H   6.656  5.103   2.012 1.00 . B A . 101 OCA H51  1 1 
       13 3515 2 2  1 .   H52  H   6.135  3.903   0.827 1.00 . B A . 101 OCA H52  1 1 
       13 3516 2 2  1 .   H61  H   5.614  2.365   2.411 1.00 . B A . 101 OCA H61  1 1 
       13 3517 2 2  1 .   H62  H   6.919  2.875   3.487 1.00 . B A . 101 OCA H62  1 1 
       13 3518 2 2  1 .   H71  H   4.328  4.357   3.032 1.00 . B A . 101 OCA H71  1 1 
       13 3519 2 2  1 .   H72  H   5.630  4.853   4.120 1.00 . B A . 101 OCA H72  1 1 
       13 3520 2 2  1 .   H81  H   3.670  3.687   5.195 1.00 . B A . 101 OCA H81  1 1 
       13 3521 2 2  1 .   H82  H   5.259  3.007   5.550 1.00 . B A . 101 OCA H82  1 1 
       13 3522 2 2  1 .   H83  H   4.205  2.221   4.374 1.00 . B A . 101 OCA H83  1 1 
       13 3523 2 2  1 .   O1   O  10.521  1.972   2.543 1.00 . B A . 101 OCA O1   1 1 
       14 3524 1 1  1 PRO C    C   7.157  0.242   0.268 1.00 . A A .   2 PRO C    1 1 
       14 3525 1 1  1 PRO CA   C   8.605 -0.135   0.588 1.00 . A A .   2 PRO CA   1 1 
       14 3526 1 1  1 PRO CB   C   9.572  0.787  -0.150 1.00 . A A .   2 PRO CB   1 1 
       14 3527 1 1  1 PRO CD   C   9.664 -1.370  -1.222 1.00 . A A .   2 PRO CD   1 1 
       14 3528 1 1  1 PRO CG   C   9.801  0.115  -1.462 1.00 . A A .   2 PRO CG   1 1 
       14 3529 1 1  1 PRO HA   H   8.770 -0.059   1.652 1.00 . A A .   2 PRO HA   1 1 
       14 3530 1 1  1 PRO HB2  H   9.120  1.760  -0.275 1.00 . A A .   2 PRO HB2  1 1 
       14 3531 1 1  1 PRO HB3  H  10.489  0.876   0.410 1.00 . A A .   2 PRO HB3  1 1 
       14 3532 1 1  1 PRO HD2  H   9.071 -1.824  -2.001 1.00 . A A .   2 PRO HD2  1 1 
       14 3533 1 1  1 PRO HD3  H  10.639 -1.833  -1.172 1.00 . A A .   2 PRO HD3  1 1 
       14 3534 1 1  1 PRO HG2  H   9.059  0.445  -2.175 1.00 . A A .   2 PRO HG2  1 1 
       14 3535 1 1  1 PRO HG3  H  10.793  0.345  -1.823 1.00 . A A .   2 PRO HG3  1 1 
       14 3536 1 1  1 PRO N    N   8.972 -1.464   0.080 1.00 . A A .   2 PRO N    1 1 
       14 3537 1 1  1 PRO O    O   6.686  1.314   0.650 1.00 . A A .   2 PRO O    1 1 
       14 3538 1 1  2 CYS C    C   4.225 -1.581  -0.199 1.00 . A A .   3 CYS C    1 1 
       14 3539 1 1  2 CYS CA   C   5.060 -0.437  -0.761 1.00 . A A .   3 CYS CA   1 1 
       14 3540 1 1  2 CYS CB   C   4.850 -0.339  -2.273 1.00 . A A .   3 CYS CB   1 1 
       14 3541 1 1  2 CYS H    H   6.920 -1.442  -0.789 1.00 . A A .   3 CYS H    1 1 
       14 3542 1 1  2 CYS HA   H   4.745  0.491  -0.301 1.00 . A A .   3 CYS HA   1 1 
       14 3543 1 1  2 CYS HB2  H   5.182 -1.257  -2.734 1.00 . A A .   3 CYS HB2  1 1 
       14 3544 1 1  2 CYS HB3  H   3.796 -0.205  -2.473 1.00 . A A .   3 CYS HB3  1 1 
       14 3545 1 1  2 CYS N    N   6.467 -0.637  -0.449 1.00 . A A .   3 CYS N    1 1 
       14 3546 1 1  2 CYS O    O   4.318 -2.719  -0.667 1.00 . A A .   3 CYS O    1 1 
       14 3547 1 1  2 CYS SG   S   5.747  1.033  -3.069 1.00 . A A .   3 CYS SG   1 1 
       14 3548 1 1  3 LYS C    C   1.119 -1.969   1.086 1.00 . A A .   4 LYS C    1 1 
       14 3549 1 1  3 LYS CA   C   2.566 -2.298   1.403 1.00 . A A .   4 LYS CA   1 1 
       14 3550 1 1  3 LYS CB   C   2.749 -2.367   2.922 1.00 . A A .   4 LYS CB   1 1 
       14 3551 1 1  3 LYS CD   C   3.136 -4.830   3.215 1.00 . A A .   4 LYS CD   1 1 
       14 3552 1 1  3 LYS CE   C   2.559 -6.142   3.722 1.00 . A A .   4 LYS CE   1 1 
       14 3553 1 1  3 LYS CG   C   2.228 -3.654   3.538 1.00 . A A .   4 LYS CG   1 1 
       14 3554 1 1  3 LYS H    H   3.432 -0.384   1.188 1.00 . A A .   4 LYS H    1 1 
       14 3555 1 1  3 LYS HA   H   2.818 -3.255   0.970 1.00 . A A .   4 LYS HA   1 1 
       14 3556 1 1  3 LYS HB2  H   3.800 -2.277   3.152 1.00 . A A .   4 LYS HB2  1 1 
       14 3557 1 1  3 LYS HB3  H   2.216 -1.539   3.373 1.00 . A A .   4 LYS HB3  1 1 
       14 3558 1 1  3 LYS HD2  H   3.261 -4.893   2.144 1.00 . A A .   4 LYS HD2  1 1 
       14 3559 1 1  3 LYS HD3  H   4.097 -4.666   3.681 1.00 . A A .   4 LYS HD3  1 1 
       14 3560 1 1  3 LYS HE2  H   2.272 -6.023   4.757 1.00 . A A .   4 LYS HE2  1 1 
       14 3561 1 1  3 LYS HE3  H   1.687 -6.389   3.133 1.00 . A A .   4 LYS HE3  1 1 
       14 3562 1 1  3 LYS HG2  H   2.176 -3.536   4.610 1.00 . A A .   4 LYS HG2  1 1 
       14 3563 1 1  3 LYS HG3  H   1.241 -3.856   3.147 1.00 . A A .   4 LYS HG3  1 1 
       14 3564 1 1  3 LYS HZ1  H   3.062 -8.171   3.736 1.00 . A A .   4 LYS HZ1  1 1 
       14 3565 1 1  3 LYS HZ2  H   4.266 -7.158   4.366 1.00 . A A .   4 LYS HZ2  1 1 
       14 3566 1 1  3 LYS HZ3  H   4.019 -7.234   2.690 1.00 . A A .   4 LYS HZ3  1 1 
       14 3567 1 1  3 LYS N    N   3.436 -1.293   0.821 1.00 . A A .   4 LYS N    1 1 
       14 3568 1 1  3 LYS NZ   N   3.542 -7.252   3.619 1.00 . A A .   4 LYS NZ   1 1 
       14 3569 1 1  3 LYS O    O   0.584 -0.976   1.579 1.00 . A A .   4 LYS O    1 1 
       14 3570 1 1  4 ASN C    C  -1.730 -3.691   0.594 1.00 . A A .   5 ASN C    1 1 
       14 3571 1 1  4 ASN CA   C  -0.916 -2.564  -0.043 1.00 . A A .   5 ASN CA   1 1 
       14 3572 1 1  4 ASN CB   C  -1.151 -2.558  -1.558 1.00 . A A .   5 ASN CB   1 1 
       14 3573 1 1  4 ASN CG   C  -0.218 -1.616  -2.301 1.00 . A A .   5 ASN CG   1 1 
       14 3574 1 1  4 ASN H    H   0.971 -3.525  -0.170 1.00 . A A .   5 ASN H    1 1 
       14 3575 1 1  4 ASN HA   H  -1.207 -1.609   0.364 1.00 . A A .   5 ASN HA   1 1 
       14 3576 1 1  4 ASN HB2  H  -0.996 -3.556  -1.941 1.00 . A A .   5 ASN HB2  1 1 
       14 3577 1 1  4 ASN HB3  H  -2.168 -2.256  -1.756 1.00 . A A .   5 ASN HB3  1 1 
       14 3578 1 1  4 ASN HD21 H  -1.547 -0.140  -2.182 1.00 . A A .   5 ASN HD21 1 1 
       14 3579 1 1  4 ASN HD22 H  -0.070  0.230  -3.001 1.00 . A A .   5 ASN HD22 1 1 
       14 3580 1 1  4 ASN N    N   0.485 -2.776   0.252 1.00 . A A .   5 ASN N    1 1 
       14 3581 1 1  4 ASN ND2  N  -0.653 -0.385  -2.514 1.00 . A A .   5 ASN ND2  1 1 
       14 3582 1 1  4 ASN O    O  -1.652 -4.838   0.156 1.00 . A A .   5 ASN O    1 1 
       14 3583 1 1  4 ASN OD1  O   0.883 -1.998  -2.691 1.00 . A A .   5 ASN OD1  1 1 
       14 3584 1 1  5 .   C    C  -4.492 -4.806   1.450 1.00 . A A .   6 O6H C    1 1 
       14 3585 1 1  5 .   CA   C  -3.309 -4.377   2.310 1.00 . A A .   6 O6H CA   1 1 
       14 3586 1 1  5 .   CB   C  -3.797 -3.853   3.662 1.00 . A A .   6 O6H CB   1 1 
       14 3587 1 1  5 .   CD1  C  -2.370 -2.041   4.680 1.00 . A A .   6 O6H CD1  1 1 
       14 3588 1 1  5 .   CD2  C  -1.941 -4.299   5.318 1.00 . A A .   6 O6H CD2  1 1 
       14 3589 1 1  5 .   CE1  C  -1.353 -1.606   5.502 1.00 . A A .   6 O6H CE1  1 1 
       14 3590 1 1  5 .   CE2  C  -0.920 -3.873   6.148 1.00 . A A .   6 O6H CE2  1 1 
       14 3591 1 1  5 .   CF1  C  -3.148 -1.029   3.893 1.00 . A A .   6 O6H CF1  1 1 
       14 3592 1 1  5 .   CF2  C  -2.250 -5.768   5.234 1.00 . A A .   6 O6H CF2  1 1 
       14 3593 1 1  5 .   CG   C  -2.685 -3.391   4.570 1.00 . A A .   6 O6H CG   1 1 
       14 3594 1 1  5 .   CH   C   0.475 -2.056   7.123 1.00 . A A .   6 O6H CH   1 1 
       14 3595 1 1  5 .   CZ   C  -0.632 -2.527   6.232 1.00 . A A .   6 O6H CZ   1 1 
       14 3596 1 1  5 .   H1   H  -2.491 -2.464   1.988 1.00 . A A .   6 O6H H1   1 1 
       14 3597 1 1  5 .   HA   H  -2.686 -5.241   2.483 1.00 . A A .   6 O6H HA   1 1 
       14 3598 1 1  5 .   HB1  H  -4.336 -4.639   4.171 1.00 . A A .   6 O6H HB1  1 1 
       14 3599 1 1  5 .   HB2  H  -4.459 -3.017   3.498 1.00 . A A .   6 O6H HB2  1 1 
       14 3600 1 1  5 .   HE1  H  -1.123 -0.554   5.573 1.00 . A A .   6 O6H HE1  1 1 
       14 3601 1 1  5 .   HE2  H  -0.350 -4.590   6.722 1.00 . A A .   6 O6H HE2  1 1 
       14 3602 1 1  5 .   HF11 H  -4.000 -1.450   3.378 1.00 . A A .   6 O6H HF11 1 1 
       14 3603 1 1  5 .   HF12 H  -2.565 -0.542   3.127 1.00 . A A .   6 O6H HF12 1 1 
       14 3604 1 1  5 .   HF13 H  -3.546 -0.229   4.499 1.00 . A A .   6 O6H HF13 1 1 
       14 3605 1 1  5 .   HF21 H  -1.368 -6.389   5.180 1.00 . A A .   6 O6H HF21 1 1 
       14 3606 1 1  5 .   HF22 H  -2.839 -6.033   4.368 1.00 . A A .   6 O6H HF22 1 1 
       14 3607 1 1  5 .   HF23 H  -2.807 -6.138   6.082 1.00 . A A .   6 O6H HF23 1 1 
       14 3608 1 1  5 .   HH1  H   1.359 -2.672   7.065 1.00 . A A .   6 O6H HH1  1 1 
       14 3609 1 1  5 .   HH2  H   0.809 -1.053   6.898 1.00 . A A .   6 O6H HH2  1 1 
       14 3610 1 1  5 .   HH3  H   0.206 -2.039   8.168 1.00 . A A .   6 O6H HH3  1 1 
       14 3611 1 1  5 .   N    N  -2.491 -3.379   1.642 1.00 . A A .   6 O6H N    1 1 
       14 3612 1 1  5 .   O    O  -4.859 -5.979   1.421 1.00 . A A .   6 O6H O    1 1 
       14 3613 1 1  6 PHE C    C  -6.262 -4.060  -1.411 1.00 . A A .   7 PHE C    1 1 
       14 3614 1 1  6 PHE CA   C  -6.382 -4.063   0.112 1.00 . A A .   7 PHE CA   1 1 
       14 3615 1 1  6 PHE CB   C  -7.392 -3.009   0.573 1.00 . A A .   7 PHE CB   1 1 
       14 3616 1 1  6 PHE CD1  C  -7.854 -3.859   2.895 1.00 . A A .   7 PHE CD1  1 1 
       14 3617 1 1  6 PHE CD2  C  -7.003 -1.645   2.644 1.00 . A A .   7 PHE CD2  1 1 
       14 3618 1 1  6 PHE CE1  C  -7.867 -3.699   4.269 1.00 . A A .   7 PHE CE1  1 1 
       14 3619 1 1  6 PHE CE2  C  -7.017 -1.480   4.015 1.00 . A A .   7 PHE CE2  1 1 
       14 3620 1 1  6 PHE CG   C  -7.421 -2.834   2.067 1.00 . A A .   7 PHE CG   1 1 
       14 3621 1 1  6 PHE CZ   C  -7.448 -2.508   4.828 1.00 . A A .   7 PHE CZ   1 1 
       14 3622 1 1  6 PHE H    H  -4.679 -2.959   0.716 1.00 . A A .   7 PHE H    1 1 
       14 3623 1 1  6 PHE HA   H  -6.737 -5.035   0.422 1.00 . A A .   7 PHE HA   1 1 
       14 3624 1 1  6 PHE HB2  H  -7.138 -2.058   0.130 1.00 . A A .   7 PHE HB2  1 1 
       14 3625 1 1  6 PHE HB3  H  -8.381 -3.300   0.251 1.00 . A A .   7 PHE HB3  1 1 
       14 3626 1 1  6 PHE HD1  H  -8.183 -4.792   2.459 1.00 . A A .   7 PHE HD1  1 1 
       14 3627 1 1  6 PHE HD2  H  -6.666 -0.840   2.010 1.00 . A A .   7 PHE HD2  1 1 
       14 3628 1 1  6 PHE HE1  H  -8.205 -4.504   4.905 1.00 . A A .   7 PHE HE1  1 1 
       14 3629 1 1  6 PHE HE2  H  -6.694 -0.545   4.450 1.00 . A A .   7 PHE HE2  1 1 
       14 3630 1 1  6 PHE HZ   H  -7.452 -2.382   5.901 1.00 . A A .   7 PHE HZ   1 1 
       14 3631 1 1  6 PHE N    N  -5.099 -3.841   0.769 1.00 . A A .   7 PHE N    1 1 
       14 3632 1 1  6 PHE O    O  -7.155 -4.540  -2.108 1.00 . A A .   7 PHE O    1 1 
       14 3633 1 1  7 DTR C    C  -4.719 -2.009  -3.866 1.00 . A A .   8 DTR C    1 1 
       14 3634 1 1  7 DTR CA   C  -4.992 -3.435  -3.371 1.00 . A A .   8 DTR CA   1 1 
       14 3635 1 1  7 DTR CB   C  -3.850 -4.370  -3.792 1.00 . A A .   8 DTR CB   1 1 
       14 3636 1 1  7 DTR CD1  C  -4.271 -4.770  -6.287 1.00 . A A .   8 DTR CD1  1 1 
       14 3637 1 1  7 DTR CD2  C  -2.402 -3.619  -5.841 1.00 . A A .   8 DTR CD2  1 1 
       14 3638 1 1  7 DTR CE2  C  -2.526 -3.752  -7.234 1.00 . A A .   8 DTR CE2  1 1 
       14 3639 1 1  7 DTR CE3  C  -1.299 -2.935  -5.326 1.00 . A A .   8 DTR CE3  1 1 
       14 3640 1 1  7 DTR CG   C  -3.534 -4.271  -5.252 1.00 . A A .   8 DTR CG   1 1 
       14 3641 1 1  7 DTR CH2  C  -0.526 -2.556  -7.589 1.00 . A A .   8 DTR CH2  1 1 
       14 3642 1 1  7 DTR CZ2  C  -1.595 -3.223  -8.118 1.00 . A A .   8 DTR CZ2  1 1 
       14 3643 1 1  7 DTR CZ3  C  -0.370 -2.412  -6.205 1.00 . A A .   8 DTR CZ3  1 1 
       14 3644 1 1  7 DTR H    H  -4.523 -3.078  -1.343 1.00 . A A .   8 DTR H    1 1 
       14 3645 1 1  7 DTR HA   H  -5.883 -3.831  -3.841 1.00 . A A .   8 DTR HA   1 1 
       14 3646 1 1  7 DTR HB2  H  -2.959 -4.117  -3.237 1.00 . A A .   8 DTR HB2  1 1 
       14 3647 1 1  7 DTR HB3  H  -4.127 -5.392  -3.577 1.00 . A A .   8 DTR HB3  1 1 
       14 3648 1 1  7 DTR HD1  H  -5.191 -5.322  -6.170 1.00 . A A .   8 DTR HD1  1 1 
       14 3649 1 1  7 DTR HE1  H  -4.014 -4.695  -8.374 1.00 . A A .   8 DTR HE1  1 1 
       14 3650 1 1  7 DTR HE3  H  -1.165 -2.814  -4.262 1.00 . A A .   8 DTR HE3  1 1 
       14 3651 1 1  7 DTR HH2  H   0.224 -2.134  -8.240 1.00 . A A .   8 DTR HH2  1 1 
       14 3652 1 1  7 DTR HZ2  H  -1.710 -3.311  -9.185 1.00 . A A .   8 DTR HZ2  1 1 
       14 3653 1 1  7 DTR HZ3  H   0.490 -1.879  -5.825 1.00 . A A .   8 DTR HZ3  1 1 
       14 3654 1 1  7 DTR N    N  -5.191 -3.480  -1.931 1.00 . A A .   8 DTR N    1 1 
       14 3655 1 1  7 DTR NE1  N  -3.674 -4.453  -7.482 1.00 . A A .   8 DTR NE1  1 1 
       14 3656 1 1  7 DTR O    O  -3.848 -1.328  -3.326 1.00 . A A .   8 DTR O    1 1 
       14 3657 1 1  8 LYS C    C  -5.963  0.861  -4.777 1.00 . A A .   9 LYS C    1 1 
       14 3658 1 1  8 LYS CA   C  -5.202 -0.246  -5.489 1.00 . A A .   9 LYS CA   1 1 
       14 3659 1 1  8 LYS CB   C  -5.603 -0.266  -6.970 1.00 . A A .   9 LYS CB   1 1 
       14 3660 1 1  8 LYS CD   C  -3.404 -0.479  -8.179 1.00 . A A .   9 LYS CD   1 1 
       14 3661 1 1  8 LYS CE   C  -3.544  0.619  -9.232 1.00 . A A .   9 LYS CE   1 1 
       14 3662 1 1  8 LYS CG   C  -4.733 -1.147  -7.841 1.00 . A A .   9 LYS CG   1 1 
       14 3663 1 1  8 LYS H    H  -6.219 -2.081  -5.221 1.00 . A A .   9 LYS H    1 1 
       14 3664 1 1  8 LYS HA   H  -4.142 -0.053  -5.413 1.00 . A A .   9 LYS HA   1 1 
       14 3665 1 1  8 LYS HB2  H  -6.621 -0.612  -7.051 1.00 . A A .   9 LYS HB2  1 1 
       14 3666 1 1  8 LYS HB3  H  -5.541  0.736  -7.357 1.00 . A A .   9 LYS HB3  1 1 
       14 3667 1 1  8 LYS HD2  H  -2.996 -0.044  -7.280 1.00 . A A .   9 LYS HD2  1 1 
       14 3668 1 1  8 LYS HD3  H  -2.726 -1.232  -8.550 1.00 . A A .   9 LYS HD3  1 1 
       14 3669 1 1  8 LYS HE2  H  -2.557  0.909  -9.561 1.00 . A A .   9 LYS HE2  1 1 
       14 3670 1 1  8 LYS HE3  H  -4.096  0.222 -10.070 1.00 . A A .   9 LYS HE3  1 1 
       14 3671 1 1  8 LYS HG2  H  -4.538 -2.072  -7.319 1.00 . A A .   9 LYS HG2  1 1 
       14 3672 1 1  8 LYS HG3  H  -5.260 -1.357  -8.759 1.00 . A A .   9 LYS HG3  1 1 
       14 3673 1 1  8 LYS HZ1  H  -3.899  2.056  -7.759 1.00 . A A .   9 LYS HZ1  1 1 
       14 3674 1 1  8 LYS HZ2  H  -5.276  1.649  -8.672 1.00 . A A .   9 LYS HZ2  1 1 
       14 3675 1 1  8 LYS HZ3  H  -4.072  2.636  -9.340 1.00 . A A .   9 LYS HZ3  1 1 
       14 3676 1 1  8 LYS N    N  -5.470 -1.543  -4.874 1.00 . A A .   9 LYS N    1 1 
       14 3677 1 1  8 LYS NZ   N  -4.249  1.821  -8.715 1.00 . A A .   9 LYS NZ   1 1 
       14 3678 1 1  8 LYS O    O  -5.854  2.030  -5.137 1.00 . A A .   9 LYS O    1 1 
       14 3679 1 1  9 THR C    C  -6.639  2.154  -1.958 1.00 . A A .  10 THR C    1 1 
       14 3680 1 1  9 THR CA   C  -7.508  1.440  -2.998 1.00 . A A .  10 THR CA   1 1 
       14 3681 1 1  9 THR CB   C  -8.692  0.741  -2.307 1.00 . A A .  10 THR CB   1 1 
       14 3682 1 1  9 THR CG2  C  -9.795  0.433  -3.305 1.00 . A A .  10 THR CG2  1 1 
       14 3683 1 1  9 THR H    H  -6.806 -0.470  -3.558 1.00 . A A .  10 THR H    1 1 
       14 3684 1 1  9 THR HA   H  -7.905  2.175  -3.682 1.00 . A A .  10 THR HA   1 1 
       14 3685 1 1  9 THR HB   H  -9.089  1.401  -1.547 1.00 . A A .  10 THR HB   1 1 
       14 3686 1 1  9 THR HG1  H  -8.202 -0.335  -0.724 1.00 . A A .  10 THR HG1  1 1 
       14 3687 1 1  9 THR HG21 H  -9.410 -0.216  -4.078 1.00 . A A .  10 THR HG21 1 1 
       14 3688 1 1  9 THR HG22 H -10.146  1.354  -3.748 1.00 . A A .  10 THR HG22 1 1 
       14 3689 1 1  9 THR HG23 H -10.613 -0.057  -2.798 1.00 . A A .  10 THR HG23 1 1 
       14 3690 1 1  9 THR N    N  -6.734  0.483  -3.772 1.00 . A A .  10 THR N    1 1 
       14 3691 1 1  9 THR O    O  -6.871  3.321  -1.632 1.00 . A A .  10 THR O    1 1 
       14 3692 1 1  9 THR OG1  O  -8.249 -0.476  -1.687 1.00 . A A .  10 THR OG1  1 1 
       14 3693 1 1 10 PHE C    C  -3.273  2.060  -1.080 1.00 . A A .  11 PHE C    1 1 
       14 3694 1 1 10 PHE CA   C  -4.708  2.043  -0.487 1.00 . A A .  11 PHE CA   1 1 
       14 3695 1 1 10 PHE CB   C  -4.710  1.217   0.802 1.00 . A A .  11 PHE CB   1 1 
       14 3696 1 1 10 PHE CD1  C  -4.846  2.550   2.925 1.00 . A A .  11 PHE CD1  1 1 
       14 3697 1 1 10 PHE CD2  C  -2.688  1.951   2.110 1.00 . A A .  11 PHE CD2  1 1 
       14 3698 1 1 10 PHE CE1  C  -4.266  3.197   3.998 1.00 . A A .  11 PHE CE1  1 1 
       14 3699 1 1 10 PHE CE2  C  -2.103  2.597   3.181 1.00 . A A .  11 PHE CE2  1 1 
       14 3700 1 1 10 PHE CG   C  -4.067  1.919   1.968 1.00 . A A .  11 PHE CG   1 1 
       14 3701 1 1 10 PHE CZ   C  -2.893  3.220   4.126 1.00 . A A .  11 PHE CZ   1 1 
       14 3702 1 1 10 PHE H    H  -5.479  0.537  -1.746 1.00 . A A .  11 PHE H    1 1 
       14 3703 1 1 10 PHE HA   H  -5.065  3.035  -0.254 1.00 . A A .  11 PHE HA   1 1 
       14 3704 1 1 10 PHE HB2  H  -5.730  0.989   1.074 1.00 . A A .  11 PHE HB2  1 1 
       14 3705 1 1 10 PHE HB3  H  -4.173  0.295   0.631 1.00 . A A .  11 PHE HB3  1 1 
       14 3706 1 1 10 PHE HD1  H  -5.921  2.530   2.826 1.00 . A A .  11 PHE HD1  1 1 
       14 3707 1 1 10 PHE HD2  H  -2.069  1.465   1.370 1.00 . A A .  11 PHE HD2  1 1 
       14 3708 1 1 10 PHE HE1  H  -4.887  3.686   4.735 1.00 . A A .  11 PHE HE1  1 1 
       14 3709 1 1 10 PHE HE2  H  -1.026  2.614   3.280 1.00 . A A .  11 PHE HE2  1 1 
       14 3710 1 1 10 PHE HZ   H  -2.436  3.726   4.963 1.00 . A A .  11 PHE HZ   1 1 
       14 3711 1 1 10 PHE N    N  -5.624  1.459  -1.454 1.00 . A A .  11 PHE N    1 1 
       14 3712 1 1 10 PHE O    O  -2.692  0.985  -1.238 1.00 . A A .  11 PHE O    1 1 
       14 3713 1 1 11 THR C    C  -0.381  3.967  -1.022 1.00 . A A .  12 THR C    1 1 
       14 3714 1 1 11 THR CA   C  -1.333  3.237  -1.972 1.00 . A A .  12 THR CA   1 1 
       14 3715 1 1 11 THR CB   C  -1.298  3.914  -3.356 1.00 . A A .  12 THR CB   1 1 
       14 3716 1 1 11 THR CG2  C   0.061  3.736  -4.017 1.00 . A A .  12 THR CG2  1 1 
       14 3717 1 1 11 THR H    H  -3.156  4.077  -1.367 1.00 . A A .  12 THR H    1 1 
       14 3718 1 1 11 THR HA   H  -1.006  2.215  -2.082 1.00 . A A .  12 THR HA   1 1 
       14 3719 1 1 11 THR HB   H  -1.487  4.971  -3.230 1.00 . A A .  12 THR HB   1 1 
       14 3720 1 1 11 THR HG1  H  -3.119  3.897  -4.130 1.00 . A A .  12 THR HG1  1 1 
       14 3721 1 1 11 THR HG21 H   0.064  4.231  -4.977 1.00 . A A .  12 THR HG21 1 1 
       14 3722 1 1 11 THR HG22 H   0.258  2.684  -4.156 1.00 . A A .  12 THR HG22 1 1 
       14 3723 1 1 11 THR HG23 H   0.827  4.164  -3.389 1.00 . A A .  12 THR HG23 1 1 
       14 3724 1 1 11 THR N    N  -2.686  3.224  -1.437 1.00 . A A .  12 THR N    1 1 
       14 3725 1 1 11 THR O    O  -0.481  5.183  -0.839 1.00 . A A .  12 THR O    1 1 
       14 3726 1 1 11 THR OG1  O  -2.317  3.351  -4.194 1.00 . A A .  12 THR OG1  1 1 
       14 3727 1 1 12 SER C    C   2.910  3.331   0.163 1.00 . A A .  13 SER C    1 1 
       14 3728 1 1 12 SER CA   C   1.494  3.807   0.505 1.00 . A A .  13 SER CA   1 1 
       14 3729 1 1 12 SER CB   C   1.146  3.456   1.953 1.00 . A A .  13 SER CB   1 1 
       14 3730 1 1 12 SER H    H   0.529  2.251  -0.548 1.00 . A A .  13 SER H    1 1 
       14 3731 1 1 12 SER HA   H   1.441  4.879   0.388 1.00 . A A .  13 SER HA   1 1 
       14 3732 1 1 12 SER HB2  H   1.967  3.736   2.596 1.00 . A A .  13 SER HB2  1 1 
       14 3733 1 1 12 SER HB3  H   0.257  3.994   2.246 1.00 . A A .  13 SER HB3  1 1 
       14 3734 1 1 12 SER HG   H   1.573  1.573   1.606 1.00 . A A .  13 SER HG   1 1 
       14 3735 1 1 12 SER N    N   0.519  3.220  -0.400 1.00 . A A .  13 SER N    1 1 
       14 3736 1 1 12 SER O    O   3.223  2.148   0.319 1.00 . A A .  13 SER O    1 1 
       14 3737 1 1 12 SER OG   O   0.907  2.068   2.097 1.00 . A A .  13 SER OG   1 1 
       14 3738 1 1 13 CYS C    C   6.096  4.901  -0.011 1.00 . A A .  14 CYS C    1 1 
       14 3739 1 1 13 CYS CA   C   5.135  3.908  -0.651 1.00 . A A .  14 CYS CA   1 1 
       14 3740 1 1 13 CYS CB   C   5.331  3.894  -2.167 1.00 . A A .  14 CYS CB   1 1 
       14 3741 1 1 13 CYS H    H   3.450  5.169  -0.447 1.00 . A A .  14 CYS H    1 1 
       14 3742 1 1 13 CYS HA   H   5.341  2.922  -0.260 1.00 . A A .  14 CYS HA   1 1 
       14 3743 1 1 13 CYS HB2  H   4.997  4.838  -2.575 1.00 . A A .  14 CYS HB2  1 1 
       14 3744 1 1 13 CYS HB3  H   6.382  3.766  -2.385 1.00 . A A .  14 CYS HB3  1 1 
       14 3745 1 1 13 CYS N    N   3.756  4.243  -0.315 1.00 . A A .  14 CYS N    1 1 
       14 3746 1 1 13 CYS O    O   6.033  6.101  -0.282 1.00 . A A .  14 CYS O    1 1 
       14 3747 1 1 13 CYS SG   S   4.420  2.569  -3.024 1.00 . A A .  14 CYS SG   1 1 
       14 3748 1 1 14 LYS C    C   9.196  4.446   1.852 1.00 . A A .  15 LYS C    1 1 
       14 3749 1 1 14 LYS CA   C   7.940  5.243   1.528 1.00 . A A .  15 LYS CA   1 1 
       14 3750 1 1 14 LYS CB   C   7.347  5.877   2.803 1.00 . A A .  15 LYS CB   1 1 
       14 3751 1 1 14 LYS CD   C   5.523  4.251   3.497 1.00 . A A .  15 LYS CD   1 1 
       14 3752 1 1 14 LYS CE   C   4.439  5.295   3.261 1.00 . A A .  15 LYS CE   1 1 
       14 3753 1 1 14 LYS CG   C   6.859  4.890   3.864 1.00 . A A .  15 LYS CG   1 1 
       14 3754 1 1 14 LYS H    H   6.983  3.433   1.015 1.00 . A A .  15 LYS H    1 1 
       14 3755 1 1 14 LYS HA   H   8.211  6.034   0.843 1.00 . A A .  15 LYS HA   1 1 
       14 3756 1 1 14 LYS HB2  H   8.102  6.500   3.256 1.00 . A A .  15 LYS HB2  1 1 
       14 3757 1 1 14 LYS HB3  H   6.512  6.501   2.517 1.00 . A A .  15 LYS HB3  1 1 
       14 3758 1 1 14 LYS HD2  H   5.650  3.672   2.595 1.00 . A A .  15 LYS HD2  1 1 
       14 3759 1 1 14 LYS HD3  H   5.216  3.602   4.302 1.00 . A A .  15 LYS HD3  1 1 
       14 3760 1 1 14 LYS HE2  H   4.735  5.923   2.435 1.00 . A A .  15 LYS HE2  1 1 
       14 3761 1 1 14 LYS HE3  H   3.519  4.785   3.012 1.00 . A A .  15 LYS HE3  1 1 
       14 3762 1 1 14 LYS HG2  H   7.595  4.108   3.975 1.00 . A A .  15 LYS HG2  1 1 
       14 3763 1 1 14 LYS HG3  H   6.749  5.414   4.802 1.00 . A A .  15 LYS HG3  1 1 
       14 3764 1 1 14 LYS HZ1  H   3.937  5.562   5.273 1.00 . A A .  15 LYS HZ1  1 1 
       14 3765 1 1 14 LYS HZ2  H   3.443  6.833   4.264 1.00 . A A .  15 LYS HZ2  1 1 
       14 3766 1 1 14 LYS HZ3  H   5.076  6.680   4.693 1.00 . A A .  15 LYS HZ3  1 1 
       14 3767 1 1 14 LYS N    N   6.972  4.401   0.846 1.00 . A A .  15 LYS N    1 1 
       14 3768 1 1 14 LYS NZ   N   4.210  6.149   4.455 1.00 . A A .  15 LYS NZ   1 1 
       14 3769 1 1 14 LYS O    O  10.293  4.884   1.448 1.00 . A A .  15 LYS O    1 1 
       14 3770 1 1 14 LYS OXT  O   9.077  3.371   2.470 1.00 . A A .  15 LYS OXT  1 1 
       14 3771 2 2  1 .   C1   C   8.730 -2.620   0.743 1.00 . B A . 101 OCA C1   1 1 
       14 3772 2 2  1 .   C2   C   8.107 -2.344   2.103 1.00 . B A . 101 OCA C2   1 1 
       14 3773 2 2  1 .   C3   C   9.146 -2.170   3.198 1.00 . B A . 101 OCA C3   1 1 
       14 3774 2 2  1 .   C4   C   8.655 -2.719   4.527 1.00 . B A . 101 OCA C4   1 1 
       14 3775 2 2  1 .   C5   C   8.705 -1.662   5.619 1.00 . B A . 101 OCA C5   1 1 
       14 3776 2 2  1 .   C6   C  10.072 -1.601   6.274 1.00 . B A . 101 OCA C6   1 1 
       14 3777 2 2  1 .   C7   C   9.964 -1.302   7.756 1.00 . B A . 101 OCA C7   1 1 
       14 3778 2 2  1 .   C8   C  11.323 -1.262   8.414 1.00 . B A . 101 OCA C8   1 1 
       14 3779 2 2  1 .   H21  H   7.516 -1.443   2.035 1.00 . B A . 101 OCA H21  1 1 
       14 3780 2 2  1 .   H22  H   7.465 -3.174   2.363 1.00 . B A . 101 OCA H22  1 1 
       14 3781 2 2  1 .   H31  H  10.045 -2.696   2.912 1.00 . B A . 101 OCA H31  1 1 
       14 3782 2 2  1 .   H32  H   9.362 -1.117   3.312 1.00 . B A . 101 OCA H32  1 1 
       14 3783 2 2  1 .   H41  H   7.635 -3.055   4.410 1.00 . B A . 101 OCA H41  1 1 
       14 3784 2 2  1 .   H42  H   9.280 -3.550   4.815 1.00 . B A . 101 OCA H42  1 1 
       14 3785 2 2  1 .   H51  H   8.481 -0.699   5.186 1.00 . B A . 101 OCA H51  1 1 
       14 3786 2 2  1 .   H52  H   7.970 -1.901   6.372 1.00 . B A . 101 OCA H52  1 1 
       14 3787 2 2  1 .   H61  H  10.569 -2.551   6.144 1.00 . B A . 101 OCA H61  1 1 
       14 3788 2 2  1 .   H62  H  10.651 -0.823   5.801 1.00 . B A . 101 OCA H62  1 1 
       14 3789 2 2  1 .   H71  H   9.374 -2.073   8.231 1.00 . B A . 101 OCA H71  1 1 
       14 3790 2 2  1 .   H72  H   9.489 -0.342   7.891 1.00 . B A . 101 OCA H72  1 1 
       14 3791 2 2  1 .   H81  H  11.210 -1.352   9.485 1.00 . B A . 101 OCA H81  1 1 
       14 3792 2 2  1 .   H82  H  11.807 -0.326   8.181 1.00 . B A . 101 OCA H82  1 1 
       14 3793 2 2  1 .   H83  H  11.924 -2.080   8.045 1.00 . B A . 101 OCA H83  1 1 
       14 3794 2 2  1 .   O1   O   9.020 -3.745   0.335 1.00 . B A . 101 OCA O1   1 1 
       15 3795 1 1  1 PRO C    C   7.041  0.413   0.148 1.00 . A A .   2 PRO C    1 1 
       15 3796 1 1  1 PRO CA   C   8.516  0.108   0.395 1.00 . A A .   2 PRO CA   1 1 
       15 3797 1 1  1 PRO CB   C   9.398  1.127  -0.317 1.00 . A A .   2 PRO CB   1 1 
       15 3798 1 1  1 PRO CD   C   9.351 -0.925  -1.617 1.00 . A A .   2 PRO CD   1 1 
       15 3799 1 1  1 PRO CG   C   9.610  0.566  -1.690 1.00 . A A .   2 PRO CG   1 1 
       15 3800 1 1  1 PRO HA   H   8.720  0.121   1.455 1.00 . A A .   2 PRO HA   1 1 
       15 3801 1 1  1 PRO HB2  H   8.890  2.080  -0.353 1.00 . A A .   2 PRO HB2  1 1 
       15 3802 1 1  1 PRO HB3  H  10.334  1.232   0.212 1.00 . A A .   2 PRO HB3  1 1 
       15 3803 1 1  1 PRO HD2  H   8.562 -1.205  -2.301 1.00 . A A .   2 PRO HD2  1 1 
       15 3804 1 1  1 PRO HD3  H  10.255 -1.474  -1.840 1.00 . A A .   2 PRO HD3  1 1 
       15 3805 1 1  1 PRO HG2  H   8.918  1.028  -2.380 1.00 . A A .   2 PRO HG2  1 1 
       15 3806 1 1  1 PRO HG3  H  10.625  0.751  -2.005 1.00 . A A .   2 PRO HG3  1 1 
       15 3807 1 1  1 PRO N    N   8.935 -1.147  -0.222 1.00 . A A .   2 PRO N    1 1 
       15 3808 1 1  1 PRO O    O   6.531  1.449   0.569 1.00 . A A .   2 PRO O    1 1 
       15 3809 1 1  2 CYS C    C   4.205 -1.580  -0.345 1.00 . A A .   3 CYS C    1 1 
       15 3810 1 1  2 CYS CA   C   4.958 -0.359  -0.855 1.00 . A A .   3 CYS CA   1 1 
       15 3811 1 1  2 CYS CB   C   4.754 -0.220  -2.368 1.00 . A A .   3 CYS CB   1 1 
       15 3812 1 1  2 CYS H    H   6.846 -1.295  -0.862 1.00 . A A .   3 CYS H    1 1 
       15 3813 1 1  2 CYS HA   H   4.587  0.525  -0.358 1.00 . A A .   3 CYS HA   1 1 
       15 3814 1 1  2 CYS HB2  H   5.066 -1.134  -2.850 1.00 . A A .   3 CYS HB2  1 1 
       15 3815 1 1  2 CYS HB3  H   3.707 -0.051  -2.569 1.00 . A A .   3 CYS HB3  1 1 
       15 3816 1 1  2 CYS N    N   6.372 -0.499  -0.547 1.00 . A A .   3 CYS N    1 1 
       15 3817 1 1  2 CYS O    O   4.554 -2.710  -0.680 1.00 . A A .   3 CYS O    1 1 
       15 3818 1 1  2 CYS SG   S   5.691  1.148  -3.127 1.00 . A A .   3 CYS SG   1 1 
       15 3819 1 1  3 LYS C    C   0.915 -2.173   0.788 1.00 . A A .   4 LYS C    1 1 
       15 3820 1 1  3 LYS CA   C   2.393 -2.447   1.014 1.00 . A A .   4 LYS CA   1 1 
       15 3821 1 1  3 LYS CB   C   2.665 -2.611   2.512 1.00 . A A .   4 LYS CB   1 1 
       15 3822 1 1  3 LYS CD   C   2.978 -5.102   2.546 1.00 . A A .   4 LYS CD   1 1 
       15 3823 1 1  3 LYS CE   C   2.562 -6.417   3.184 1.00 . A A .   4 LYS CE   1 1 
       15 3824 1 1  3 LYS CG   C   2.175 -3.929   3.091 1.00 . A A .   4 LYS CG   1 1 
       15 3825 1 1  3 LYS H    H   2.959 -0.431   0.711 1.00 . A A .   4 LYS H    1 1 
       15 3826 1 1  3 LYS HA   H   2.668 -3.354   0.499 1.00 . A A .   4 LYS HA   1 1 
       15 3827 1 1  3 LYS HB2  H   3.728 -2.542   2.683 1.00 . A A .   4 LYS HB2  1 1 
       15 3828 1 1  3 LYS HB3  H   2.174 -1.807   3.040 1.00 . A A .   4 LYS HB3  1 1 
       15 3829 1 1  3 LYS HD2  H   2.821 -5.168   1.481 1.00 . A A .   4 LYS HD2  1 1 
       15 3830 1 1  3 LYS HD3  H   4.027 -4.930   2.747 1.00 . A A .   4 LYS HD3  1 1 
       15 3831 1 1  3 LYS HE2  H   3.277 -7.178   2.907 1.00 . A A .   4 LYS HE2  1 1 
       15 3832 1 1  3 LYS HE3  H   2.566 -6.298   4.257 1.00 . A A .   4 LYS HE3  1 1 
       15 3833 1 1  3 LYS HG2  H   2.279 -3.900   4.166 1.00 . A A .   4 LYS HG2  1 1 
       15 3834 1 1  3 LYS HG3  H   1.135 -4.063   2.831 1.00 . A A .   4 LYS HG3  1 1 
       15 3835 1 1  3 LYS HZ1  H   0.873 -7.627   3.360 1.00 . A A .   4 LYS HZ1  1 1 
       15 3836 1 1  3 LYS HZ2  H   1.237 -7.191   1.763 1.00 . A A .   4 LYS HZ2  1 1 
       15 3837 1 1  3 LYS HZ3  H   0.538 -6.063   2.812 1.00 . A A .   4 LYS HZ3  1 1 
       15 3838 1 1  3 LYS N    N   3.187 -1.354   0.471 1.00 . A A .   4 LYS N    1 1 
       15 3839 1 1  3 LYS NZ   N   1.209 -6.850   2.751 1.00 . A A .   4 LYS NZ   1 1 
       15 3840 1 1  3 LYS O    O   0.387 -1.167   1.260 1.00 . A A .   4 LYS O    1 1 
       15 3841 1 1  4 ASN C    C  -1.969 -3.944   0.575 1.00 . A A .   5 ASN C    1 1 
       15 3842 1 1  4 ASN CA   C  -1.175 -2.881  -0.186 1.00 . A A .   5 ASN CA   1 1 
       15 3843 1 1  4 ASN CB   C  -1.466 -3.016  -1.685 1.00 . A A .   5 ASN CB   1 1 
       15 3844 1 1  4 ASN CG   C  -0.632 -2.078  -2.546 1.00 . A A .   5 ASN CG   1 1 
       15 3845 1 1  4 ASN H    H   0.720 -3.837  -0.314 1.00 . A A .   5 ASN H    1 1 
       15 3846 1 1  4 ASN HA   H  -1.459 -1.896   0.145 1.00 . A A .   5 ASN HA   1 1 
       15 3847 1 1  4 ASN HB2  H  -1.261 -4.030  -1.992 1.00 . A A .   5 ASN HB2  1 1 
       15 3848 1 1  4 ASN HB3  H  -2.509 -2.798  -1.861 1.00 . A A .   5 ASN HB3  1 1 
       15 3849 1 1  4 ASN HD21 H  -0.771 -0.624  -1.195 1.00 . A A .   5 ASN HD21 1 1 
       15 3850 1 1  4 ASN HD22 H   0.144 -0.256  -2.611 1.00 . A A .   5 ASN HD22 1 1 
       15 3851 1 1  4 ASN N    N   0.247 -3.053   0.059 1.00 . A A .   5 ASN N    1 1 
       15 3852 1 1  4 ASN ND2  N  -0.397 -0.863  -2.070 1.00 . A A .   5 ASN ND2  1 1 
       15 3853 1 1  4 ASN O    O  -1.910 -5.125   0.233 1.00 . A A .   5 ASN O    1 1 
       15 3854 1 1  4 ASN OD1  O  -0.215 -2.438  -3.643 1.00 . A A .   5 ASN OD1  1 1 
       15 3855 1 1  5 .   C    C  -4.805 -4.809   1.525 1.00 . A A .   6 O6H C    1 1 
       15 3856 1 1  5 .   CA   C  -3.575 -4.441   2.347 1.00 . A A .   6 O6H CA   1 1 
       15 3857 1 1  5 .   CB   C  -3.996 -3.845   3.696 1.00 . A A .   6 O6H CB   1 1 
       15 3858 1 1  5 .   CD1  C  -2.151 -4.429   5.328 1.00 . A A .   6 O6H CD1  1 1 
       15 3859 1 1  5 .   CD2  C  -2.412 -2.153   4.678 1.00 . A A .   6 O6H CD2  1 1 
       15 3860 1 1  5 .   CE1  C  -1.084 -4.080   6.134 1.00 . A A .   6 O6H CE1  1 1 
       15 3861 1 1  5 .   CE2  C  -1.350 -1.790   5.479 1.00 . A A .   6 O6H CE2  1 1 
       15 3862 1 1  5 .   CF1  C  -2.568 -5.871   5.256 1.00 . A A .   6 O6H CF1  1 1 
       15 3863 1 1  5 .   CF2  C  -3.131 -1.095   3.903 1.00 . A A .   6 O6H CF2  1 1 
       15 3864 1 1  5 .   CG   C  -2.834 -3.472   4.583 1.00 . A A .   6 O6H CG   1 1 
       15 3865 1 1  5 .   CH   C   0.466 -2.366   7.070 1.00 . A A .   6 O6H CH   1 1 
       15 3866 1 1  5 .   CZ   C  -0.689 -2.758   6.202 1.00 . A A .   6 O6H CZ   1 1 
       15 3867 1 1  5 .   H1   H  -2.610 -2.614   1.933 1.00 . A A .   6 O6H H1   1 1 
       15 3868 1 1  5 .   HA   H  -3.018 -5.347   2.538 1.00 . A A .   6 O6H HA   1 1 
       15 3869 1 1  5 .   HB1  H  -4.603 -4.564   4.227 1.00 . A A .   6 O6H HB1  1 1 
       15 3870 1 1  5 .   HB2  H  -4.577 -2.952   3.521 1.00 . A A .   6 O6H HB2  1 1 
       15 3871 1 1  5 .   HE1  H  -0.564 -4.835   6.708 1.00 . A A .   6 O6H HE1  1 1 
       15 3872 1 1  5 .   HE2  H  -1.035 -0.760   5.536 1.00 . A A .   6 O6H HE2  1 1 
       15 3873 1 1  5 .   HF11 H  -3.620 -6.006   5.046 1.00 . A A .   6 O6H HF11 1 1 
       15 3874 1 1  5 .   HF12 H  -2.388 -6.418   6.171 1.00 . A A .   6 O6H HF12 1 1 
       15 3875 1 1  5 .   HF13 H  -2.050 -6.426   4.488 1.00 . A A .   6 O6H HF13 1 1 
       15 3876 1 1  5 .   HF21 H  -4.200 -1.224   3.900 1.00 . A A .   6 O6H HF21 1 1 
       15 3877 1 1  5 .   HF22 H  -2.846 -1.058   2.861 1.00 . A A .   6 O6H HF22 1 1 
       15 3878 1 1  5 .   HF23 H  -2.963 -0.097   4.282 1.00 . A A .   6 O6H HF23 1 1 
       15 3879 1 1  5 .   HH1  H   0.814 -1.360   6.888 1.00 . A A .   6 O6H HH1  1 1 
       15 3880 1 1  5 .   HH2  H   1.332 -2.997   6.938 1.00 . A A .   6 O6H HH2  1 1 
       15 3881 1 1  5 .   HH3  H   0.242 -2.404   8.126 1.00 . A A .   6 O6H HH3  1 1 
       15 3882 1 1  5 .   N    N  -2.689 -3.537   1.623 1.00 . A A .   6 O6H N    1 1 
       15 3883 1 1  5 .   O    O  -5.270 -5.945   1.554 1.00 . A A .   6 O6H O    1 1 
       15 3884 1 1  6 PHE C    C  -6.595 -4.063  -1.307 1.00 . A A .   7 PHE C    1 1 
       15 3885 1 1  6 PHE CA   C  -6.664 -3.953   0.212 1.00 . A A .   7 PHE CA   1 1 
       15 3886 1 1  6 PHE CB   C  -7.542 -2.757   0.601 1.00 . A A .   7 PHE CB   1 1 
       15 3887 1 1  6 PHE CD1  C  -7.800 -3.327   3.037 1.00 . A A .   7 PHE CD1  1 1 
       15 3888 1 1  6 PHE CD2  C  -7.075 -1.132   2.455 1.00 . A A .   7 PHE CD2  1 1 
       15 3889 1 1  6 PHE CE1  C  -7.729 -2.997   4.378 1.00 . A A .   7 PHE CE1  1 1 
       15 3890 1 1  6 PHE CE2  C  -7.006 -0.795   3.793 1.00 . A A .   7 PHE CE2  1 1 
       15 3891 1 1  6 PHE CG   C  -7.472 -2.400   2.061 1.00 . A A .   7 PHE CG   1 1 
       15 3892 1 1  6 PHE CZ   C  -7.332 -1.730   4.755 1.00 . A A .   7 PHE CZ   1 1 
       15 3893 1 1  6 PHE H    H  -4.838 -2.997   0.688 1.00 . A A .   7 PHE H    1 1 
       15 3894 1 1  6 PHE HA   H  -7.115 -4.853   0.603 1.00 . A A .   7 PHE HA   1 1 
       15 3895 1 1  6 PHE HB2  H  -7.229 -1.892   0.036 1.00 . A A .   7 PHE HB2  1 1 
       15 3896 1 1  6 PHE HB3  H  -8.572 -2.982   0.361 1.00 . A A .   7 PHE HB3  1 1 
       15 3897 1 1  6 PHE HD1  H  -8.111 -4.319   2.744 1.00 . A A .   7 PHE HD1  1 1 
       15 3898 1 1  6 PHE HD2  H  -6.820 -0.400   1.703 1.00 . A A .   7 PHE HD2  1 1 
       15 3899 1 1  6 PHE HE1  H  -7.987 -3.730   5.129 1.00 . A A .   7 PHE HE1  1 1 
       15 3900 1 1  6 PHE HE2  H  -6.696  0.197   4.086 1.00 . A A .   7 PHE HE2  1 1 
       15 3901 1 1  6 PHE HZ   H  -7.275 -1.471   5.801 1.00 . A A .   7 PHE HZ   1 1 
       15 3902 1 1  6 PHE N    N  -5.340 -3.826   0.811 1.00 . A A .   7 PHE N    1 1 
       15 3903 1 1  6 PHE O    O  -7.551 -4.502  -1.945 1.00 . A A .   7 PHE O    1 1 
       15 3904 1 1  7 DTR C    C  -4.843 -2.265  -3.837 1.00 . A A .   8 DTR C    1 1 
       15 3905 1 1  7 DTR CA   C  -5.351 -3.625  -3.330 1.00 . A A .   8 DTR CA   1 1 
       15 3906 1 1  7 DTR CB   C  -4.443 -4.754  -3.832 1.00 . A A .   8 DTR CB   1 1 
       15 3907 1 1  7 DTR CD1  C  -5.283 -4.948  -6.237 1.00 . A A .   8 DTR CD1  1 1 
       15 3908 1 1  7 DTR CD2  C  -3.124 -4.392  -6.056 1.00 . A A .   8 DTR CD2  1 1 
       15 3909 1 1  7 DTR CE2  C  -3.465 -4.439  -7.416 1.00 . A A .   8 DTR CE2  1 1 
       15 3910 1 1  7 DTR CE3  C  -1.811 -4.065  -5.701 1.00 . A A .   8 DTR CE3  1 1 
       15 3911 1 1  7 DTR CG   C  -4.303 -4.715  -5.317 1.00 . A A .   8 DTR CG   1 1 
       15 3912 1 1  7 DTR CH2  C  -1.276 -3.845  -8.050 1.00 . A A .   8 DTR CH2  1 1 
       15 3913 1 1  7 DTR CZ2  C  -2.552 -4.164  -8.421 1.00 . A A .   8 DTR CZ2  1 1 
       15 3914 1 1  7 DTR CZ3  C  -0.899 -3.798  -6.704 1.00 . A A .   8 DTR CZ3  1 1 
       15 3915 1 1  7 DTR H    H  -4.736 -3.338  -1.334 1.00 . A A .   8 DTR H    1 1 
       15 3916 1 1  7 DTR HA   H  -6.329 -3.831  -3.747 1.00 . A A .   8 DTR HA   1 1 
       15 3917 1 1  7 DTR HB2  H  -3.461 -4.653  -3.392 1.00 . A A .   8 DTR HB2  1 1 
       15 3918 1 1  7 DTR HB3  H  -4.867 -5.709  -3.557 1.00 . A A .   8 DTR HB3  1 1 
       15 3919 1 1  7 DTR HD1  H  -6.298 -5.218  -5.990 1.00 . A A .   8 DTR HD1  1 1 
       15 3920 1 1  7 DTR HE1  H  -5.297 -4.885  -8.339 1.00 . A A .   8 DTR HE1  1 1 
       15 3921 1 1  7 DTR HE3  H  -1.505 -4.028  -4.665 1.00 . A A .   8 DTR HE3  1 1 
       15 3922 1 1  7 DTR HH2  H  -0.533 -3.630  -8.802 1.00 . A A .   8 DTR HH2  1 1 
       15 3923 1 1  7 DTR HZ2  H  -2.832 -4.181  -9.459 1.00 . A A .   8 DTR HZ2  1 1 
       15 3924 1 1  7 DTR HZ3  H   0.120 -3.543  -6.449 1.00 . A A .   8 DTR HZ3  1 1 
       15 3925 1 1  7 DTR N    N  -5.483 -3.641  -1.887 1.00 . A A .   8 DTR N    1 1 
       15 3926 1 1  7 DTR NE1  N  -4.787 -4.777  -7.501 1.00 . A A .   8 DTR NE1  1 1 
       15 3927 1 1  7 DTR O    O  -3.867 -1.738  -3.307 1.00 . A A .   8 DTR O    1 1 
       15 3928 1 1  8 LYS C    C  -5.713  0.757  -4.711 1.00 . A A .   9 LYS C    1 1 
       15 3929 1 1  8 LYS CA   C  -5.060 -0.421  -5.420 1.00 . A A .   9 LYS CA   1 1 
       15 3930 1 1  8 LYS CB   C  -5.389 -0.362  -6.919 1.00 . A A .   9 LYS CB   1 1 
       15 3931 1 1  8 LYS CD   C  -4.848 -0.968  -9.271 1.00 . A A .   9 LYS CD   1 1 
       15 3932 1 1  8 LYS CE   C  -3.772 -1.475 -10.217 1.00 . A A .   9 LYS CE   1 1 
       15 3933 1 1  8 LYS CG   C  -4.484 -1.188  -7.811 1.00 . A A .   9 LYS CG   1 1 
       15 3934 1 1  8 LYS H    H  -6.337 -2.095  -5.184 1.00 . A A .   9 LYS H    1 1 
       15 3935 1 1  8 LYS HA   H  -3.990 -0.359  -5.292 1.00 . A A .   9 LYS HA   1 1 
       15 3936 1 1  8 LYS HB2  H  -6.400 -0.703  -7.065 1.00 . A A .   9 LYS HB2  1 1 
       15 3937 1 1  8 LYS HB3  H  -5.318  0.658  -7.248 1.00 . A A .   9 LYS HB3  1 1 
       15 3938 1 1  8 LYS HD2  H  -5.770 -1.489  -9.483 1.00 . A A .   9 LYS HD2  1 1 
       15 3939 1 1  8 LYS HD3  H  -4.989  0.091  -9.436 1.00 . A A .   9 LYS HD3  1 1 
       15 3940 1 1  8 LYS HE2  H  -3.593 -2.517 -10.012 1.00 . A A .   9 LYS HE2  1 1 
       15 3941 1 1  8 LYS HE3  H  -4.126 -1.366 -11.233 1.00 . A A .   9 LYS HE3  1 1 
       15 3942 1 1  8 LYS HG2  H  -3.458 -0.891  -7.649 1.00 . A A .   9 LYS HG2  1 1 
       15 3943 1 1  8 LYS HG3  H  -4.606 -2.233  -7.570 1.00 . A A .   9 LYS HG3  1 1 
       15 3944 1 1  8 LYS HZ1  H  -1.813 -1.030 -10.795 1.00 . A A .   9 LYS HZ1  1 1 
       15 3945 1 1  8 LYS HZ2  H  -2.077 -0.897  -9.131 1.00 . A A .   9 LYS HZ2  1 1 
       15 3946 1 1  8 LYS HZ3  H  -2.662  0.300 -10.174 1.00 . A A .   9 LYS HZ3  1 1 
       15 3947 1 1  8 LYS N    N  -5.511 -1.682  -4.836 1.00 . A A .   9 LYS N    1 1 
       15 3948 1 1  8 LYS NZ   N  -2.496 -0.724 -10.068 1.00 . A A .   9 LYS NZ   1 1 
       15 3949 1 1  8 LYS O    O  -5.457  1.916  -5.035 1.00 . A A .   9 LYS O    1 1 
       15 3950 1 1  9 THR C    C  -6.427  2.145  -1.944 1.00 . A A .  10 THR C    1 1 
       15 3951 1 1  9 THR CA   C  -7.294  1.463  -3.007 1.00 . A A .  10 THR CA   1 1 
       15 3952 1 1  9 THR CB   C  -8.519  0.835  -2.326 1.00 . A A .  10 THR CB   1 1 
       15 3953 1 1  9 THR CG2  C  -9.635  1.853  -2.178 1.00 . A A .  10 THR CG2  1 1 
       15 3954 1 1  9 THR H    H  -6.688 -0.499  -3.507 1.00 . A A .  10 THR H    1 1 
       15 3955 1 1  9 THR HA   H  -7.636  2.203  -3.718 1.00 . A A .  10 THR HA   1 1 
       15 3956 1 1  9 THR HB   H  -8.233  0.483  -1.346 1.00 . A A .  10 THR HB   1 1 
       15 3957 1 1  9 THR HG1  H  -9.539  0.058  -3.836 1.00 . A A .  10 THR HG1  1 1 
       15 3958 1 1  9 THR HG21 H  -9.917  2.222  -3.153 1.00 . A A .  10 THR HG21 1 1 
       15 3959 1 1  9 THR HG22 H  -9.294  2.675  -1.566 1.00 . A A .  10 THR HG22 1 1 
       15 3960 1 1  9 THR HG23 H -10.489  1.386  -1.710 1.00 . A A .  10 THR HG23 1 1 
       15 3961 1 1  9 THR N    N  -6.546  0.446  -3.731 1.00 . A A .  10 THR N    1 1 
       15 3962 1 1  9 THR O    O  -6.725  3.253  -1.503 1.00 . A A .  10 THR O    1 1 
       15 3963 1 1  9 THR OG1  O  -8.988 -0.273  -3.108 1.00 . A A .  10 THR OG1  1 1 
       15 3964 1 1 10 PHE C    C  -2.994  1.946  -1.044 1.00 . A A .  11 PHE C    1 1 
       15 3965 1 1 10 PHE CA   C  -4.453  2.025  -0.532 1.00 . A A .  11 PHE CA   1 1 
       15 3966 1 1 10 PHE CB   C  -4.583  1.208   0.759 1.00 . A A .  11 PHE CB   1 1 
       15 3967 1 1 10 PHE CD1  C  -2.522  1.681   2.123 1.00 . A A .  11 PHE CD1  1 1 
       15 3968 1 1 10 PHE CD2  C  -4.614  2.519   2.902 1.00 . A A .  11 PHE CD2  1 1 
       15 3969 1 1 10 PHE CE1  C  -1.889  2.229   3.221 1.00 . A A .  11 PHE CE1  1 1 
       15 3970 1 1 10 PHE CE2  C  -3.983  3.073   4.001 1.00 . A A .  11 PHE CE2  1 1 
       15 3971 1 1 10 PHE CG   C  -3.890  1.818   1.948 1.00 . A A .  11 PHE CG   1 1 
       15 3972 1 1 10 PHE CZ   C  -2.620  2.927   4.162 1.00 . A A .  11 PHE CZ   1 1 
       15 3973 1 1 10 PHE H    H  -5.141  0.617  -1.948 1.00 . A A .  11 PHE H    1 1 
       15 3974 1 1 10 PHE HA   H  -4.757  3.039  -0.324 1.00 . A A .  11 PHE HA   1 1 
       15 3975 1 1 10 PHE HB2  H  -5.629  1.103   1.004 1.00 . A A .  11 PHE HB2  1 1 
       15 3976 1 1 10 PHE HB3  H  -4.161  0.228   0.595 1.00 . A A .  11 PHE HB3  1 1 
       15 3977 1 1 10 PHE HD1  H  -1.946  1.141   1.384 1.00 . A A .  11 PHE HD1  1 1 
       15 3978 1 1 10 PHE HD2  H  -5.680  2.635   2.778 1.00 . A A .  11 PHE HD2  1 1 
       15 3979 1 1 10 PHE HE1  H  -0.823  2.114   3.343 1.00 . A A .  11 PHE HE1  1 1 
       15 3980 1 1 10 PHE HE2  H  -4.558  3.618   4.736 1.00 . A A .  11 PHE HE2  1 1 
       15 3981 1 1 10 PHE HZ   H  -2.126  3.354   5.020 1.00 . A A .  11 PHE HZ   1 1 
       15 3982 1 1 10 PHE N    N  -5.351  1.482  -1.542 1.00 . A A .  11 PHE N    1 1 
       15 3983 1 1 10 PHE O    O  -2.469  0.840  -1.155 1.00 . A A .  11 PHE O    1 1 
       15 3984 1 1 11 THR C    C  -0.049  3.876  -0.968 1.00 . A A .  12 THR C    1 1 
       15 3985 1 1 11 THR CA   C  -0.937  2.975  -1.812 1.00 . A A .  12 THR CA   1 1 
       15 3986 1 1 11 THR CB   C  -0.787  3.359  -3.298 1.00 . A A .  12 THR CB   1 1 
       15 3987 1 1 11 THR CG2  C   0.652  3.173  -3.765 1.00 . A A .  12 THR CG2  1 1 
       15 3988 1 1 11 THR H    H  -2.741  3.948  -1.367 1.00 . A A .  12 THR H    1 1 
       15 3989 1 1 11 THR HA   H  -0.615  1.952  -1.692 1.00 . A A .  12 THR HA   1 1 
       15 3990 1 1 11 THR HB   H  -1.058  4.399  -3.417 1.00 . A A .  12 THR HB   1 1 
       15 3991 1 1 11 THR HG1  H  -2.219  2.020  -3.522 1.00 . A A .  12 THR HG1  1 1 
       15 3992 1 1 11 THR HG21 H   0.732  3.450  -4.806 1.00 . A A .  12 THR HG21 1 1 
       15 3993 1 1 11 THR HG22 H   0.939  2.139  -3.644 1.00 . A A .  12 THR HG22 1 1 
       15 3994 1 1 11 THR HG23 H   1.304  3.801  -3.180 1.00 . A A .  12 THR HG23 1 1 
       15 3995 1 1 11 THR N    N  -2.320  3.064  -1.383 1.00 . A A .  12 THR N    1 1 
       15 3996 1 1 11 THR O    O  -0.131  5.100  -1.051 1.00 . A A .  12 THR O    1 1 
       15 3997 1 1 11 THR OG1  O  -1.660  2.553  -4.099 1.00 . A A .  12 THR OG1  1 1 
       15 3998 1 1 12 SER C    C   3.162  3.515   0.313 1.00 . A A .  13 SER C    1 1 
       15 3999 1 1 12 SER CA   C   1.752  3.997   0.647 1.00 . A A .  13 SER CA   1 1 
       15 4000 1 1 12 SER CB   C   1.470  3.816   2.140 1.00 . A A .  13 SER CB   1 1 
       15 4001 1 1 12 SER H    H   0.738  2.288  -0.052 1.00 . A A .  13 SER H    1 1 
       15 4002 1 1 12 SER HA   H   1.656  5.044   0.398 1.00 . A A .  13 SER HA   1 1 
       15 4003 1 1 12 SER HB2  H   1.518  2.767   2.390 1.00 . A A .  13 SER HB2  1 1 
       15 4004 1 1 12 SER HB3  H   2.207  4.359   2.711 1.00 . A A .  13 SER HB3  1 1 
       15 4005 1 1 12 SER HG   H  -0.010  5.083   1.933 1.00 . A A .  13 SER HG   1 1 
       15 4006 1 1 12 SER N    N   0.782  3.264  -0.141 1.00 . A A .  13 SER N    1 1 
       15 4007 1 1 12 SER O    O   3.475  2.338   0.499 1.00 . A A .  13 SER O    1 1 
       15 4008 1 1 12 SER OG   O   0.183  4.303   2.471 1.00 . A A .  13 SER OG   1 1 
       15 4009 1 1 13 CYS C    C   6.310  5.105   0.051 1.00 . A A .  14 CYS C    1 1 
       15 4010 1 1 13 CYS CA   C   5.370  4.068  -0.539 1.00 . A A .  14 CYS CA   1 1 
       15 4011 1 1 13 CYS CB   C   5.562  3.982  -2.057 1.00 . A A .  14 CYS CB   1 1 
       15 4012 1 1 13 CYS H    H   3.690  5.322  -0.377 1.00 . A A .  14 CYS H    1 1 
       15 4013 1 1 13 CYS HA   H   5.590  3.108  -0.100 1.00 . A A .  14 CYS HA   1 1 
       15 4014 1 1 13 CYS HB2  H   5.358  4.947  -2.494 1.00 . A A .  14 CYS HB2  1 1 
       15 4015 1 1 13 CYS HB3  H   6.585  3.707  -2.268 1.00 . A A .  14 CYS HB3  1 1 
       15 4016 1 1 13 CYS N    N   3.997  4.409  -0.212 1.00 . A A .  14 CYS N    1 1 
       15 4017 1 1 13 CYS O    O   6.327  6.256  -0.387 1.00 . A A .  14 CYS O    1 1 
       15 4018 1 1 13 CYS SG   S   4.485  2.762  -2.882 1.00 . A A .  14 CYS SG   1 1 
       15 4019 1 1 14 LYS C    C   9.190  4.851   2.248 1.00 . A A .  15 LYS C    1 1 
       15 4020 1 1 14 LYS CA   C   7.972  5.615   1.741 1.00 . A A .  15 LYS CA   1 1 
       15 4021 1 1 14 LYS CB   C   7.255  6.300   2.906 1.00 . A A .  15 LYS CB   1 1 
       15 4022 1 1 14 LYS CD   C   7.799  8.681   2.336 1.00 . A A .  15 LYS CD   1 1 
       15 4023 1 1 14 LYS CE   C   8.379  9.993   2.838 1.00 . A A .  15 LYS CE   1 1 
       15 4024 1 1 14 LYS CG   C   7.926  7.579   3.378 1.00 . A A .  15 LYS CG   1 1 
       15 4025 1 1 14 LYS H    H   7.005  3.773   1.364 1.00 . A A .  15 LYS H    1 1 
       15 4026 1 1 14 LYS HA   H   8.294  6.362   1.031 1.00 . A A .  15 LYS HA   1 1 
       15 4027 1 1 14 LYS HB2  H   6.247  6.537   2.601 1.00 . A A .  15 LYS HB2  1 1 
       15 4028 1 1 14 LYS HB3  H   7.215  5.612   3.738 1.00 . A A .  15 LYS HB3  1 1 
       15 4029 1 1 14 LYS HD2  H   8.329  8.382   1.445 1.00 . A A .  15 LYS HD2  1 1 
       15 4030 1 1 14 LYS HD3  H   6.754  8.826   2.106 1.00 . A A .  15 LYS HD3  1 1 
       15 4031 1 1 14 LYS HE2  H   7.904 10.245   3.774 1.00 . A A .  15 LYS HE2  1 1 
       15 4032 1 1 14 LYS HE3  H   9.440  9.866   2.997 1.00 . A A .  15 LYS HE3  1 1 
       15 4033 1 1 14 LYS HG2  H   7.455  7.904   4.293 1.00 . A A .  15 LYS HG2  1 1 
       15 4034 1 1 14 LYS HG3  H   8.974  7.383   3.558 1.00 . A A .  15 LYS HG3  1 1 
       15 4035 1 1 14 LYS HZ1  H   7.147 11.201   1.654 1.00 . A A .  15 LYS HZ1  1 1 
       15 4036 1 1 14 LYS HZ2  H   8.683 10.928   0.989 1.00 . A A .  15 LYS HZ2  1 1 
       15 4037 1 1 14 LYS HZ3  H   8.500 12.004   2.287 1.00 . A A .  15 LYS HZ3  1 1 
       15 4038 1 1 14 LYS N    N   7.064  4.705   1.062 1.00 . A A .  15 LYS N    1 1 
       15 4039 1 1 14 LYS NZ   N   8.163 11.106   1.876 1.00 . A A .  15 LYS NZ   1 1 
       15 4040 1 1 14 LYS O    O   9.080  4.183   3.297 1.00 . A A .  15 LYS O    1 1 
       15 4041 1 1 14 LYS OXT  O  10.247  4.903   1.584 1.00 . A A .  15 LYS OXT  1 1 
       15 4042 2 2  1 .   C1   C   8.975 -2.341   0.417 1.00 . B A . 101 OCA C1   1 1 
       15 4043 2 2  1 .   C2   C   8.600 -2.193   1.889 1.00 . B A . 101 OCA C2   1 1 
       15 4044 2 2  1 .   C3   C   7.107 -2.357   2.150 1.00 . B A . 101 OCA C3   1 1 
       15 4045 2 2  1 .   C4   C   6.795 -3.709   2.767 1.00 . B A . 101 OCA C4   1 1 
       15 4046 2 2  1 .   C5   C   6.495 -3.590   4.253 1.00 . B A . 101 OCA C5   1 1 
       15 4047 2 2  1 .   C6   C   6.647 -4.926   4.965 1.00 . B A . 101 OCA C6   1 1 
       15 4048 2 2  1 .   C7   C   8.106 -5.243   5.262 1.00 . B A . 101 OCA C7   1 1 
       15 4049 2 2  1 .   C8   C   8.255 -6.567   5.978 1.00 . B A . 101 OCA C8   1 1 
       15 4050 2 2  1 .   H21  H   8.901 -1.210   2.222 1.00 . B A . 101 OCA H21  1 1 
       15 4051 2 2  1 .   H22  H   9.133 -2.942   2.453 1.00 . B A . 101 OCA H22  1 1 
       15 4052 2 2  1 .   H31  H   6.575 -2.268   1.214 1.00 . B A . 101 OCA H31  1 1 
       15 4053 2 2  1 .   H32  H   6.783 -1.580   2.825 1.00 . B A . 101 OCA H32  1 1 
       15 4054 2 2  1 .   H41  H   7.645 -4.360   2.632 1.00 . B A . 101 OCA H41  1 1 
       15 4055 2 2  1 .   H42  H   5.933 -4.130   2.268 1.00 . B A . 101 OCA H42  1 1 
       15 4056 2 2  1 .   H51  H   7.180 -2.880   4.692 1.00 . B A . 101 OCA H51  1 1 
       15 4057 2 2  1 .   H52  H   5.481 -3.239   4.378 1.00 . B A . 101 OCA H52  1 1 
       15 4058 2 2  1 .   H61  H   6.101 -4.887   5.895 1.00 . B A . 101 OCA H61  1 1 
       15 4059 2 2  1 .   H62  H   6.238 -5.704   4.337 1.00 . B A . 101 OCA H62  1 1 
       15 4060 2 2  1 .   H71  H   8.518 -4.467   5.889 1.00 . B A . 101 OCA H71  1 1 
       15 4061 2 2  1 .   H72  H   8.653 -5.293   4.332 1.00 . B A . 101 OCA H72  1 1 
       15 4062 2 2  1 .   H81  H   7.278 -6.990   6.159 1.00 . B A . 101 OCA H81  1 1 
       15 4063 2 2  1 .   H82  H   8.761 -6.413   6.918 1.00 . B A . 101 OCA H82  1 1 
       15 4064 2 2  1 .   H83  H   8.832 -7.246   5.366 1.00 . B A . 101 OCA H83  1 1 
       15 4065 2 2  1 .   O1   O   9.218 -3.421  -0.123 1.00 . B A . 101 OCA O1   1 1 
       16 4066 1 1  1 PRO C    C   7.277  0.461   0.309 1.00 . A A .   2 PRO C    1 1 
       16 4067 1 1  1 PRO CA   C   8.731  0.091   0.597 1.00 . A A .   2 PRO CA   1 1 
       16 4068 1 1  1 PRO CB   C   9.678  0.984  -0.197 1.00 . A A .   2 PRO CB   1 1 
       16 4069 1 1  1 PRO CD   C   9.475 -1.170  -1.313 1.00 . A A .   2 PRO CD   1 1 
       16 4070 1 1  1 PRO CG   C   9.886  0.278  -1.503 1.00 . A A .   2 PRO CG   1 1 
       16 4071 1 1  1 PRO HA   H   8.932  0.189   1.653 1.00 . A A .   2 PRO HA   1 1 
       16 4072 1 1  1 PRO HB2  H   9.221  1.953  -0.341 1.00 . A A .   2 PRO HB2  1 1 
       16 4073 1 1  1 PRO HB3  H  10.607  1.096   0.341 1.00 . A A .   2 PRO HB3  1 1 
       16 4074 1 1  1 PRO HD2  H   8.644 -1.412  -1.959 1.00 . A A .   2 PRO HD2  1 1 
       16 4075 1 1  1 PRO HD3  H  10.310 -1.826  -1.508 1.00 . A A .   2 PRO HD3  1 1 
       16 4076 1 1  1 PRO HG2  H   9.274  0.737  -2.265 1.00 . A A .   2 PRO HG2  1 1 
       16 4077 1 1  1 PRO HG3  H  10.927  0.333  -1.782 1.00 . A A .   2 PRO HG3  1 1 
       16 4078 1 1  1 PRO N    N   9.074 -1.238   0.099 1.00 . A A .   2 PRO N    1 1 
       16 4079 1 1  1 PRO O    O   6.803  1.522   0.707 1.00 . A A .   2 PRO O    1 1 
       16 4080 1 1  2 CYS C    C   4.358 -1.381  -0.286 1.00 . A A .   3 CYS C    1 1 
       16 4081 1 1  2 CYS CA   C   5.196 -0.200  -0.754 1.00 . A A .   3 CYS CA   1 1 
       16 4082 1 1  2 CYS CB   C   5.056 -0.034  -2.271 1.00 . A A .   3 CYS CB   1 1 
       16 4083 1 1  2 CYS H    H   7.026 -1.245  -0.689 1.00 . A A .   3 CYS H    1 1 
       16 4084 1 1  2 CYS HA   H   4.855  0.697  -0.260 1.00 . A A .   3 CYS HA   1 1 
       16 4085 1 1  2 CYS HB2  H   5.250 -0.983  -2.749 1.00 . A A .   3 CYS HB2  1 1 
       16 4086 1 1  2 CYS HB3  H   4.047  0.276  -2.499 1.00 . A A .   3 CYS HB3  1 1 
       16 4087 1 1  2 CYS N    N   6.586 -0.419  -0.398 1.00 . A A .   3 CYS N    1 1 
       16 4088 1 1  2 CYS O    O   4.651 -2.527  -0.630 1.00 . A A .   3 CYS O    1 1 
       16 4089 1 1  2 CYS SG   S   6.192  1.192  -3.003 1.00 . A A .   3 CYS SG   1 1 
       16 4090 1 1  3 LYS C    C   0.997 -1.808   0.750 1.00 . A A .   4 LYS C    1 1 
       16 4091 1 1  3 LYS CA   C   2.453 -2.164   0.990 1.00 . A A .   4 LYS CA   1 1 
       16 4092 1 1  3 LYS CB   C   2.702 -2.431   2.478 1.00 . A A .   4 LYS CB   1 1 
       16 4093 1 1  3 LYS CD   C   2.265 -4.125   4.291 1.00 . A A .   4 LYS CD   1 1 
       16 4094 1 1  3 LYS CE   C   3.403 -5.033   3.846 1.00 . A A .   4 LYS CE   1 1 
       16 4095 1 1  3 LYS CG   C   1.672 -3.350   3.124 1.00 . A A .   4 LYS CG   1 1 
       16 4096 1 1  3 LYS H    H   3.151 -0.179   0.762 1.00 . A A .   4 LYS H    1 1 
       16 4097 1 1  3 LYS HA   H   2.681 -3.061   0.434 1.00 . A A .   4 LYS HA   1 1 
       16 4098 1 1  3 LYS HB2  H   3.676 -2.884   2.591 1.00 . A A .   4 LYS HB2  1 1 
       16 4099 1 1  3 LYS HB3  H   2.689 -1.488   3.007 1.00 . A A .   4 LYS HB3  1 1 
       16 4100 1 1  3 LYS HD2  H   2.643 -3.422   5.019 1.00 . A A .   4 LYS HD2  1 1 
       16 4101 1 1  3 LYS HD3  H   1.489 -4.728   4.742 1.00 . A A .   4 LYS HD3  1 1 
       16 4102 1 1  3 LYS HE2  H   4.191 -4.421   3.433 1.00 . A A .   4 LYS HE2  1 1 
       16 4103 1 1  3 LYS HE3  H   3.777 -5.565   4.708 1.00 . A A .   4 LYS HE3  1 1 
       16 4104 1 1  3 LYS HG2  H   0.851 -2.749   3.490 1.00 . A A .   4 LYS HG2  1 1 
       16 4105 1 1  3 LYS HG3  H   1.303 -4.047   2.385 1.00 . A A .   4 LYS HG3  1 1 
       16 4106 1 1  3 LYS HZ1  H   3.774 -6.624   2.538 1.00 . A A .   4 LYS HZ1  1 1 
       16 4107 1 1  3 LYS HZ2  H   2.614 -5.528   1.970 1.00 . A A .   4 LYS HZ2  1 1 
       16 4108 1 1  3 LYS HZ3  H   2.210 -6.626   3.195 1.00 . A A .   4 LYS HZ3  1 1 
       16 4109 1 1  3 LYS N    N   3.330 -1.110   0.503 1.00 . A A .   4 LYS N    1 1 
       16 4110 1 1  3 LYS NZ   N   2.969 -6.019   2.817 1.00 . A A .   4 LYS NZ   1 1 
       16 4111 1 1  3 LYS O    O   0.516 -0.773   1.212 1.00 . A A .   4 LYS O    1 1 
       16 4112 1 1  4 ASN C    C  -1.899 -3.566   0.488 1.00 . A A .   5 ASN C    1 1 
       16 4113 1 1  4 ASN CA   C  -1.119 -2.465  -0.235 1.00 . A A .   5 ASN CA   1 1 
       16 4114 1 1  4 ASN CB   C  -1.441 -2.524  -1.743 1.00 . A A .   5 ASN CB   1 1 
       16 4115 1 1  4 ASN CG   C  -0.764 -1.439  -2.581 1.00 . A A .   5 ASN CG   1 1 
       16 4116 1 1  4 ASN H    H   0.749 -3.458  -0.358 1.00 . A A .   5 ASN H    1 1 
       16 4117 1 1  4 ASN HA   H  -1.396 -1.496   0.152 1.00 . A A .   5 ASN HA   1 1 
       16 4118 1 1  4 ASN HB2  H  -1.129 -3.484  -2.127 1.00 . A A .   5 ASN HB2  1 1 
       16 4119 1 1  4 ASN HB3  H  -2.510 -2.429  -1.869 1.00 . A A .   5 ASN HB3  1 1 
       16 4120 1 1  4 ASN HD21 H   0.858 -1.481  -1.441 1.00 . A A .   5 ASN HD21 1 1 
       16 4121 1 1  4 ASN HD22 H   0.893 -0.367  -2.756 1.00 . A A .   5 ASN HD22 1 1 
       16 4122 1 1  4 ASN N    N   0.301 -2.662   0.011 1.00 . A A .   5 ASN N    1 1 
       16 4123 1 1  4 ASN ND2  N   0.451 -1.055  -2.223 1.00 . A A .   5 ASN ND2  1 1 
       16 4124 1 1  4 ASN O    O  -1.823 -4.728   0.095 1.00 . A A .   5 ASN O    1 1 
       16 4125 1 1  4 ASN OD1  O  -1.324 -0.968  -3.570 1.00 . A A .   5 ASN OD1  1 1 
       16 4126 1 1  5 .   C    C  -4.587 -4.732   1.545 1.00 . A A .   6 O6H C    1 1 
       16 4127 1 1  5 .   CA   C  -3.380 -4.212   2.319 1.00 . A A .   6 O6H CA   1 1 
       16 4128 1 1  5 .   CB   C  -3.830 -3.662   3.679 1.00 . A A .   6 O6H CB   1 1 
       16 4129 1 1  5 .   CD1  C  -2.413 -1.918   4.811 1.00 . A A .   6 O6H CD1  1 1 
       16 4130 1 1  5 .   CD2  C  -1.895 -4.206   5.225 1.00 . A A .   6 O6H CD2  1 1 
       16 4131 1 1  5 .   CE1  C  -1.376 -1.526   5.633 1.00 . A A .   6 O6H CE1  1 1 
       16 4132 1 1  5 .   CE2  C  -0.853 -3.826   6.054 1.00 . A A .   6 O6H CE2  1 1 
       16 4133 1 1  5 .   CF1  C  -3.254 -0.867   4.156 1.00 . A A .   6 O6H CF1  1 1 
       16 4134 1 1  5 .   CF2  C  -2.158 -5.670   5.017 1.00 . A A .   6 O6H CF2  1 1 
       16 4135 1 1  5 .   CG   C  -2.695 -3.258   4.588 1.00 . A A .   6 O6H CG   1 1 
       16 4136 1 1  5 .   CH   C   0.528 -2.060   7.145 1.00 . A A .   6 O6H CH   1 1 
       16 4137 1 1  5 .   CZ   C  -0.600 -2.484   6.253 1.00 . A A .   6 O6H CZ   1 1 
       16 4138 1 1  5 .   H1   H  -2.634 -2.288   1.853 1.00 . A A .   6 O6H H1   1 1 
       16 4139 1 1  5 .   HA   H  -2.717 -5.045   2.497 1.00 . A A .   6 O6H HA   1 1 
       16 4140 1 1  5 .   HB1  H  -4.411 -4.417   4.189 1.00 . A A .   6 O6H HB1  1 1 
       16 4141 1 1  5 .   HB2  H  -4.449 -2.792   3.517 1.00 . A A .   6 O6H HB2  1 1 
       16 4142 1 1  5 .   HE1  H  -1.174 -0.477   5.791 1.00 . A A .   6 O6H HE1  1 1 
       16 4143 1 1  5 .   HE2  H  -0.242 -4.573   6.541 1.00 . A A .   6 O6H HE2  1 1 
       16 4144 1 1  5 .   HF11 H  -2.674 -0.101   3.662 1.00 . A A .   6 O6H HF11 1 1 
       16 4145 1 1  5 .   HF12 H  -3.892 -0.341   4.848 1.00 . A A .   6 O6H HF12 1 1 
       16 4146 1 1  5 .   HF13 H  -3.914 -1.260   3.397 1.00 . A A .   6 O6H HF13 1 1 
       16 4147 1 1  5 .   HF21 H  -2.563 -5.897   4.041 1.00 . A A .   6 O6H HF21 1 1 
       16 4148 1 1  5 .   HF22 H  -2.864 -6.084   5.722 1.00 . A A .   6 O6H HF22 1 1 
       16 4149 1 1  5 .   HF23 H  -1.273 -6.280   5.108 1.00 . A A .   6 O6H HF23 1 1 
       16 4150 1 1  5 .   HH1  H   1.503 -2.260   6.726 1.00 . A A .   6 O6H HH1  1 1 
       16 4151 1 1  5 .   HH2  H   0.522 -2.551   8.106 1.00 . A A .   6 O6H HH2  1 1 
       16 4152 1 1  5 .   HH3  H   0.524 -1.001   7.365 1.00 . A A .   6 O6H HH3  1 1 
       16 4153 1 1  5 .   N    N  -2.618 -3.220   1.559 1.00 . A A .   6 O6H N    1 1 
       16 4154 1 1  5 .   O    O  -4.923 -5.915   1.617 1.00 . A A .   6 O6H O    1 1 
       16 4155 1 1  6 PHE C    C  -6.470 -4.234  -1.271 1.00 . A A .   7 PHE C    1 1 
       16 4156 1 1  6 PHE CA   C  -6.560 -4.152   0.245 1.00 . A A .   7 PHE CA   1 1 
       16 4157 1 1  6 PHE CB   C  -7.602 -3.103   0.647 1.00 . A A .   7 PHE CB   1 1 
       16 4158 1 1  6 PHE CD1  C  -7.579 -3.502   3.127 1.00 . A A .   7 PHE CD1  1 1 
       16 4159 1 1  6 PHE CD2  C  -7.143 -1.298   2.324 1.00 . A A .   7 PHE CD2  1 1 
       16 4160 1 1  6 PHE CE1  C  -7.409 -3.065   4.426 1.00 . A A .   7 PHE CE1  1 1 
       16 4161 1 1  6 PHE CE2  C  -6.980 -0.854   3.622 1.00 . A A .   7 PHE CE2  1 1 
       16 4162 1 1  6 PHE CG   C  -7.445 -2.624   2.062 1.00 . A A .   7 PHE CG   1 1 
       16 4163 1 1  6 PHE CZ   C  -7.112 -1.740   4.674 1.00 . A A .   7 PHE CZ   1 1 
       16 4164 1 1  6 PHE H    H  -4.891 -2.937   0.723 1.00 . A A .   7 PHE H    1 1 
       16 4165 1 1  6 PHE HA   H  -6.870 -5.113   0.626 1.00 . A A .   7 PHE HA   1 1 
       16 4166 1 1  6 PHE HB2  H  -7.513 -2.249  -0.006 1.00 . A A .   7 PHE HB2  1 1 
       16 4167 1 1  6 PHE HB3  H  -8.590 -3.528   0.545 1.00 . A A .   7 PHE HB3  1 1 
       16 4168 1 1  6 PHE HD1  H  -7.814 -4.540   2.933 1.00 . A A .   7 PHE HD1  1 1 
       16 4169 1 1  6 PHE HD2  H  -7.040 -0.606   1.502 1.00 . A A .   7 PHE HD2  1 1 
       16 4170 1 1  6 PHE HE1  H  -7.516 -3.759   5.248 1.00 . A A .   7 PHE HE1  1 1 
       16 4171 1 1  6 PHE HE2  H  -6.751  0.183   3.813 1.00 . A A .   7 PHE HE2  1 1 
       16 4172 1 1  6 PHE HZ   H  -6.970 -1.397   5.687 1.00 . A A .   7 PHE HZ   1 1 
       16 4173 1 1  6 PHE N    N  -5.265 -3.833   0.841 1.00 . A A .   7 PHE N    1 1 
       16 4174 1 1  6 PHE O    O  -7.345 -4.796  -1.928 1.00 . A A .   7 PHE O    1 1 
       16 4175 1 1  7 DTR C    C  -4.975 -2.190  -3.758 1.00 . A A .   8 DTR C    1 1 
       16 4176 1 1  7 DTR CA   C  -5.252 -3.610  -3.264 1.00 . A A .   8 DTR CA   1 1 
       16 4177 1 1  7 DTR CB   C  -4.118 -4.558  -3.684 1.00 . A A .   8 DTR CB   1 1 
       16 4178 1 1  7 DTR CD1  C  -2.603 -4.121  -5.702 1.00 . A A .   8 DTR CD1  1 1 
       16 4179 1 1  7 DTR CD2  C  -4.673 -4.781  -6.239 1.00 . A A .   8 DTR CD2  1 1 
       16 4180 1 1  7 DTR CE2  C  -3.945 -4.573  -7.427 1.00 . A A .   8 DTR CE2  1 1 
       16 4181 1 1  7 DTR CE3  C  -6.004 -5.200  -6.329 1.00 . A A .   8 DTR CE3  1 1 
       16 4182 1 1  7 DTR CG   C  -3.793 -4.491  -5.147 1.00 . A A .   8 DTR CG   1 1 
       16 4183 1 1  7 DTR CH2  C  -5.808 -5.180  -8.743 1.00 . A A .   8 DTR CH2  1 1 
       16 4184 1 1  7 DTR CZ2  C  -4.504 -4.770  -8.686 1.00 . A A .   8 DTR CZ2  1 1 
       16 4185 1 1  7 DTR CZ3  C  -6.557 -5.395  -7.578 1.00 . A A .   8 DTR CZ3  1 1 
       16 4186 1 1  7 DTR H    H  -4.765 -3.206  -1.256 1.00 . A A .   8 DTR H    1 1 
       16 4187 1 1  7 DTR HA   H  -6.152 -4.004  -3.721 1.00 . A A .   8 DTR HA   1 1 
       16 4188 1 1  7 DTR HB2  H  -3.224 -4.304  -3.133 1.00 . A A .   8 DTR HB2  1 1 
       16 4189 1 1  7 DTR HB3  H  -4.403 -5.572  -3.450 1.00 . A A .   8 DTR HB3  1 1 
       16 4190 1 1  7 DTR HD1  H  -1.731 -3.835  -5.134 1.00 . A A .   8 DTR HD1  1 1 
       16 4191 1 1  7 DTR HE1  H  -1.952 -3.953  -7.696 1.00 . A A .   8 DTR HE1  1 1 
       16 4192 1 1  7 DTR HE3  H  -6.597 -5.369  -5.443 1.00 . A A .   8 DTR HE3  1 1 
       16 4193 1 1  7 DTR HH2  H  -6.283 -5.346  -9.700 1.00 . A A .   8 DTR HH2  1 1 
       16 4194 1 1  7 DTR HZ2  H  -3.941 -4.611  -9.593 1.00 . A A .   8 DTR HZ2  1 1 
       16 4195 1 1  7 DTR HZ3  H  -7.584 -5.718  -7.667 1.00 . A A .   8 DTR HZ3  1 1 
       16 4196 1 1  7 DTR N    N  -5.431 -3.636  -1.827 1.00 . A A .   8 DTR N    1 1 
       16 4197 1 1  7 DTR NE1  N  -2.685 -4.171  -7.072 1.00 . A A .   8 DTR NE1  1 1 
       16 4198 1 1  7 DTR O    O  -4.091 -1.521  -3.233 1.00 . A A .   8 DTR O    1 1 
       16 4199 1 1  8 LYS C    C  -6.114  0.719  -4.649 1.00 . A A .   9 LYS C    1 1 
       16 4200 1 1  8 LYS CA   C  -5.442 -0.440  -5.383 1.00 . A A .   9 LYS CA   1 1 
       16 4201 1 1  8 LYS CB   C  -5.891 -0.486  -6.849 1.00 . A A .   9 LYS CB   1 1 
       16 4202 1 1  8 LYS CD   C  -3.815  0.529  -7.850 1.00 . A A .   9 LYS CD   1 1 
       16 4203 1 1  8 LYS CE   C  -3.415 -0.712  -8.633 1.00 . A A .   9 LYS CE   1 1 
       16 4204 1 1  8 LYS CG   C  -5.325  0.638  -7.709 1.00 . A A .   9 LYS CG   1 1 
       16 4205 1 1  8 LYS H    H  -6.542 -2.205  -5.021 1.00 . A A .   9 LYS H    1 1 
       16 4206 1 1  8 LYS HA   H  -4.371 -0.300  -5.347 1.00 . A A .   9 LYS HA   1 1 
       16 4207 1 1  8 LYS HB2  H  -5.579 -1.428  -7.278 1.00 . A A .   9 LYS HB2  1 1 
       16 4208 1 1  8 LYS HB3  H  -6.971 -0.429  -6.885 1.00 . A A .   9 LYS HB3  1 1 
       16 4209 1 1  8 LYS HD2  H  -3.446  1.402  -8.367 1.00 . A A .   9 LYS HD2  1 1 
       16 4210 1 1  8 LYS HD3  H  -3.376  0.480  -6.864 1.00 . A A .   9 LYS HD3  1 1 
       16 4211 1 1  8 LYS HE2  H  -3.809 -1.583  -8.129 1.00 . A A .   9 LYS HE2  1 1 
       16 4212 1 1  8 LYS HE3  H  -3.840 -0.649  -9.623 1.00 . A A .   9 LYS HE3  1 1 
       16 4213 1 1  8 LYS HG2  H  -5.771  0.588  -8.691 1.00 . A A .   9 LYS HG2  1 1 
       16 4214 1 1  8 LYS HG3  H  -5.567  1.586  -7.250 1.00 . A A .   9 LYS HG3  1 1 
       16 4215 1 1  8 LYS HZ1  H  -1.698 -1.629  -9.392 1.00 . A A .   9 LYS HZ1  1 1 
       16 4216 1 1  8 LYS HZ2  H  -1.524 -1.043  -7.808 1.00 . A A .   9 LYS HZ2  1 1 
       16 4217 1 1  8 LYS HZ3  H  -1.527  0.036  -9.117 1.00 . A A .   9 LYS HZ3  1 1 
       16 4218 1 1  8 LYS N    N  -5.748 -1.708  -4.732 1.00 . A A .   9 LYS N    1 1 
       16 4219 1 1  8 LYS NZ   N  -1.939 -0.847  -8.746 1.00 . A A .   9 LYS NZ   1 1 
       16 4220 1 1  8 LYS O    O  -5.971  1.883  -5.027 1.00 . A A .   9 LYS O    1 1 
       16 4221 1 1  9 THR C    C  -6.577  2.111  -1.836 1.00 . A A .  10 THR C    1 1 
       16 4222 1 1  9 THR CA   C  -7.536  1.394  -2.798 1.00 . A A .  10 THR CA   1 1 
       16 4223 1 1  9 THR CB   C  -8.684  0.742  -2.001 1.00 . A A .  10 THR CB   1 1 
       16 4224 1 1  9 THR CG2  C  -9.642  1.795  -1.463 1.00 . A A .  10 THR CG2  1 1 
       16 4225 1 1  9 THR H    H  -6.926 -0.555  -3.347 1.00 . A A .  10 THR H    1 1 
       16 4226 1 1  9 THR HA   H  -7.962  2.120  -3.478 1.00 . A A .  10 THR HA   1 1 
       16 4227 1 1  9 THR HB   H  -8.264  0.198  -1.166 1.00 . A A .  10 THR HB   1 1 
       16 4228 1 1  9 THR HG1  H  -9.124 -0.054  -3.768 1.00 . A A .  10 THR HG1  1 1 
       16 4229 1 1  9 THR HG21 H -10.431  1.314  -0.903 1.00 . A A .  10 THR HG21 1 1 
       16 4230 1 1  9 THR HG22 H -10.069  2.344  -2.287 1.00 . A A .  10 THR HG22 1 1 
       16 4231 1 1  9 THR HG23 H  -9.104  2.475  -0.817 1.00 . A A .  10 THR HG23 1 1 
       16 4232 1 1  9 THR N    N  -6.835  0.392  -3.587 1.00 . A A .  10 THR N    1 1 
       16 4233 1 1  9 THR O    O  -6.810  3.257  -1.449 1.00 . A A .  10 THR O    1 1 
       16 4234 1 1  9 THR OG1  O  -9.403 -0.173  -2.844 1.00 . A A .  10 THR OG1  1 1 
       16 4235 1 1 10 PHE C    C  -3.086  1.909  -1.203 1.00 . A A .  11 PHE C    1 1 
       16 4236 1 1 10 PHE CA   C  -4.498  2.017  -0.573 1.00 . A A .  11 PHE CA   1 1 
       16 4237 1 1 10 PHE CB   C  -4.513  1.244   0.749 1.00 . A A .  11 PHE CB   1 1 
       16 4238 1 1 10 PHE CD1  C  -2.258  1.383   1.855 1.00 . A A .  11 PHE CD1  1 1 
       16 4239 1 1 10 PHE CD2  C  -4.027  2.734   2.714 1.00 . A A .  11 PHE CD2  1 1 
       16 4240 1 1 10 PHE CE1  C  -1.403  1.887   2.816 1.00 . A A .  11 PHE CE1  1 1 
       16 4241 1 1 10 PHE CE2  C  -3.176  3.242   3.678 1.00 . A A .  11 PHE CE2  1 1 
       16 4242 1 1 10 PHE CG   C  -3.580  1.800   1.792 1.00 . A A .  11 PHE CG   1 1 
       16 4243 1 1 10 PHE CZ   C  -1.861  2.816   3.729 1.00 . A A .  11 PHE CZ   1 1 
       16 4244 1 1 10 PHE H    H  -5.321  0.556  -1.847 1.00 . A A .  11 PHE H    1 1 
       16 4245 1 1 10 PHE HA   H  -4.779  3.039  -0.374 1.00 . A A .  11 PHE HA   1 1 
       16 4246 1 1 10 PHE HB2  H  -5.513  1.261   1.154 1.00 . A A .  11 PHE HB2  1 1 
       16 4247 1 1 10 PHE HB3  H  -4.227  0.220   0.557 1.00 . A A .  11 PHE HB3  1 1 
       16 4248 1 1 10 PHE HD1  H  -1.898  0.657   1.143 1.00 . A A .  11 PHE HD1  1 1 
       16 4249 1 1 10 PHE HD2  H  -5.053  3.069   2.674 1.00 . A A .  11 PHE HD2  1 1 
       16 4250 1 1 10 PHE HE1  H  -0.376  1.554   2.855 1.00 . A A .  11 PHE HE1  1 1 
       16 4251 1 1 10 PHE HE2  H  -3.538  3.970   4.390 1.00 . A A .  11 PHE HE2  1 1 
       16 4252 1 1 10 PHE HZ   H  -1.193  3.211   4.482 1.00 . A A .  11 PHE HZ   1 1 
       16 4253 1 1 10 PHE N    N  -5.482  1.445  -1.479 1.00 . A A .  11 PHE N    1 1 
       16 4254 1 1 10 PHE O    O  -2.580  0.796  -1.323 1.00 . A A .  11 PHE O    1 1 
       16 4255 1 1 11 THR C    C  -0.144  3.839  -1.420 1.00 . A A .  12 THR C    1 1 
       16 4256 1 1 11 THR CA   C  -1.088  2.897  -2.162 1.00 . A A .  12 THR CA   1 1 
       16 4257 1 1 11 THR CB   C  -1.066  3.205  -3.673 1.00 . A A .  12 THR CB   1 1 
       16 4258 1 1 11 THR CG2  C   0.323  2.998  -4.260 1.00 . A A .  12 THR CG2  1 1 
       16 4259 1 1 11 THR H    H  -2.853  3.894  -1.618 1.00 . A A .  12 THR H    1 1 
       16 4260 1 1 11 THR HA   H  -0.755  1.878  -2.018 1.00 . A A .  12 THR HA   1 1 
       16 4261 1 1 11 THR HB   H  -1.359  4.235  -3.822 1.00 . A A .  12 THR HB   1 1 
       16 4262 1 1 11 THR HG1  H  -2.002  1.480  -3.920 1.00 . A A .  12 THR HG1  1 1 
       16 4263 1 1 11 THR HG21 H   1.028  3.641  -3.755 1.00 . A A .  12 THR HG21 1 1 
       16 4264 1 1 11 THR HG22 H   0.308  3.236  -5.312 1.00 . A A .  12 THR HG22 1 1 
       16 4265 1 1 11 THR HG23 H   0.617  1.969  -4.130 1.00 . A A .  12 THR HG23 1 1 
       16 4266 1 1 11 THR N    N  -2.435  3.009  -1.632 1.00 . A A .  12 THR N    1 1 
       16 4267 1 1 11 THR O    O  -0.250  5.059  -1.532 1.00 . A A .  12 THR O    1 1 
       16 4268 1 1 11 THR OG1  O  -2.000  2.348  -4.347 1.00 . A A .  12 THR OG1  1 1 
       16 4269 1 1 12 SER C    C   3.133  3.506  -0.079 1.00 . A A .  13 SER C    1 1 
       16 4270 1 1 12 SER CA   C   1.717  4.054   0.117 1.00 . A A .  13 SER CA   1 1 
       16 4271 1 1 12 SER CB   C   1.353  4.054   1.600 1.00 . A A .  13 SER CB   1 1 
       16 4272 1 1 12 SER H    H   0.755  2.289  -0.536 1.00 . A A .  13 SER H    1 1 
       16 4273 1 1 12 SER HA   H   1.668  5.066  -0.255 1.00 . A A .  13 SER HA   1 1 
       16 4274 1 1 12 SER HB2  H   1.320  3.037   1.962 1.00 . A A .  13 SER HB2  1 1 
       16 4275 1 1 12 SER HB3  H   2.098  4.610   2.151 1.00 . A A .  13 SER HB3  1 1 
       16 4276 1 1 12 SER HG   H  -0.368  4.751   0.965 1.00 . A A .  13 SER HG   1 1 
       16 4277 1 1 12 SER N    N   0.749  3.266  -0.627 1.00 . A A .  13 SER N    1 1 
       16 4278 1 1 12 SER O    O   3.378  2.318   0.144 1.00 . A A .  13 SER O    1 1 
       16 4279 1 1 12 SER OG   O   0.086  4.657   1.811 1.00 . A A .  13 SER OG   1 1 
       16 4280 1 1 13 CYS C    C   6.338  4.845   0.252 1.00 . A A .  14 CYS C    1 1 
       16 4281 1 1 13 CYS CA   C   5.454  3.973  -0.629 1.00 . A A .  14 CYS CA   1 1 
       16 4282 1 1 13 CYS CB   C   5.895  4.066  -2.089 1.00 . A A .  14 CYS CB   1 1 
       16 4283 1 1 13 CYS H    H   3.801  5.287  -0.720 1.00 . A A .  14 CYS H    1 1 
       16 4284 1 1 13 CYS HA   H   5.541  2.947  -0.301 1.00 . A A .  14 CYS HA   1 1 
       16 4285 1 1 13 CYS HB2  H   5.679  5.058  -2.461 1.00 . A A .  14 CYS HB2  1 1 
       16 4286 1 1 13 CYS HB3  H   6.958  3.888  -2.150 1.00 . A A .  14 CYS HB3  1 1 
       16 4287 1 1 13 CYS N    N   4.060  4.364  -0.493 1.00 . A A .  14 CYS N    1 1 
       16 4288 1 1 13 CYS O    O   6.446  6.053   0.040 1.00 . A A .  14 CYS O    1 1 
       16 4289 1 1 13 CYS SG   S   5.065  2.869  -3.188 1.00 . A A .  14 CYS SG   1 1 
       16 4290 1 1 14 LYS C    C   9.223  4.478   2.103 1.00 . A A .  15 LYS C    1 1 
       16 4291 1 1 14 LYS CA   C   7.777  4.943   2.203 1.00 . A A .  15 LYS CA   1 1 
       16 4292 1 1 14 LYS CB   C   7.244  4.734   3.623 1.00 . A A .  15 LYS CB   1 1 
       16 4293 1 1 14 LYS CD   C   5.296  4.913   5.206 1.00 . A A .  15 LYS CD   1 1 
       16 4294 1 1 14 LYS CE   C   3.862  5.389   5.392 1.00 . A A .  15 LYS CE   1 1 
       16 4295 1 1 14 LYS CG   C   5.827  5.252   3.821 1.00 . A A .  15 LYS CG   1 1 
       16 4296 1 1 14 LYS H    H   6.868  3.250   1.328 1.00 . A A .  15 LYS H    1 1 
       16 4297 1 1 14 LYS HA   H   7.732  5.992   1.961 1.00 . A A .  15 LYS HA   1 1 
       16 4298 1 1 14 LYS HB2  H   7.253  3.677   3.846 1.00 . A A .  15 LYS HB2  1 1 
       16 4299 1 1 14 LYS HB3  H   7.893  5.246   4.319 1.00 . A A .  15 LYS HB3  1 1 
       16 4300 1 1 14 LYS HD2  H   5.330  3.843   5.346 1.00 . A A .  15 LYS HD2  1 1 
       16 4301 1 1 14 LYS HD3  H   5.922  5.394   5.945 1.00 . A A .  15 LYS HD3  1 1 
       16 4302 1 1 14 LYS HE2  H   3.270  5.045   4.557 1.00 . A A .  15 LYS HE2  1 1 
       16 4303 1 1 14 LYS HE3  H   3.472  4.964   6.306 1.00 . A A .  15 LYS HE3  1 1 
       16 4304 1 1 14 LYS HG2  H   5.828  6.324   3.700 1.00 . A A .  15 LYS HG2  1 1 
       16 4305 1 1 14 LYS HG3  H   5.183  4.803   3.077 1.00 . A A .  15 LYS HG3  1 1 
       16 4306 1 1 14 LYS HZ1  H   4.264  7.312   4.667 1.00 . A A .  15 LYS HZ1  1 1 
       16 4307 1 1 14 LYS HZ2  H   4.205  7.208   6.358 1.00 . A A .  15 LYS HZ2  1 1 
       16 4308 1 1 14 LYS HZ3  H   2.772  7.170   5.458 1.00 . A A .  15 LYS HZ3  1 1 
       16 4309 1 1 14 LYS N    N   6.954  4.227   1.246 1.00 . A A .  15 LYS N    1 1 
       16 4310 1 1 14 LYS NZ   N   3.769  6.871   5.472 1.00 . A A .  15 LYS NZ   1 1 
       16 4311 1 1 14 LYS O    O  10.061  5.244   1.576 1.00 . A A .  15 LYS O    1 1 
       16 4312 1 1 14 LYS OXT  O   9.514  3.342   2.526 1.00 . A A .  15 LYS OXT  1 1 
       16 4313 2 2  1 .   C1   C   9.064 -2.361   0.853 1.00 . B A . 101 OCA C1   1 1 
       16 4314 2 2  1 .   C2   C   8.731 -2.038   2.305 1.00 . B A . 101 OCA C2   1 1 
       16 4315 2 2  1 .   C3   C   7.239 -2.081   2.601 1.00 . B A . 101 OCA C3   1 1 
       16 4316 2 2  1 .   C4   C   6.947 -1.640   4.026 1.00 . B A . 101 OCA C4   1 1 
       16 4317 2 2  1 .   C5   C   5.577 -0.994   4.146 1.00 . B A . 101 OCA C5   1 1 
       16 4318 2 2  1 .   C6   C   5.633  0.498   3.852 1.00 . B A . 101 OCA C6   1 1 
       16 4319 2 2  1 .   C7   C   4.649  1.281   4.707 1.00 . B A . 101 OCA C7   1 1 
       16 4320 2 2  1 .   C8   C   3.214  0.895   4.411 1.00 . B A . 101 OCA C8   1 1 
       16 4321 2 2  1 .   H21  H   9.100 -1.047   2.529 1.00 . B A . 101 OCA H21  1 1 
       16 4322 2 2  1 .   H22  H   9.230 -2.756   2.939 1.00 . B A . 101 OCA H22  1 1 
       16 4323 2 2  1 .   H31  H   6.729 -1.422   1.915 1.00 . B A . 101 OCA H31  1 1 
       16 4324 2 2  1 .   H32  H   6.885 -3.093   2.465 1.00 . B A . 101 OCA H32  1 1 
       16 4325 2 2  1 .   H41  H   6.984 -2.503   4.674 1.00 . B A . 101 OCA H41  1 1 
       16 4326 2 2  1 .   H42  H   7.698 -0.926   4.330 1.00 . B A . 101 OCA H42  1 1 
       16 4327 2 2  1 .   H51  H   4.906 -1.464   3.443 1.00 . B A . 101 OCA H51  1 1 
       16 4328 2 2  1 .   H52  H   5.208 -1.139   5.151 1.00 . B A . 101 OCA H52  1 1 
       16 4329 2 2  1 .   H61  H   6.633  0.856   4.053 1.00 . B A . 101 OCA H61  1 1 
       16 4330 2 2  1 .   H62  H   5.394  0.656   2.811 1.00 . B A . 101 OCA H62  1 1 
       16 4331 2 2  1 .   H71  H   4.850  1.085   5.750 1.00 . B A . 101 OCA H71  1 1 
       16 4332 2 2  1 .   H72  H   4.765  2.337   4.505 1.00 . B A . 101 OCA H72  1 1 
       16 4333 2 2  1 .   H81  H   3.186 -0.113   4.023 1.00 . B A . 101 OCA H81  1 1 
       16 4334 2 2  1 .   H82  H   2.801  1.573   3.681 1.00 . B A . 101 OCA H82  1 1 
       16 4335 2 2  1 .   H83  H   2.633  0.945   5.320 1.00 . B A . 101 OCA H83  1 1 
       16 4336 2 2  1 .   O1   O   9.240 -3.504   0.424 1.00 . B A . 101 OCA O1   1 1 
       17 4337 1 1  1 PRO C    C   6.850  0.429   0.119 1.00 . A A .   2 PRO C    1 1 
       17 4338 1 1  1 PRO CA   C   8.317  0.061   0.340 1.00 . A A .   2 PRO CA   1 1 
       17 4339 1 1  1 PRO CB   C   9.233  1.145  -0.218 1.00 . A A .   2 PRO CB   1 1 
       17 4340 1 1  1 PRO CD   C   9.270 -0.725  -1.747 1.00 . A A .   2 PRO CD   1 1 
       17 4341 1 1  1 PRO CG   C   9.428  0.776  -1.651 1.00 . A A .   2 PRO CG   1 1 
       17 4342 1 1  1 PRO HA   H   8.504 -0.068   1.395 1.00 . A A .   2 PRO HA   1 1 
       17 4343 1 1  1 PRO HB2  H   8.757  2.110  -0.117 1.00 . A A .   2 PRO HB2  1 1 
       17 4344 1 1  1 PRO HB3  H  10.169  1.139   0.319 1.00 . A A .   2 PRO HB3  1 1 
       17 4345 1 1  1 PRO HD2  H   8.584 -0.980  -2.541 1.00 . A A .   2 PRO HD2  1 1 
       17 4346 1 1  1 PRO HD3  H  10.230 -1.194  -1.915 1.00 . A A .   2 PRO HD3  1 1 
       17 4347 1 1  1 PRO HG2  H   8.680  1.267  -2.256 1.00 . A A .   2 PRO HG2  1 1 
       17 4348 1 1  1 PRO HG3  H  10.417  1.069  -1.972 1.00 . A A .   2 PRO HG3  1 1 
       17 4349 1 1  1 PRO N    N   8.718 -1.117  -0.434 1.00 . A A .   2 PRO N    1 1 
       17 4350 1 1  1 PRO O    O   6.372  1.453   0.608 1.00 . A A .   2 PRO O    1 1 
       17 4351 1 1  2 CYS C    C   3.952 -1.467  -0.527 1.00 . A A .   3 CYS C    1 1 
       17 4352 1 1  2 CYS CA   C   4.734 -0.207  -0.896 1.00 . A A .   3 CYS CA   1 1 
       17 4353 1 1  2 CYS CB   C   4.512  0.136  -2.374 1.00 . A A .   3 CYS CB   1 1 
       17 4354 1 1  2 CYS H    H   6.595 -1.190  -1.021 1.00 . A A .   3 CYS H    1 1 
       17 4355 1 1  2 CYS HA   H   4.392  0.616  -0.286 1.00 . A A .   3 CYS HA   1 1 
       17 4356 1 1  2 CYS HB2  H   4.614 -0.762  -2.963 1.00 . A A .   3 CYS HB2  1 1 
       17 4357 1 1  2 CYS HB3  H   3.513  0.528  -2.495 1.00 . A A .   3 CYS HB3  1 1 
       17 4358 1 1  2 CYS N    N   6.148 -0.411  -0.632 1.00 . A A .   3 CYS N    1 1 
       17 4359 1 1  2 CYS O    O   4.084 -2.503  -1.180 1.00 . A A .   3 CYS O    1 1 
       17 4360 1 1  2 CYS SG   S   5.678  1.372  -3.042 1.00 . A A .   3 CYS SG   1 1 
       17 4361 1 1  3 LYS C    C   0.875 -2.210   0.730 1.00 . A A .   4 LYS C    1 1 
       17 4362 1 1  3 LYS CA   C   2.347 -2.507   0.977 1.00 . A A .   4 LYS CA   1 1 
       17 4363 1 1  3 LYS CB   C   2.580 -2.779   2.470 1.00 . A A .   4 LYS CB   1 1 
       17 4364 1 1  3 LYS CD   C   1.819 -5.193   2.326 1.00 . A A .   4 LYS CD   1 1 
       17 4365 1 1  3 LYS CE   C   3.219 -5.770   2.442 1.00 . A A .   4 LYS CE   1 1 
       17 4366 1 1  3 LYS CG   C   1.681 -3.865   3.059 1.00 . A A .   4 LYS CG   1 1 
       17 4367 1 1  3 LYS H    H   3.143 -0.546   1.056 1.00 . A A .   4 LYS H    1 1 
       17 4368 1 1  3 LYS HA   H   2.635 -3.376   0.407 1.00 . A A .   4 LYS HA   1 1 
       17 4369 1 1  3 LYS HB2  H   3.607 -3.075   2.616 1.00 . A A .   4 LYS HB2  1 1 
       17 4370 1 1  3 LYS HB3  H   2.399 -1.866   3.020 1.00 . A A .   4 LYS HB3  1 1 
       17 4371 1 1  3 LYS HD2  H   1.118 -5.897   2.747 1.00 . A A .   4 LYS HD2  1 1 
       17 4372 1 1  3 LYS HD3  H   1.590 -5.040   1.282 1.00 . A A .   4 LYS HD3  1 1 
       17 4373 1 1  3 LYS HE2  H   3.922 -5.063   2.030 1.00 . A A .   4 LYS HE2  1 1 
       17 4374 1 1  3 LYS HE3  H   3.442 -5.932   3.487 1.00 . A A .   4 LYS HE3  1 1 
       17 4375 1 1  3 LYS HG2  H   1.948 -4.013   4.095 1.00 . A A .   4 LYS HG2  1 1 
       17 4376 1 1  3 LYS HG3  H   0.654 -3.536   2.997 1.00 . A A .   4 LYS HG3  1 1 
       17 4377 1 1  3 LYS HZ1  H   4.312 -7.434   1.802 1.00 . A A .   4 LYS HZ1  1 1 
       17 4378 1 1  3 LYS HZ2  H   3.128 -6.916   0.698 1.00 . A A .   4 LYS HZ2  1 1 
       17 4379 1 1  3 LYS HZ3  H   2.672 -7.757   2.099 1.00 . A A .   4 LYS HZ3  1 1 
       17 4380 1 1  3 LYS N    N   3.167 -1.385   0.537 1.00 . A A .   4 LYS N    1 1 
       17 4381 1 1  3 LYS NZ   N   3.342 -7.057   1.711 1.00 . A A .   4 LYS NZ   1 1 
       17 4382 1 1  3 LYS O    O   0.357 -1.187   1.174 1.00 . A A .   4 LYS O    1 1 
       17 4383 1 1  4 ASN C    C  -2.013 -3.966   0.598 1.00 . A A .   5 ASN C    1 1 
       17 4384 1 1  4 ASN CA   C  -1.226 -2.931  -0.210 1.00 . A A .   5 ASN CA   1 1 
       17 4385 1 1  4 ASN CB   C  -1.530 -3.128  -1.700 1.00 . A A .   5 ASN CB   1 1 
       17 4386 1 1  4 ASN CG   C  -0.655 -2.294  -2.623 1.00 . A A .   5 ASN CG   1 1 
       17 4387 1 1  4 ASN H    H   0.652 -3.896  -0.328 1.00 . A A .   5 ASN H    1 1 
       17 4388 1 1  4 ASN HA   H  -1.505 -1.931   0.085 1.00 . A A .   5 ASN HA   1 1 
       17 4389 1 1  4 ASN HB2  H  -1.387 -4.167  -1.951 1.00 . A A .   5 ASN HB2  1 1 
       17 4390 1 1  4 ASN HB3  H  -2.562 -2.860  -1.882 1.00 . A A .   5 ASN HB3  1 1 
       17 4391 1 1  4 ASN HD21 H  -0.610 -0.796  -1.319 1.00 . A A .   5 ASN HD21 1 1 
       17 4392 1 1  4 ASN HD22 H   0.278 -0.546  -2.787 1.00 . A A .   5 ASN HD22 1 1 
       17 4393 1 1  4 ASN N    N   0.195 -3.107   0.032 1.00 . A A .   5 ASN N    1 1 
       17 4394 1 1  4 ASN ND2  N  -0.296 -1.092  -2.200 1.00 . A A .   5 ASN ND2  1 1 
       17 4395 1 1  4 ASN O    O  -1.946 -5.160   0.306 1.00 . A A .   5 ASN O    1 1 
       17 4396 1 1  4 ASN OD1  O  -0.316 -2.730  -3.725 1.00 . A A .   5 ASN OD1  1 1 
       17 4397 1 1  5 .   C    C  -4.840 -4.796   1.595 1.00 . A A .   6 O6H C    1 1 
       17 4398 1 1  5 .   CA   C  -3.605 -4.404   2.398 1.00 . A A .   6 O6H CA   1 1 
       17 4399 1 1  5 .   CB   C  -4.009 -3.783   3.742 1.00 . A A .   6 O6H CB   1 1 
       17 4400 1 1  5 .   CD1  C  -2.081 -4.456   5.246 1.00 . A A .   6 O6H CD1  1 1 
       17 4401 1 1  5 .   CD2  C  -2.472 -2.135   4.867 1.00 . A A .   6 O6H CD2  1 1 
       17 4402 1 1  5 .   CE1  C  -1.003 -4.147   6.053 1.00 . A A .   6 O6H CE1  1 1 
       17 4403 1 1  5 .   CE2  C  -1.400 -1.814   5.672 1.00 . A A .   6 O6H CE2  1 1 
       17 4404 1 1  5 .   CF1  C  -2.431 -5.901   5.031 1.00 . A A .   6 O6H CF1  1 1 
       17 4405 1 1  5 .   CF2  C  -3.269 -1.030   4.242 1.00 . A A .   6 O6H CF2  1 1 
       17 4406 1 1  5 .   CG   C  -2.836 -3.455   4.635 1.00 . A A .   6 O6H CG   1 1 
       17 4407 1 1  5 .   CH   C   0.496 -2.475   7.134 1.00 . A A .   6 O6H CH   1 1 
       17 4408 1 1  5 .   CZ   C  -0.668 -2.822   6.259 1.00 . A A .   6 O6H CZ   1 1 
       17 4409 1 1  5 .   H1   H  -2.637 -2.588   1.915 1.00 . A A .   6 O6H H1   1 1 
       17 4410 1 1  5 .   HA   H  -3.046 -5.308   2.599 1.00 . A A .   6 O6H HA   1 1 
       17 4411 1 1  5 .   HB1  H  -4.651 -4.472   4.273 1.00 . A A .   6 O6H HB1  1 1 
       17 4412 1 1  5 .   HB2  H  -4.552 -2.868   3.558 1.00 . A A .   6 O6H HB2  1 1 
       17 4413 1 1  5 .   HE1  H  -0.430 -4.934   6.519 1.00 . A A .   6 O6H HE1  1 1 
       17 4414 1 1  5 .   HE2  H  -1.132 -0.780   5.836 1.00 . A A .   6 O6H HE2  1 1 
       17 4415 1 1  5 .   HF11 H  -3.481 -6.065   4.835 1.00 . A A .   6 O6H HF11 1 1 
       17 4416 1 1  5 .   HF12 H  -1.912 -6.348   4.196 1.00 . A A .   6 O6H HF12 1 1 
       17 4417 1 1  5 .   HF13 H  -2.200 -6.527   5.879 1.00 . A A .   6 O6H HF13 1 1 
       17 4418 1 1  5 .   HF21 H  -3.986 -1.381   3.518 1.00 . A A .   6 O6H HF21 1 1 
       17 4419 1 1  5 .   HF22 H  -2.662 -0.308   3.716 1.00 . A A .   6 O6H HF22 1 1 
       17 4420 1 1  5 .   HF23 H  -3.839 -0.457   4.957 1.00 . A A .   6 O6H HF23 1 1 
       17 4421 1 1  5 .   HH1  H   0.668 -3.191   7.922 1.00 . A A .   6 O6H HH1  1 1 
       17 4422 1 1  5 .   HH2  H   0.385 -1.523   7.632 1.00 . A A .   6 O6H HH2  1 1 
       17 4423 1 1  5 .   HH3  H   1.432 -2.408   6.597 1.00 . A A .   6 O6H HH3  1 1 
       17 4424 1 1  5 .   N    N  -2.721 -3.523   1.639 1.00 . A A .   6 O6H N    1 1 
       17 4425 1 1  5 .   O    O  -5.301 -5.932   1.653 1.00 . A A .   6 O6H O    1 1 
       17 4426 1 1  6 PHE C    C  -6.531 -4.100  -1.297 1.00 . A A .   7 PHE C    1 1 
       17 4427 1 1  6 PHE CA   C  -6.680 -3.998   0.214 1.00 . A A .   7 PHE CA   1 1 
       17 4428 1 1  6 PHE CB   C  -7.610 -2.829   0.558 1.00 . A A .   7 PHE CB   1 1 
       17 4429 1 1  6 PHE CD1  C  -7.868 -3.254   3.023 1.00 . A A .   7 PHE CD1  1 1 
       17 4430 1 1  6 PHE CD2  C  -7.084 -1.117   2.308 1.00 . A A .   7 PHE CD2  1 1 
       17 4431 1 1  6 PHE CE1  C  -7.775 -2.851   4.342 1.00 . A A .   7 PHE CE1  1 1 
       17 4432 1 1  6 PHE CE2  C  -6.992 -0.708   3.624 1.00 . A A .   7 PHE CE2  1 1 
       17 4433 1 1  6 PHE CG   C  -7.523 -2.393   1.993 1.00 . A A .   7 PHE CG   1 1 
       17 4434 1 1  6 PHE CZ   C  -7.335 -1.574   4.641 1.00 . A A .   7 PHE CZ   1 1 
       17 4435 1 1  6 PHE H    H  -4.901 -2.987   0.757 1.00 . A A .   7 PHE H    1 1 
       17 4436 1 1  6 PHE HA   H  -7.120 -4.912   0.585 1.00 . A A .   7 PHE HA   1 1 
       17 4437 1 1  6 PHE HB2  H  -7.358 -1.982  -0.062 1.00 . A A .   7 PHE HB2  1 1 
       17 4438 1 1  6 PHE HB3  H  -8.631 -3.122   0.361 1.00 . A A .   7 PHE HB3  1 1 
       17 4439 1 1  6 PHE HD1  H  -8.210 -4.251   2.790 1.00 . A A .   7 PHE HD1  1 1 
       17 4440 1 1  6 PHE HD2  H  -6.814 -0.438   1.513 1.00 . A A .   7 PHE HD2  1 1 
       17 4441 1 1  6 PHE HE1  H  -8.047 -3.531   5.137 1.00 . A A .   7 PHE HE1  1 1 
       17 4442 1 1  6 PHE HE2  H  -6.651  0.290   3.856 1.00 . A A .   7 PHE HE2  1 1 
       17 4443 1 1  6 PHE HZ   H  -7.255 -1.257   5.669 1.00 . A A .   7 PHE HZ   1 1 
       17 4444 1 1  6 PHE N    N  -5.383 -3.830   0.862 1.00 . A A .   7 PHE N    1 1 
       17 4445 1 1  6 PHE O    O  -7.440 -4.548  -1.993 1.00 . A A .   7 PHE O    1 1 
       17 4446 1 1  7 DTR C    C  -4.663 -2.240  -3.678 1.00 . A A .   8 DTR C    1 1 
       17 4447 1 1  7 DTR CA   C  -5.141 -3.625  -3.227 1.00 . A A .   8 DTR CA   1 1 
       17 4448 1 1  7 DTR CB   C  -4.123 -4.720  -3.586 1.00 . A A .   8 DTR CB   1 1 
       17 4449 1 1  7 DTR CD1  C  -2.381 -4.764  -5.463 1.00 . A A .   8 DTR CD1  1 1 
       17 4450 1 1  7 DTR CD2  C  -4.490 -4.554  -6.186 1.00 . A A .   8 DTR CD2  1 1 
       17 4451 1 1  7 DTR CE2  C  -3.631 -4.561  -7.299 1.00 . A A .   8 DTR CE2  1 1 
       17 4452 1 1  7 DTR CE3  C  -5.869 -4.433  -6.402 1.00 . A A .   8 DTR CE3  1 1 
       17 4453 1 1  7 DTR CG   C  -3.668 -4.687  -5.016 1.00 . A A .   8 DTR CG   1 1 
       17 4454 1 1  7 DTR CH2  C  -5.449 -4.326  -8.785 1.00 . A A .   8 DTR CH2  1 1 
       17 4455 1 1  7 DTR CZ2  C  -4.100 -4.445  -8.603 1.00 . A A .   8 DTR CZ2  1 1 
       17 4456 1 1  7 DTR CZ3  C  -6.332 -4.319  -7.699 1.00 . A A .   8 DTR CZ3  1 1 
       17 4457 1 1  7 DTR H    H  -4.718 -3.287  -1.194 1.00 . A A .   8 DTR H    1 1 
       17 4458 1 1  7 DTR HA   H  -6.059 -3.890  -3.737 1.00 . A A .   8 DTR HA   1 1 
       17 4459 1 1  7 DTR HB2  H  -3.251 -4.605  -2.961 1.00 . A A .   8 DTR HB2  1 1 
       17 4460 1 1  7 DTR HB3  H  -4.568 -5.685  -3.400 1.00 . A A .   8 DTR HB3  1 1 
       17 4461 1 1  7 DTR HD1  H  -1.520 -4.868  -4.820 1.00 . A A .   8 DTR HD1  1 1 
       17 4462 1 1  7 DTR HE1  H  -1.538 -4.733  -7.388 1.00 . A A .   8 DTR HE1  1 1 
       17 4463 1 1  7 DTR HE3  H  -6.566 -4.424  -5.575 1.00 . A A .   8 DTR HE3  1 1 
       17 4464 1 1  7 DTR HH2  H  -5.855 -4.235  -9.782 1.00 . A A .   8 DTR HH2  1 1 
       17 4465 1 1  7 DTR HZ2  H  -3.433 -4.436  -9.449 1.00 . A A .   8 DTR HZ2  1 1 
       17 4466 1 1  7 DTR HZ3  H  -7.391 -4.226  -7.885 1.00 . A A .   8 DTR HZ3  1 1 
       17 4467 1 1  7 DTR N    N  -5.402 -3.634  -1.799 1.00 . A A .   8 DTR N    1 1 
       17 4468 1 1  7 DTR NE1  N  -2.351 -4.692  -6.832 1.00 . A A .   8 DTR NE1  1 1 
       17 4469 1 1  7 DTR O    O  -3.779 -1.661  -3.051 1.00 . A A .   8 DTR O    1 1 
       17 4470 1 1  8 LYS C    C  -5.571  0.747  -4.581 1.00 . A A .   9 LYS C    1 1 
       17 4471 1 1  8 LYS CA   C  -4.833 -0.395  -5.256 1.00 . A A .   9 LYS CA   1 1 
       17 4472 1 1  8 LYS CB   C  -4.990 -0.326  -6.778 1.00 . A A .   9 LYS CB   1 1 
       17 4473 1 1  8 LYS CD   C  -2.549 -0.911  -6.861 1.00 . A A .   9 LYS CD   1 1 
       17 4474 1 1  8 LYS CE   C  -1.411 -1.340  -7.771 1.00 . A A .   9 LYS CE   1 1 
       17 4475 1 1  8 LYS CG   C  -3.909 -1.088  -7.525 1.00 . A A .   9 LYS CG   1 1 
       17 4476 1 1  8 LYS H    H  -6.012 -2.142  -5.162 1.00 . A A .   9 LYS H    1 1 
       17 4477 1 1  8 LYS HA   H  -3.782 -0.294  -5.020 1.00 . A A .   9 LYS HA   1 1 
       17 4478 1 1  8 LYS HB2  H  -5.951 -0.742  -7.048 1.00 . A A .   9 LYS HB2  1 1 
       17 4479 1 1  8 LYS HB3  H  -4.954  0.704  -7.091 1.00 . A A .   9 LYS HB3  1 1 
       17 4480 1 1  8 LYS HD2  H  -2.417  0.130  -6.608 1.00 . A A .   9 LYS HD2  1 1 
       17 4481 1 1  8 LYS HD3  H  -2.521 -1.508  -5.961 1.00 . A A .   9 LYS HD3  1 1 
       17 4482 1 1  8 LYS HE2  H  -0.538 -1.545  -7.172 1.00 . A A .   9 LYS HE2  1 1 
       17 4483 1 1  8 LYS HE3  H  -1.707 -2.237  -8.292 1.00 . A A .   9 LYS HE3  1 1 
       17 4484 1 1  8 LYS HG2  H  -4.164 -2.138  -7.532 1.00 . A A .   9 LYS HG2  1 1 
       17 4485 1 1  8 LYS HG3  H  -3.856 -0.722  -8.539 1.00 . A A .   9 LYS HG3  1 1 
       17 4486 1 1  8 LYS HZ1  H  -1.881 -0.154  -9.425 1.00 . A A .   9 LYS HZ1  1 1 
       17 4487 1 1  8 LYS HZ2  H  -0.245 -0.583  -9.325 1.00 . A A .   9 LYS HZ2  1 1 
       17 4488 1 1  8 LYS HZ3  H  -0.871  0.610  -8.294 1.00 . A A .   9 LYS HZ3  1 1 
       17 4489 1 1  8 LYS N    N  -5.266 -1.682  -4.727 1.00 . A A .   9 LYS N    1 1 
       17 4490 1 1  8 LYS NZ   N  -1.079 -0.295  -8.772 1.00 . A A .   9 LYS NZ   1 1 
       17 4491 1 1  8 LYS O    O  -5.336  1.916  -4.874 1.00 . A A .   9 LYS O    1 1 
       17 4492 1 1  9 THR C    C  -6.388  2.029  -1.827 1.00 . A A .  10 THR C    1 1 
       17 4493 1 1  9 THR CA   C  -7.228  1.382  -2.931 1.00 . A A .  10 THR CA   1 1 
       17 4494 1 1  9 THR CB   C  -8.458  0.709  -2.297 1.00 . A A .  10 THR CB   1 1 
       17 4495 1 1  9 THR CG2  C  -9.651  1.653  -2.280 1.00 . A A .  10 THR CG2  1 1 
       17 4496 1 1  9 THR H    H  -6.605 -0.557  -3.480 1.00 . A A .  10 THR H    1 1 
       17 4497 1 1  9 THR HA   H  -7.560  2.137  -3.626 1.00 . A A .  10 THR HA   1 1 
       17 4498 1 1  9 THR HB   H  -8.216  0.437  -1.280 1.00 . A A .  10 THR HB   1 1 
       17 4499 1 1  9 THR HG1  H  -9.730 -0.457  -3.274 1.00 . A A .  10 THR HG1  1 1 
       17 4500 1 1  9 THR HG21 H  -9.888  1.953  -3.290 1.00 . A A .  10 THR HG21 1 1 
       17 4501 1 1  9 THR HG22 H  -9.410  2.527  -1.693 1.00 . A A .  10 THR HG22 1 1 
       17 4502 1 1  9 THR HG23 H -10.500  1.150  -1.844 1.00 . A A .  10 THR HG23 1 1 
       17 4503 1 1  9 THR N    N  -6.445  0.396  -3.652 1.00 . A A .  10 THR N    1 1 
       17 4504 1 1  9 THR O    O  -6.698  3.123  -1.353 1.00 . A A .  10 THR O    1 1 
       17 4505 1 1  9 THR OG1  O  -8.791 -0.477  -3.036 1.00 . A A .  10 THR OG1  1 1 
       17 4506 1 1 10 PHE C    C  -2.945  1.889  -1.124 1.00 . A A .  11 PHE C    1 1 
       17 4507 1 1 10 PHE CA   C  -4.360  1.915  -0.490 1.00 . A A .  11 PHE CA   1 1 
       17 4508 1 1 10 PHE CB   C  -4.348  1.082   0.798 1.00 . A A .  11 PHE CB   1 1 
       17 4509 1 1 10 PHE CD1  C  -2.113  1.195   1.940 1.00 . A A .  11 PHE CD1  1 1 
       17 4510 1 1 10 PHE CD2  C  -3.885  2.554   2.780 1.00 . A A .  11 PHE CD2  1 1 
       17 4511 1 1 10 PHE CE1  C  -1.268  1.688   2.918 1.00 . A A .  11 PHE CE1  1 1 
       17 4512 1 1 10 PHE CE2  C  -3.045  3.049   3.759 1.00 . A A .  11 PHE CE2  1 1 
       17 4513 1 1 10 PHE CG   C  -3.430  1.621   1.861 1.00 . A A .  11 PHE CG   1 1 
       17 4514 1 1 10 PHE CZ   C  -1.735  2.616   3.828 1.00 . A A .  11 PHE CZ   1 1 
       17 4515 1 1 10 PHE H    H  -5.137  0.468  -1.800 1.00 . A A .  11 PHE H    1 1 
       17 4516 1 1 10 PHE HA   H  -4.683  2.917  -0.247 1.00 . A A .  11 PHE HA   1 1 
       17 4517 1 1 10 PHE HB2  H  -5.347  1.052   1.208 1.00 . A A .  11 PHE HB2  1 1 
       17 4518 1 1 10 PHE HB3  H  -4.031  0.076   0.564 1.00 . A A .  11 PHE HB3  1 1 
       17 4519 1 1 10 PHE HD1  H  -1.747  0.469   1.228 1.00 . A A .  11 PHE HD1  1 1 
       17 4520 1 1 10 PHE HD2  H  -4.908  2.894   2.729 1.00 . A A .  11 PHE HD2  1 1 
       17 4521 1 1 10 PHE HE1  H  -0.245  1.347   2.970 1.00 . A A .  11 PHE HE1  1 1 
       17 4522 1 1 10 PHE HE2  H  -3.413  3.776   4.469 1.00 . A A .  11 PHE HE2  1 1 
       17 4523 1 1 10 PHE HZ   H  -1.074  3.001   4.590 1.00 . A A .  11 PHE HZ   1 1 
       17 4524 1 1 10 PHE N    N  -5.309  1.355  -1.432 1.00 . A A .  11 PHE N    1 1 
       17 4525 1 1 10 PHE O    O  -2.406  0.799  -1.313 1.00 . A A .  11 PHE O    1 1 
       17 4526 1 1 11 THR C    C  -0.125  4.026  -1.208 1.00 . A A .  12 THR C    1 1 
       17 4527 1 1 11 THR CA   C  -0.973  3.018  -1.976 1.00 . A A .  12 THR CA   1 1 
       17 4528 1 1 11 THR CB   C  -0.906  3.326  -3.485 1.00 . A A .  12 THR CB   1 1 
       17 4529 1 1 11 THR CG2  C   0.527  3.268  -3.992 1.00 . A A .  12 THR CG2  1 1 
       17 4530 1 1 11 THR H    H  -2.822  3.892  -1.503 1.00 . A A .  12 THR H    1 1 
       17 4531 1 1 11 THR HA   H  -0.575  2.027  -1.811 1.00 . A A .  12 THR HA   1 1 
       17 4532 1 1 11 THR HB   H  -1.290  4.321  -3.650 1.00 . A A .  12 THR HB   1 1 
       17 4533 1 1 11 THR HG1  H  -2.238  1.872  -3.591 1.00 . A A .  12 THR HG1  1 1 
       17 4534 1 1 11 THR HG21 H   0.546  3.506  -5.046 1.00 . A A .  12 THR HG21 1 1 
       17 4535 1 1 11 THR HG22 H   0.924  2.275  -3.839 1.00 . A A .  12 THR HG22 1 1 
       17 4536 1 1 11 THR HG23 H   1.127  3.984  -3.452 1.00 . A A .  12 THR HG23 1 1 
       17 4537 1 1 11 THR N    N  -2.342  3.034  -1.498 1.00 . A A .  12 THR N    1 1 
       17 4538 1 1 11 THR O    O  -0.308  5.236  -1.333 1.00 . A A .  12 THR O    1 1 
       17 4539 1 1 11 THR OG1  O  -1.707  2.384  -4.212 1.00 . A A .  12 THR OG1  1 1 
       17 4540 1 1 12 SER C    C   3.118  3.828   0.166 1.00 . A A .  13 SER C    1 1 
       17 4541 1 1 12 SER CA   C   1.700  4.358   0.350 1.00 . A A .  13 SER CA   1 1 
       17 4542 1 1 12 SER CB   C   1.321  4.380   1.830 1.00 . A A .  13 SER CB   1 1 
       17 4543 1 1 12 SER H    H   0.818  2.546  -0.266 1.00 . A A .  13 SER H    1 1 
       17 4544 1 1 12 SER HA   H   1.632  5.358  -0.050 1.00 . A A .  13 SER HA   1 1 
       17 4545 1 1 12 SER HB2  H   1.397  3.381   2.236 1.00 . A A .  13 SER HB2  1 1 
       17 4546 1 1 12 SER HB3  H   1.989  5.040   2.365 1.00 . A A .  13 SER HB3  1 1 
       17 4547 1 1 12 SER HG   H  -0.361  5.092   1.137 1.00 . A A .  13 SER HG   1 1 
       17 4548 1 1 12 SER N    N   0.772  3.518  -0.383 1.00 . A A .  13 SER N    1 1 
       17 4549 1 1 12 SER O    O   3.383  2.662   0.452 1.00 . A A .  13 SER O    1 1 
       17 4550 1 1 12 SER OG   O  -0.006  4.843   1.995 1.00 . A A .  13 SER OG   1 1 
       17 4551 1 1 13 CYS C    C   6.389  5.105   0.153 1.00 . A A .  14 CYS C    1 1 
       17 4552 1 1 13 CYS CA   C   5.385  4.230  -0.583 1.00 . A A .  14 CYS CA   1 1 
       17 4553 1 1 13 CYS CB   C   5.662  4.248  -2.086 1.00 . A A .  14 CYS CB   1 1 
       17 4554 1 1 13 CYS H    H   3.775  5.599  -0.497 1.00 . A A .  14 CYS H    1 1 
       17 4555 1 1 13 CYS HA   H   5.482  3.217  -0.222 1.00 . A A .  14 CYS HA   1 1 
       17 4556 1 1 13 CYS HB2  H   5.488  5.243  -2.463 1.00 . A A .  14 CYS HB2  1 1 
       17 4557 1 1 13 CYS HB3  H   6.693  3.976  -2.258 1.00 . A A .  14 CYS HB3  1 1 
       17 4558 1 1 13 CYS N    N   4.021  4.665  -0.318 1.00 . A A .  14 CYS N    1 1 
       17 4559 1 1 13 CYS O    O   6.563  6.282  -0.169 1.00 . A A .  14 CYS O    1 1 
       17 4560 1 1 13 CYS SG   S   4.619  3.102  -3.048 1.00 . A A .  14 CYS SG   1 1 
       17 4561 1 1 14 LYS C    C   8.908  4.226   2.695 1.00 . A A .  15 LYS C    1 1 
       17 4562 1 1 14 LYS CA   C   8.017  5.228   1.963 1.00 . A A .  15 LYS CA   1 1 
       17 4563 1 1 14 LYS CB   C   7.353  6.207   2.960 1.00 . A A .  15 LYS CB   1 1 
       17 4564 1 1 14 LYS CD   C   4.892  5.595   3.120 1.00 . A A .  15 LYS CD   1 1 
       17 4565 1 1 14 LYS CE   C   4.115  6.891   3.338 1.00 . A A .  15 LYS CE   1 1 
       17 4566 1 1 14 LYS CG   C   6.245  5.604   3.824 1.00 . A A .  15 LYS CG   1 1 
       17 4567 1 1 14 LYS H    H   6.834  3.582   1.368 1.00 . A A .  15 LYS H    1 1 
       17 4568 1 1 14 LYS HA   H   8.638  5.796   1.284 1.00 . A A .  15 LYS HA   1 1 
       17 4569 1 1 14 LYS HB2  H   8.113  6.598   3.618 1.00 . A A .  15 LYS HB2  1 1 
       17 4570 1 1 14 LYS HB3  H   6.928  7.026   2.400 1.00 . A A .  15 LYS HB3  1 1 
       17 4571 1 1 14 LYS HD2  H   5.050  5.462   2.062 1.00 . A A .  15 LYS HD2  1 1 
       17 4572 1 1 14 LYS HD3  H   4.307  4.769   3.503 1.00 . A A .  15 LYS HD3  1 1 
       17 4573 1 1 14 LYS HE2  H   3.192  6.837   2.784 1.00 . A A .  15 LYS HE2  1 1 
       17 4574 1 1 14 LYS HE3  H   3.891  6.986   4.391 1.00 . A A .  15 LYS HE3  1 1 
       17 4575 1 1 14 LYS HG2  H   6.512  4.587   4.070 1.00 . A A .  15 LYS HG2  1 1 
       17 4576 1 1 14 LYS HG3  H   6.161  6.181   4.732 1.00 . A A .  15 LYS HG3  1 1 
       17 4577 1 1 14 LYS HZ1  H   5.670  8.275   3.539 1.00 . A A .  15 LYS HZ1  1 1 
       17 4578 1 1 14 LYS HZ2  H   4.239  8.932   2.912 1.00 . A A .  15 LYS HZ2  1 1 
       17 4579 1 1 14 LYS HZ3  H   5.228  7.970   1.929 1.00 . A A .  15 LYS HZ3  1 1 
       17 4580 1 1 14 LYS N    N   7.027  4.524   1.160 1.00 . A A .  15 LYS N    1 1 
       17 4581 1 1 14 LYS NZ   N   4.864  8.098   2.897 1.00 . A A .  15 LYS NZ   1 1 
       17 4582 1 1 14 LYS O    O   8.576  3.840   3.839 1.00 . A A .  15 LYS O    1 1 
       17 4583 1 1 14 LYS OXT  O   9.929  3.805   2.111 1.00 . A A .  15 LYS OXT  1 1 
       17 4584 2 2  1 .   C1   C   8.612 -2.390   0.011 1.00 . B A . 101 OCA C1   1 1 
       17 4585 2 2  1 .   C2   C   8.081 -2.421   1.438 1.00 . B A . 101 OCA C2   1 1 
       17 4586 2 2  1 .   C3   C   9.190 -2.357   2.478 1.00 . B A . 101 OCA C3   1 1 
       17 4587 2 2  1 .   C4   C   8.645 -2.505   3.889 1.00 . B A . 101 OCA C4   1 1 
       17 4588 2 2  1 .   C5   C   8.503 -1.159   4.577 1.00 . B A . 101 OCA C5   1 1 
       17 4589 2 2  1 .   C6   C   7.490 -1.219   5.708 1.00 . B A . 101 OCA C6   1 1 
       17 4590 2 2  1 .   C7   C   7.712 -0.100   6.710 1.00 . B A . 101 OCA C7   1 1 
       17 4591 2 2  1 .   C8   C   6.709 -0.153   7.842 1.00 . B A . 101 OCA C8   1 1 
       17 4592 2 2  1 .   H21  H   7.426 -1.575   1.580 1.00 . B A . 101 OCA H21  1 1 
       17 4593 2 2  1 .   H22  H   7.524 -3.336   1.581 1.00 . B A . 101 OCA H22  1 1 
       17 4594 2 2  1 .   H31  H   9.892 -3.155   2.291 1.00 . B A . 101 OCA H31  1 1 
       17 4595 2 2  1 .   H32  H   9.692 -1.405   2.397 1.00 . B A . 101 OCA H32  1 1 
       17 4596 2 2  1 .   H41  H   7.676 -2.977   3.839 1.00 . B A . 101 OCA H41  1 1 
       17 4597 2 2  1 .   H42  H   9.321 -3.124   4.461 1.00 . B A . 101 OCA H42  1 1 
       17 4598 2 2  1 .   H51  H   9.461 -0.868   4.980 1.00 . B A . 101 OCA H51  1 1 
       17 4599 2 2  1 .   H52  H   8.176 -0.428   3.853 1.00 . B A . 101 OCA H52  1 1 
       17 4600 2 2  1 .   H61  H   6.498 -1.126   5.292 1.00 . B A . 101 OCA H61  1 1 
       17 4601 2 2  1 .   H62  H   7.585 -2.169   6.213 1.00 . B A . 101 OCA H62  1 1 
       17 4602 2 2  1 .   H71  H   7.612  0.852   6.208 1.00 . B A . 101 OCA H71  1 1 
       17 4603 2 2  1 .   H72  H   8.703 -0.189   7.129 1.00 . B A . 101 OCA H72  1 1 
       17 4604 2 2  1 .   H81  H   7.219  0.000   8.781 1.00 . B A . 101 OCA H81  1 1 
       17 4605 2 2  1 .   H82  H   6.227 -1.119   7.847 1.00 . B A . 101 OCA H82  1 1 
       17 4606 2 2  1 .   H83  H   5.967  0.620   7.704 1.00 . B A . 101 OCA H83  1 1 
       17 4607 2 2  1 .   O1   O   8.943 -3.391  -0.622 1.00 . B A . 101 OCA O1   1 1 
       18 4608 1 1  1 PRO C    C   7.279 -0.139   0.415 1.00 . A A .   2 PRO C    1 1 
       18 4609 1 1  1 PRO CA   C   8.724 -0.593   0.629 1.00 . A A .   2 PRO CA   1 1 
       18 4610 1 1  1 PRO CB   C   9.692  0.344  -0.087 1.00 . A A .   2 PRO CB   1 1 
       18 4611 1 1  1 PRO CD   C   9.434 -1.682  -1.406 1.00 . A A .   2 PRO CD   1 1 
       18 4612 1 1  1 PRO CG   C   9.837 -0.222  -1.466 1.00 . A A .   2 PRO CG   1 1 
       18 4613 1 1  1 PRO HA   H   8.946 -0.612   1.686 1.00 . A A .   2 PRO HA   1 1 
       18 4614 1 1  1 PRO HB2  H   9.278  1.343  -0.110 1.00 . A A .   2 PRO HB2  1 1 
       18 4615 1 1  1 PRO HB3  H  10.637  0.354   0.434 1.00 . A A .   2 PRO HB3  1 1 
       18 4616 1 1  1 PRO HD2  H   8.618 -1.876  -2.086 1.00 . A A .   2 PRO HD2  1 1 
       18 4617 1 1  1 PRO HD3  H  10.279 -2.313  -1.641 1.00 . A A .   2 PRO HD3  1 1 
       18 4618 1 1  1 PRO HG2  H   9.191  0.312  -2.148 1.00 . A A .   2 PRO HG2  1 1 
       18 4619 1 1  1 PRO HG3  H  10.864 -0.134  -1.785 1.00 . A A .   2 PRO HG3  1 1 
       18 4620 1 1  1 PRO N    N   9.011 -1.877  -0.009 1.00 . A A .   2 PRO N    1 1 
       18 4621 1 1  1 PRO O    O   6.868  0.910   0.908 1.00 . A A .   2 PRO O    1 1 
       18 4622 1 1  2 CYS C    C   4.257 -1.854  -0.297 1.00 . A A .   3 CYS C    1 1 
       18 4623 1 1  2 CYS CA   C   5.126 -0.636  -0.599 1.00 . A A .   3 CYS CA   1 1 
       18 4624 1 1  2 CYS CB   C   4.947 -0.218  -2.059 1.00 . A A .   3 CYS CB   1 1 
       18 4625 1 1  2 CYS H    H   6.915 -1.750  -0.705 1.00 . A A .   3 CYS H    1 1 
       18 4626 1 1  2 CYS HA   H   4.832  0.181   0.042 1.00 . A A .   3 CYS HA   1 1 
       18 4627 1 1  2 CYS HB2  H   5.225 -1.042  -2.697 1.00 . A A .   3 CYS HB2  1 1 
       18 4628 1 1  2 CYS HB3  H   3.908  0.028  -2.231 1.00 . A A .   3 CYS HB3  1 1 
       18 4629 1 1  2 CYS N    N   6.522 -0.936  -0.328 1.00 . A A .   3 CYS N    1 1 
       18 4630 1 1  2 CYS O    O   4.443 -2.916  -0.889 1.00 . A A .   3 CYS O    1 1 
       18 4631 1 1  2 CYS SG   S   5.950  1.225  -2.549 1.00 . A A .   3 CYS SG   1 1 
       18 4632 1 1  3 LYS C    C   0.978 -2.357   0.728 1.00 . A A .   4 LYS C    1 1 
       18 4633 1 1  3 LYS CA   C   2.416 -2.782   0.983 1.00 . A A .   4 LYS CA   1 1 
       18 4634 1 1  3 LYS CB   C   2.585 -3.172   2.458 1.00 . A A .   4 LYS CB   1 1 
       18 4635 1 1  3 LYS CD   C   1.880 -5.581   2.168 1.00 . A A .   4 LYS CD   1 1 
       18 4636 1 1  3 LYS CE   C   0.846 -6.634   2.543 1.00 . A A .   4 LYS CE   1 1 
       18 4637 1 1  3 LYS CG   C   1.639 -4.275   2.914 1.00 . A A .   4 LYS CG   1 1 
       18 4638 1 1  3 LYS H    H   3.227 -0.837   1.081 1.00 . A A .   4 LYS H    1 1 
       18 4639 1 1  3 LYS HA   H   2.647 -3.633   0.362 1.00 . A A .   4 LYS HA   1 1 
       18 4640 1 1  3 LYS HB2  H   3.598 -3.510   2.616 1.00 . A A .   4 LYS HB2  1 1 
       18 4641 1 1  3 LYS HB3  H   2.406 -2.300   3.069 1.00 . A A .   4 LYS HB3  1 1 
       18 4642 1 1  3 LYS HD2  H   1.823 -5.393   1.106 1.00 . A A .   4 LYS HD2  1 1 
       18 4643 1 1  3 LYS HD3  H   2.863 -5.950   2.419 1.00 . A A .   4 LYS HD3  1 1 
       18 4644 1 1  3 LYS HE2  H   0.866 -6.774   3.614 1.00 . A A .   4 LYS HE2  1 1 
       18 4645 1 1  3 LYS HE3  H  -0.129 -6.279   2.249 1.00 . A A .   4 LYS HE3  1 1 
       18 4646 1 1  3 LYS HG2  H   1.783 -4.447   3.970 1.00 . A A .   4 LYS HG2  1 1 
       18 4647 1 1  3 LYS HG3  H   0.622 -3.956   2.737 1.00 . A A .   4 LYS HG3  1 1 
       18 4648 1 1  3 LYS HZ1  H   0.333 -8.612   2.109 1.00 . A A .   4 LYS HZ1  1 1 
       18 4649 1 1  3 LYS HZ2  H   2.006 -8.343   2.219 1.00 . A A .   4 LYS HZ2  1 1 
       18 4650 1 1  3 LYS HZ3  H   1.151 -7.821   0.847 1.00 . A A .   4 LYS HZ3  1 1 
       18 4651 1 1  3 LYS N    N   3.322 -1.702   0.630 1.00 . A A .   4 LYS N    1 1 
       18 4652 1 1  3 LYS NZ   N   1.103 -7.940   1.884 1.00 . A A .   4 LYS NZ   1 1 
       18 4653 1 1  3 LYS O    O   0.533 -1.321   1.223 1.00 . A A .   4 LYS O    1 1 
       18 4654 1 1  4 ASN C    C  -1.998 -3.926   0.455 1.00 . A A .   5 ASN C    1 1 
       18 4655 1 1  4 ASN CA   C  -1.153 -2.882  -0.277 1.00 . A A .   5 ASN CA   1 1 
       18 4656 1 1  4 ASN CB   C  -1.451 -2.948  -1.778 1.00 . A A .   5 ASN CB   1 1 
       18 4657 1 1  4 ASN CG   C  -0.491 -2.121  -2.617 1.00 . A A .   5 ASN CG   1 1 
       18 4658 1 1  4 ASN H    H   0.665 -3.948  -0.436 1.00 . A A .   5 ASN H    1 1 
       18 4659 1 1  4 ASN HA   H  -1.375 -1.891   0.089 1.00 . A A .   5 ASN HA   1 1 
       18 4660 1 1  4 ASN HB2  H  -1.385 -3.974  -2.105 1.00 . A A .   5 ASN HB2  1 1 
       18 4661 1 1  4 ASN HB3  H  -2.454 -2.587  -1.953 1.00 . A A .   5 ASN HB3  1 1 
       18 4662 1 1  4 ASN HD21 H  -1.692 -0.537  -2.503 1.00 . A A .   5 ASN HD21 1 1 
       18 4663 1 1  4 ASN HD22 H  -0.243 -0.325  -3.430 1.00 . A A .   5 ASN HD22 1 1 
       18 4664 1 1  4 ASN N    N   0.251 -3.157  -0.032 1.00 . A A .   5 ASN N    1 1 
       18 4665 1 1  4 ASN ND2  N  -0.841 -0.869  -2.871 1.00 . A A .   5 ASN ND2  1 1 
       18 4666 1 1  4 ASN O    O  -1.982 -5.098   0.086 1.00 . A A .   5 ASN O    1 1 
       18 4667 1 1  4 ASN OD1  O   0.560 -2.610  -3.041 1.00 . A A .   5 ASN OD1  1 1 
       18 4668 1 1  5 .   C    C  -4.796 -4.815   1.460 1.00 . A A .   6 O6H C    1 1 
       18 4669 1 1  5 .   CA   C  -3.558 -4.430   2.255 1.00 . A A .   6 O6H CA   1 1 
       18 4670 1 1  5 .   CB   C  -3.947 -3.845   3.617 1.00 . A A .   6 O6H CB   1 1 
       18 4671 1 1  5 .   CD1  C  -2.038 -4.546   5.127 1.00 . A A .   6 O6H CD1  1 1 
       18 4672 1 1  5 .   CD2  C  -2.344 -2.227   4.689 1.00 . A A .   6 O6H CD2  1 1 
       18 4673 1 1  5 .   CE1  C  -0.943 -4.256   5.921 1.00 . A A .   6 O6H CE1  1 1 
       18 4674 1 1  5 .   CE2  C  -1.256 -1.923   5.480 1.00 . A A .   6 O6H CE2  1 1 
       18 4675 1 1  5 .   CF1  C  -2.450 -5.979   4.949 1.00 . A A .   6 O6H CF1  1 1 
       18 4676 1 1  5 .   CF2  C  -3.098 -1.114   4.034 1.00 . A A .   6 O6H CF2  1 1 
       18 4677 1 1  5 .   CG   C  -2.758 -3.535   4.495 1.00 . A A .   6 O6H CG   1 1 
       18 4678 1 1  5 .   CH   C   0.628 -2.614   6.947 1.00 . A A .   6 O6H CH   1 1 
       18 4679 1 1  5 .   CZ   C  -0.559 -2.942   6.091 1.00 . A A .   6 O6H CZ   1 1 
       18 4680 1 1  5 .   H1   H  -2.621 -2.593   1.819 1.00 . A A .   6 O6H H1   1 1 
       18 4681 1 1  5 .   HA   H  -2.985 -5.329   2.429 1.00 . A A .   6 O6H HA   1 1 
       18 4682 1 1  5 .   HB1  H  -4.573 -4.552   4.140 1.00 . A A .   6 O6H HB1  1 1 
       18 4683 1 1  5 .   HB2  H  -4.495 -2.928   3.463 1.00 . A A .   6 O6H HB2  1 1 
       18 4684 1 1  5 .   HE1  H  -0.396 -5.051   6.404 1.00 . A A .   6 O6H HE1  1 1 
       18 4685 1 1  5 .   HE2  H  -0.952 -0.897   5.616 1.00 . A A .   6 O6H HE2  1 1 
       18 4686 1 1  5 .   HF11 H  -2.467 -6.538   5.873 1.00 . A A .   6 O6H HF11 1 1 
       18 4687 1 1  5 .   HF12 H  -1.795 -6.532   4.292 1.00 . A A .   6 O6H HF12 1 1 
       18 4688 1 1  5 .   HF13 H  -3.438 -6.093   4.528 1.00 . A A .   6 O6H HF13 1 1 
       18 4689 1 1  5 .   HF21 H  -4.089 -0.974   4.437 1.00 . A A .   6 O6H HF21 1 1 
       18 4690 1 1  5 .   HF22 H  -2.612 -0.153   4.131 1.00 . A A .   6 O6H HF22 1 1 
       18 4691 1 1  5 .   HF23 H  -3.237 -1.258   2.973 1.00 . A A .   6 O6H HF23 1 1 
       18 4692 1 1  5 .   HH1  H   0.373 -2.050   7.832 1.00 . A A .   6 O6H HH1  1 1 
       18 4693 1 1  5 .   HH2  H   1.156 -3.486   7.304 1.00 . A A .   6 O6H HH2  1 1 
       18 4694 1 1  5 .   HH3  H   1.371 -2.020   6.435 1.00 . A A .   6 O6H HH3  1 1 
       18 4695 1 1  5 .   N    N  -2.695 -3.519   1.514 1.00 . A A .   6 O6H N    1 1 
       18 4696 1 1  5 .   O    O  -5.252 -5.953   1.515 1.00 . A A .   6 O6H O    1 1 
       18 4697 1 1  6 PHE C    C  -6.492 -4.114  -1.417 1.00 . A A .   7 PHE C    1 1 
       18 4698 1 1  6 PHE CA   C  -6.649 -4.058   0.095 1.00 . A A .   7 PHE CA   1 1 
       18 4699 1 1  6 PHE CB   C  -7.630 -2.939   0.463 1.00 . A A .   7 PHE CB   1 1 
       18 4700 1 1  6 PHE CD1  C  -7.892 -3.352   2.926 1.00 . A A .   7 PHE CD1  1 1 
       18 4701 1 1  6 PHE CD2  C  -7.082 -1.227   2.208 1.00 . A A .   7 PHE CD2  1 1 
       18 4702 1 1  6 PHE CE1  C  -7.793 -2.946   4.243 1.00 . A A .   7 PHE CE1  1 1 
       18 4703 1 1  6 PHE CE2  C  -6.984 -0.815   3.520 1.00 . A A .   7 PHE CE2  1 1 
       18 4704 1 1  6 PHE CG   C  -7.538 -2.499   1.896 1.00 . A A .   7 PHE CG   1 1 
       18 4705 1 1  6 PHE CZ   C  -7.338 -1.675   4.540 1.00 . A A .   7 PHE CZ   1 1 
       18 4706 1 1  6 PHE H    H  -4.917 -2.985   0.673 1.00 . A A .   7 PHE H    1 1 
       18 4707 1 1  6 PHE HA   H  -7.048 -5.000   0.441 1.00 . A A .   7 PHE HA   1 1 
       18 4708 1 1  6 PHE HB2  H  -7.436 -2.081  -0.160 1.00 . A A .   7 PHE HB2  1 1 
       18 4709 1 1  6 PHE HB3  H  -8.639 -3.285   0.286 1.00 . A A .   7 PHE HB3  1 1 
       18 4710 1 1  6 PHE HD1  H  -8.249 -4.345   2.693 1.00 . A A .   7 PHE HD1  1 1 
       18 4711 1 1  6 PHE HD2  H  -6.804 -0.554   1.411 1.00 . A A .   7 PHE HD2  1 1 
       18 4712 1 1  6 PHE HE1  H  -8.073 -3.620   5.038 1.00 . A A .   7 PHE HE1  1 1 
       18 4713 1 1  6 PHE HE2  H  -6.629  0.180   3.750 1.00 . A A .   7 PHE HE2  1 1 
       18 4714 1 1  6 PHE HZ   H  -7.256 -1.356   5.567 1.00 . A A .   7 PHE HZ   1 1 
       18 4715 1 1  6 PHE N    N  -5.364 -3.849   0.752 1.00 . A A .   7 PHE N    1 1 
       18 4716 1 1  6 PHE O    O  -7.371 -4.603  -2.123 1.00 . A A .   7 PHE O    1 1 
       18 4717 1 1  7 DTR C    C  -4.806 -2.100  -3.788 1.00 . A A .   8 DTR C    1 1 
       18 4718 1 1  7 DTR CA   C  -5.151 -3.527  -3.345 1.00 . A A .   8 DTR CA   1 1 
       18 4719 1 1  7 DTR CB   C  -4.035 -4.497  -3.757 1.00 . A A .   8 DTR CB   1 1 
       18 4720 1 1  7 DTR CD1  C  -4.500 -5.381  -6.115 1.00 . A A .   8 DTR CD1  1 1 
       18 4721 1 1  7 DTR CD2  C  -2.924 -3.793  -6.034 1.00 . A A .   8 DTR CD2  1 1 
       18 4722 1 1  7 DTR CE2  C  -3.092 -4.190  -7.372 1.00 . A A .   8 DTR CE2  1 1 
       18 4723 1 1  7 DTR CE3  C  -1.982 -2.800  -5.739 1.00 . A A .   8 DTR CE3  1 1 
       18 4724 1 1  7 DTR CG   C  -3.838 -4.568  -5.243 1.00 . A A .   8 DTR CG   1 1 
       18 4725 1 1  7 DTR CH2  C  -1.442 -2.660  -8.097 1.00 . A A .   8 DTR CH2  1 1 
       18 4726 1 1  7 DTR CZ2  C  -2.357 -3.628  -8.414 1.00 . A A .   8 DTR CZ2  1 1 
       18 4727 1 1  7 DTR CZ3  C  -1.252 -2.245  -6.773 1.00 . A A .   8 DTR CZ3  1 1 
       18 4728 1 1  7 DTR H    H  -4.707 -3.223  -1.307 1.00 . A A .   8 DTR H    1 1 
       18 4729 1 1  7 DTR HA   H  -6.047 -3.874  -3.843 1.00 . A A .   8 DTR HA   1 1 
       18 4730 1 1  7 DTR HB2  H  -3.106 -4.177  -3.310 1.00 . A A .   8 DTR HB2  1 1 
       18 4731 1 1  7 DTR HB3  H  -4.279 -5.488  -3.402 1.00 . A A .   8 DTR HB3  1 1 
       18 4732 1 1  7 DTR HD1  H  -5.263 -6.090  -5.826 1.00 . A A .   8 DTR HD1  1 1 
       18 4733 1 1  7 DTR HE1  H  -4.385 -5.627  -8.204 1.00 . A A .   8 DTR HE1  1 1 
       18 4734 1 1  7 DTR HE3  H  -1.819 -2.468  -4.724 1.00 . A A .   8 DTR HE3  1 1 
       18 4735 1 1  7 DTR HH2  H  -0.850 -2.199  -8.874 1.00 . A A .   8 DTR HH2  1 1 
       18 4736 1 1  7 DTR HZ2  H  -2.493 -3.933  -9.440 1.00 . A A .   8 DTR HZ2  1 1 
       18 4737 1 1  7 DTR HZ3  H  -0.521 -1.477  -6.562 1.00 . A A .   8 DTR HZ3  1 1 
       18 4738 1 1  7 DTR N    N  -5.383 -3.583  -1.914 1.00 . A A .   8 DTR N    1 1 
       18 4739 1 1  7 DTR NE1  N  -4.059 -5.160  -7.396 1.00 . A A .   8 DTR NE1  1 1 
       18 4740 1 1  7 DTR O    O  -3.925 -1.471  -3.202 1.00 . A A .   8 DTR O    1 1 
       18 4741 1 1  8 LYS C    C  -5.883  0.845  -4.649 1.00 . A A .   9 LYS C    1 1 
       18 4742 1 1  8 LYS CA   C  -5.162 -0.285  -5.372 1.00 . A A .   9 LYS CA   1 1 
       18 4743 1 1  8 LYS CB   C  -5.499 -0.269  -6.867 1.00 . A A .   9 LYS CB   1 1 
       18 4744 1 1  8 LYS CD   C  -7.222 -0.659  -8.664 1.00 . A A .   9 LYS CD   1 1 
       18 4745 1 1  8 LYS CE   C  -6.378 -1.702  -9.377 1.00 . A A .   9 LYS CE   1 1 
       18 4746 1 1  8 LYS CG   C  -6.943 -0.637  -7.171 1.00 . A A .   9 LYS CG   1 1 
       18 4747 1 1  8 LYS H    H  -6.299 -2.049  -5.137 1.00 . A A .   9 LYS H    1 1 
       18 4748 1 1  8 LYS HA   H  -4.097 -0.149  -5.253 1.00 . A A .   9 LYS HA   1 1 
       18 4749 1 1  8 LYS HB2  H  -5.316  0.722  -7.255 1.00 . A A .   9 LYS HB2  1 1 
       18 4750 1 1  8 LYS HB3  H  -4.857 -0.969  -7.379 1.00 . A A .   9 LYS HB3  1 1 
       18 4751 1 1  8 LYS HD2  H  -8.266 -0.889  -8.821 1.00 . A A .   9 LYS HD2  1 1 
       18 4752 1 1  8 LYS HD3  H  -7.001  0.315  -9.075 1.00 . A A .   9 LYS HD3  1 1 
       18 4753 1 1  8 LYS HE2  H  -5.338 -1.425  -9.291 1.00 . A A .   9 LYS HE2  1 1 
       18 4754 1 1  8 LYS HE3  H  -6.536 -2.660  -8.903 1.00 . A A .   9 LYS HE3  1 1 
       18 4755 1 1  8 LYS HG2  H  -7.145 -1.617  -6.764 1.00 . A A .   9 LYS HG2  1 1 
       18 4756 1 1  8 LYS HG3  H  -7.592  0.088  -6.703 1.00 . A A .   9 LYS HG3  1 1 
       18 4757 1 1  8 LYS HZ1  H  -6.651 -0.878 -11.280 1.00 . A A .   9 LYS HZ1  1 1 
       18 4758 1 1  8 LYS HZ2  H  -7.707 -2.155 -10.923 1.00 . A A .   9 LYS HZ2  1 1 
       18 4759 1 1  8 LYS HZ3  H  -6.087 -2.477 -11.297 1.00 . A A .   9 LYS HZ3  1 1 
       18 4760 1 1  8 LYS N    N  -5.510 -1.576  -4.791 1.00 . A A .   9 LYS N    1 1 
       18 4761 1 1  8 LYS NZ   N  -6.730 -1.811 -10.818 1.00 . A A .   9 LYS NZ   1 1 
       18 4762 1 1  8 LYS O    O  -5.718  2.017  -4.980 1.00 . A A .   9 LYS O    1 1 
       18 4763 1 1  9 THR C    C  -6.487  2.089  -1.792 1.00 . A A .  10 THR C    1 1 
       18 4764 1 1  9 THR CA   C  -7.402  1.454  -2.848 1.00 . A A .  10 THR CA   1 1 
       18 4765 1 1  9 THR CB   C  -8.606  0.782  -2.155 1.00 . A A .  10 THR CB   1 1 
       18 4766 1 1  9 THR CG2  C  -9.556  1.818  -1.567 1.00 . A A .  10 THR CG2  1 1 
       18 4767 1 1  9 THR H    H  -6.806 -0.478  -3.472 1.00 . A A .  10 THR H    1 1 
       18 4768 1 1  9 THR HA   H  -7.772  2.224  -3.506 1.00 . A A .  10 THR HA   1 1 
       18 4769 1 1  9 THR HB   H  -8.240  0.153  -1.354 1.00 . A A .  10 THR HB   1 1 
       18 4770 1 1  9 THR HG1  H  -9.547  0.521  -3.872 1.00 . A A .  10 THR HG1  1 1 
       18 4771 1 1  9 THR HG21 H  -9.929  2.455  -2.355 1.00 . A A .  10 THR HG21 1 1 
       18 4772 1 1  9 THR HG22 H  -9.031  2.417  -0.838 1.00 . A A .  10 THR HG22 1 1 
       18 4773 1 1  9 THR HG23 H -10.384  1.316  -1.089 1.00 . A A .  10 THR HG23 1 1 
       18 4774 1 1  9 THR N    N  -6.675  0.478  -3.648 1.00 . A A .  10 THR N    1 1 
       18 4775 1 1  9 THR O    O  -6.738  3.197  -1.317 1.00 . A A .  10 THR O    1 1 
       18 4776 1 1  9 THR OG1  O  -9.310 -0.026  -3.106 1.00 . A A .  10 THR OG1  1 1 
       18 4777 1 1 10 PHE C    C  -3.045  1.952  -1.102 1.00 . A A .  11 PHE C    1 1 
       18 4778 1 1 10 PHE CA   C  -4.461  1.910  -0.476 1.00 . A A .  11 PHE CA   1 1 
       18 4779 1 1 10 PHE CB   C  -4.440  1.000   0.754 1.00 . A A .  11 PHE CB   1 1 
       18 4780 1 1 10 PHE CD1  C  -4.342  2.294   2.904 1.00 . A A .  11 PHE CD1  1 1 
       18 4781 1 1 10 PHE CD2  C  -2.308  1.406   2.025 1.00 . A A .  11 PHE CD2  1 1 
       18 4782 1 1 10 PHE CE1  C  -3.650  2.826   3.975 1.00 . A A .  11 PHE CE1  1 1 
       18 4783 1 1 10 PHE CE2  C  -1.611  1.935   3.095 1.00 . A A .  11 PHE CE2  1 1 
       18 4784 1 1 10 PHE CG   C  -3.679  1.578   1.917 1.00 . A A .  11 PHE CG   1 1 
       18 4785 1 1 10 PHE CZ   C  -2.284  2.646   4.071 1.00 . A A .  11 PHE CZ   1 1 
       18 4786 1 1 10 PHE H    H  -5.229  0.537  -1.878 1.00 . A A .  11 PHE H    1 1 
       18 4787 1 1 10 PHE HA   H  -4.800  2.885  -0.167 1.00 . A A .  11 PHE HA   1 1 
       18 4788 1 1 10 PHE HB2  H  -5.455  0.821   1.076 1.00 . A A .  11 PHE HB2  1 1 
       18 4789 1 1 10 PHE HB3  H  -3.981  0.059   0.489 1.00 . A A .  11 PHE HB3  1 1 
       18 4790 1 1 10 PHE HD1  H  -5.410  2.434   2.831 1.00 . A A .  11 PHE HD1  1 1 
       18 4791 1 1 10 PHE HD2  H  -1.781  0.849   1.262 1.00 . A A .  11 PHE HD2  1 1 
       18 4792 1 1 10 PHE HE1  H  -4.177  3.383   4.736 1.00 . A A .  11 PHE HE1  1 1 
       18 4793 1 1 10 PHE HE2  H  -0.543  1.793   3.168 1.00 . A A .  11 PHE HE2  1 1 
       18 4794 1 1 10 PHE HZ   H  -1.742  3.061   4.908 1.00 . A A .  11 PHE HZ   1 1 
       18 4795 1 1 10 PHE N    N  -5.407  1.398  -1.450 1.00 . A A .  11 PHE N    1 1 
       18 4796 1 1 10 PHE O    O  -2.482  0.889  -1.359 1.00 . A A .  11 PHE O    1 1 
       18 4797 1 1 11 THR C    C  -0.243  4.079  -0.988 1.00 . A A .  12 THR C    1 1 
       18 4798 1 1 11 THR CA   C  -1.094  3.175  -1.877 1.00 . A A .  12 THR CA   1 1 
       18 4799 1 1 11 THR CB   C  -1.042  3.683  -3.330 1.00 . A A .  12 THR CB   1 1 
       18 4800 1 1 11 THR CG2  C   0.361  3.547  -3.906 1.00 . A A .  12 THR CG2  1 1 
       18 4801 1 1 11 THR H    H  -2.948  3.981  -1.325 1.00 . A A .  12 THR H    1 1 
       18 4802 1 1 11 THR HA   H  -0.692  2.172  -1.849 1.00 . A A .  12 THR HA   1 1 
       18 4803 1 1 11 THR HB   H  -1.323  4.726  -3.344 1.00 . A A .  12 THR HB   1 1 
       18 4804 1 1 11 THR HG1  H  -2.768  2.772  -3.622 1.00 . A A .  12 THR HG1  1 1 
       18 4805 1 1 11 THR HG21 H   0.653  2.507  -3.891 1.00 . A A .  12 THR HG21 1 1 
       18 4806 1 1 11 THR HG22 H   1.054  4.126  -3.311 1.00 . A A .  12 THR HG22 1 1 
       18 4807 1 1 11 THR HG23 H   0.369  3.909  -4.923 1.00 . A A .  12 THR HG23 1 1 
       18 4808 1 1 11 THR N    N  -2.460  3.133  -1.393 1.00 . A A .  12 THR N    1 1 
       18 4809 1 1 11 THR O    O  -0.444  5.293  -0.948 1.00 . A A .  12 THR O    1 1 
       18 4810 1 1 11 THR OG1  O  -1.968  2.938  -4.134 1.00 . A A .  12 THR OG1  1 1 
       18 4811 1 1 12 SER C    C   3.038  3.784   0.339 1.00 . A A .  13 SER C    1 1 
       18 4812 1 1 12 SER CA   C   1.595  4.234   0.588 1.00 . A A .  13 SER CA   1 1 
       18 4813 1 1 12 SER CB   C   1.228  4.067   2.065 1.00 . A A .  13 SER CB   1 1 
       18 4814 1 1 12 SER H    H   0.742  2.501  -0.262 1.00 . A A .  13 SER H    1 1 
       18 4815 1 1 12 SER HA   H   1.492  5.275   0.323 1.00 . A A .  13 SER HA   1 1 
       18 4816 1 1 12 SER HB2  H   1.250  3.018   2.323 1.00 . A A .  13 SER HB2  1 1 
       18 4817 1 1 12 SER HB3  H   1.938  4.604   2.677 1.00 . A A .  13 SER HB3  1 1 
       18 4818 1 1 12 SER HG   H  -0.398  5.023   1.533 1.00 . A A .  13 SER HG   1 1 
       18 4819 1 1 12 SER N    N   0.677  3.478  -0.247 1.00 . A A .  13 SER N    1 1 
       18 4820 1 1 12 SER O    O   3.400  2.647   0.644 1.00 . A A .  13 SER O    1 1 
       18 4821 1 1 12 SER OG   O  -0.073  4.572   2.322 1.00 . A A .  13 SER OG   1 1 
       18 4822 1 1 13 CYS C    C   6.101  5.511   0.022 1.00 . A A .  14 CYS C    1 1 
       18 4823 1 1 13 CYS CA   C   5.244  4.369  -0.500 1.00 . A A .  14 CYS CA   1 1 
       18 4824 1 1 13 CYS CB   C   5.482  4.165  -1.997 1.00 . A A .  14 CYS CB   1 1 
       18 4825 1 1 13 CYS H    H   3.493  5.537  -0.525 1.00 . A A .  14 CYS H    1 1 
       18 4826 1 1 13 CYS HA   H   5.499  3.463   0.031 1.00 . A A .  14 CYS HA   1 1 
       18 4827 1 1 13 CYS HB2  H   5.153  5.045  -2.529 1.00 . A A .  14 CYS HB2  1 1 
       18 4828 1 1 13 CYS HB3  H   6.538  4.019  -2.170 1.00 . A A .  14 CYS HB3  1 1 
       18 4829 1 1 13 CYS N    N   3.845  4.661  -0.250 1.00 . A A .  14 CYS N    1 1 
       18 4830 1 1 13 CYS O    O   5.843  6.678  -0.280 1.00 . A A .  14 CYS O    1 1 
       18 4831 1 1 13 CYS SG   S   4.600  2.732  -2.701 1.00 . A A .  14 CYS SG   1 1 
       18 4832 1 1 14 LYS C    C   8.935  6.772   0.384 1.00 . A A .  15 LYS C    1 1 
       18 4833 1 1 14 LYS CA   C   7.976  6.176   1.417 1.00 . A A .  15 LYS CA   1 1 
       18 4834 1 1 14 LYS CB   C   8.737  5.572   2.608 1.00 . A A .  15 LYS CB   1 1 
       18 4835 1 1 14 LYS CD   C  10.185  3.714   3.494 1.00 . A A .  15 LYS CD   1 1 
       18 4836 1 1 14 LYS CE   C  11.291  2.735   3.129 1.00 . A A .  15 LYS CE   1 1 
       18 4837 1 1 14 LYS CG   C   9.584  4.357   2.258 1.00 . A A .  15 LYS CG   1 1 
       18 4838 1 1 14 LYS H    H   7.289  4.226   0.977 1.00 . A A .  15 LYS H    1 1 
       18 4839 1 1 14 LYS HA   H   7.338  6.967   1.781 1.00 . A A .  15 LYS HA   1 1 
       18 4840 1 1 14 LYS HB2  H   9.390  6.329   3.018 1.00 . A A .  15 LYS HB2  1 1 
       18 4841 1 1 14 LYS HB3  H   8.023  5.280   3.364 1.00 . A A .  15 LYS HB3  1 1 
       18 4842 1 1 14 LYS HD2  H  10.596  4.487   4.127 1.00 . A A .  15 LYS HD2  1 1 
       18 4843 1 1 14 LYS HD3  H   9.407  3.186   4.028 1.00 . A A .  15 LYS HD3  1 1 
       18 4844 1 1 14 LYS HE2  H  11.510  2.118   3.990 1.00 . A A .  15 LYS HE2  1 1 
       18 4845 1 1 14 LYS HE3  H  10.948  2.110   2.317 1.00 . A A .  15 LYS HE3  1 1 
       18 4846 1 1 14 LYS HG2  H   8.965  3.633   1.751 1.00 . A A .  15 LYS HG2  1 1 
       18 4847 1 1 14 LYS HG3  H  10.384  4.670   1.602 1.00 . A A .  15 LYS HG3  1 1 
       18 4848 1 1 14 LYS HZ1  H  13.008  3.856   3.542 1.00 . A A .  15 LYS HZ1  1 1 
       18 4849 1 1 14 LYS HZ2  H  12.308  4.205   2.038 1.00 . A A .  15 LYS HZ2  1 1 
       18 4850 1 1 14 LYS HZ3  H  13.190  2.772   2.247 1.00 . A A .  15 LYS HZ3  1 1 
       18 4851 1 1 14 LYS N    N   7.113  5.174   0.808 1.00 . A A .  15 LYS N    1 1 
       18 4852 1 1 14 LYS NZ   N  12.535  3.439   2.709 1.00 . A A .  15 LYS NZ   1 1 
       18 4853 1 1 14 LYS O    O   9.818  6.043  -0.120 1.00 . A A .  15 LYS O    1 1 
       18 4854 1 1 14 LYS OXT  O   8.798  7.971   0.072 1.00 . A A .  15 LYS OXT  1 1 
       18 4855 2 2  1 .   C1   C   8.944 -3.077   0.619 1.00 . B A . 101 OCA C1   1 1 
       18 4856 2 2  1 .   C2   C   8.584 -2.904   2.089 1.00 . B A . 101 OCA C2   1 1 
       18 4857 2 2  1 .   C3   C   7.084 -2.936   2.344 1.00 . B A . 101 OCA C3   1 1 
       18 4858 2 2  1 .   C4   C   6.729 -3.876   3.483 1.00 . B A . 101 OCA C4   1 1 
       18 4859 2 2  1 .   C5   C   6.732 -3.157   4.822 1.00 . B A . 101 OCA C5   1 1 
       18 4860 2 2  1 .   C6   C   5.374 -3.244   5.505 1.00 . B A . 101 OCA C6   1 1 
       18 4861 2 2  1 .   C7   C   5.510 -3.384   7.017 1.00 . B A . 101 OCA C7   1 1 
       18 4862 2 2  1 .   C8   C   6.169 -2.173   7.642 1.00 . B A . 101 OCA C8   1 1 
       18 4863 2 2  1 .   H21  H   8.972 -1.953   2.427 1.00 . B A . 101 OCA H21  1 1 
       18 4864 2 2  1 .   H22  H   9.048 -3.701   2.652 1.00 . B A . 101 OCA H22  1 1 
       18 4865 2 2  1 .   H31  H   6.751 -1.940   2.598 1.00 . B A . 101 OCA H31  1 1 
       18 4866 2 2  1 .   H32  H   6.582 -3.267   1.447 1.00 . B A . 101 OCA H32  1 1 
       18 4867 2 2  1 .   H41  H   5.744 -4.284   3.307 1.00 . B A . 101 OCA H41  1 1 
       18 4868 2 2  1 .   H42  H   7.452 -4.680   3.516 1.00 . B A . 101 OCA H42  1 1 
       18 4869 2 2  1 .   H51  H   7.476 -3.609   5.461 1.00 . B A . 101 OCA H51  1 1 
       18 4870 2 2  1 .   H52  H   6.977 -2.118   4.658 1.00 . B A . 101 OCA H52  1 1 
       18 4871 2 2  1 .   H61  H   4.813 -2.347   5.288 1.00 . B A . 101 OCA H61  1 1 
       18 4872 2 2  1 .   H62  H   4.845 -4.104   5.123 1.00 . B A . 101 OCA H62  1 1 
       18 4873 2 2  1 .   H71  H   6.114 -4.251   7.237 1.00 . B A . 101 OCA H71  1 1 
       18 4874 2 2  1 .   H72  H   4.529 -3.503   7.452 1.00 . B A . 101 OCA H72  1 1 
       18 4875 2 2  1 .   H81  H   6.488 -2.417   8.644 1.00 . B A . 101 OCA H81  1 1 
       18 4876 2 2  1 .   H82  H   5.463 -1.355   7.678 1.00 . B A . 101 OCA H82  1 1 
       18 4877 2 2  1 .   H83  H   7.026 -1.884   7.051 1.00 . B A . 101 OCA H83  1 1 
       18 4878 2 2  1 .   O1   O   9.088 -4.172   0.073 1.00 . B A . 101 OCA O1   1 1 
       19 4879 1 1  1 PRO C    C   7.107  0.134   0.431 1.00 . A A .   2 PRO C    1 1 
       19 4880 1 1  1 PRO CA   C   8.527 -0.276   0.822 1.00 . A A .   2 PRO CA   1 1 
       19 4881 1 1  1 PRO CB   C   9.555  0.470  -0.046 1.00 . A A .   2 PRO CB   1 1 
       19 4882 1 1  1 PRO CD   C   9.575 -1.845  -0.681 1.00 . A A .   2 PRO CD   1 1 
       19 4883 1 1  1 PRO CG   C  10.394 -0.589  -0.693 1.00 . A A .   2 PRO CG   1 1 
       19 4884 1 1  1 PRO HA   H   8.692 -0.041   1.863 1.00 . A A .   2 PRO HA   1 1 
       19 4885 1 1  1 PRO HB2  H   9.038  1.062  -0.785 1.00 . A A .   2 PRO HB2  1 1 
       19 4886 1 1  1 PRO HB3  H  10.153  1.114   0.580 1.00 . A A .   2 PRO HB3  1 1 
       19 4887 1 1  1 PRO HD2  H   8.932 -1.888  -1.550 1.00 . A A .   2 PRO HD2  1 1 
       19 4888 1 1  1 PRO HD3  H  10.212 -2.715  -0.633 1.00 . A A .   2 PRO HD3  1 1 
       19 4889 1 1  1 PRO HG2  H  10.624 -0.303  -1.709 1.00 . A A .   2 PRO HG2  1 1 
       19 4890 1 1  1 PRO HG3  H  11.304 -0.730  -0.129 1.00 . A A .   2 PRO HG3  1 1 
       19 4891 1 1  1 PRO N    N   8.796 -1.695   0.546 1.00 . A A .   2 PRO N    1 1 
       19 4892 1 1  1 PRO O    O   6.655  1.232   0.749 1.00 . A A .   2 PRO O    1 1 
       19 4893 1 1  2 CYS C    C   4.174 -1.632  -0.004 1.00 . A A .   3 CYS C    1 1 
       19 4894 1 1  2 CYS CA   C   5.032 -0.550  -0.642 1.00 . A A .   3 CYS CA   1 1 
       19 4895 1 1  2 CYS CB   C   4.865 -0.581  -2.163 1.00 . A A .   3 CYS CB   1 1 
       19 4896 1 1  2 CYS H    H   6.876 -1.575  -0.569 1.00 . A A .   3 CYS H    1 1 
       19 4897 1 1  2 CYS HA   H   4.724  0.415  -0.269 1.00 . A A .   3 CYS HA   1 1 
       19 4898 1 1  2 CYS HB2  H   5.302 -1.492  -2.546 1.00 . A A .   3 CYS HB2  1 1 
       19 4899 1 1  2 CYS HB3  H   3.813 -0.564  -2.402 1.00 . A A .   3 CYS HB3  1 1 
       19 4900 1 1  2 CYS N    N   6.426 -0.753  -0.277 1.00 . A A .   3 CYS N    1 1 
       19 4901 1 1  2 CYS O    O   4.424 -2.821  -0.197 1.00 . A A .   3 CYS O    1 1 
       19 4902 1 1  2 CYS SG   S   5.655  0.815  -3.022 1.00 . A A .   3 CYS SG   1 1 
       19 4903 1 1  3 LYS C    C   0.847 -1.866   1.064 1.00 . A A .   4 LYS C    1 1 
       19 4904 1 1  3 LYS CA   C   2.294 -2.180   1.416 1.00 . A A .   4 LYS CA   1 1 
       19 4905 1 1  3 LYS CB   C   2.485 -2.127   2.935 1.00 . A A .   4 LYS CB   1 1 
       19 4906 1 1  3 LYS CD   C   2.813 -4.600   3.260 1.00 . A A .   4 LYS CD   1 1 
       19 4907 1 1  3 LYS CE   C   2.458 -5.819   4.102 1.00 . A A .   4 LYS CE   1 1 
       19 4908 1 1  3 LYS CG   C   2.009 -3.373   3.669 1.00 . A A .   4 LYS CG   1 1 
       19 4909 1 1  3 LYS H    H   3.028 -0.266   0.897 1.00 . A A .   4 LYS H    1 1 
       19 4910 1 1  3 LYS HA   H   2.539 -3.167   1.058 1.00 . A A .   4 LYS HA   1 1 
       19 4911 1 1  3 LYS HB2  H   3.531 -1.991   3.148 1.00 . A A .   4 LYS HB2  1 1 
       19 4912 1 1  3 LYS HB3  H   1.939 -1.279   3.322 1.00 . A A .   4 LYS HB3  1 1 
       19 4913 1 1  3 LYS HD2  H   2.607 -4.823   2.225 1.00 . A A .   4 LYS HD2  1 1 
       19 4914 1 1  3 LYS HD3  H   3.865 -4.385   3.382 1.00 . A A .   4 LYS HD3  1 1 
       19 4915 1 1  3 LYS HE2  H   3.029 -6.664   3.749 1.00 . A A .   4 LYS HE2  1 1 
       19 4916 1 1  3 LYS HE3  H   2.718 -5.617   5.132 1.00 . A A .   4 LYS HE3  1 1 
       19 4917 1 1  3 LYS HG2  H   2.121 -3.218   4.731 1.00 . A A .   4 LYS HG2  1 1 
       19 4918 1 1  3 LYS HG3  H   0.968 -3.542   3.435 1.00 . A A .   4 LYS HG3  1 1 
       19 4919 1 1  3 LYS HZ1  H   0.822 -7.055   4.512 1.00 . A A .   4 LYS HZ1  1 1 
       19 4920 1 1  3 LYS HZ2  H   0.714 -6.235   3.030 1.00 . A A .   4 LYS HZ2  1 1 
       19 4921 1 1  3 LYS HZ3  H   0.451 -5.406   4.480 1.00 . A A .   4 LYS HZ3  1 1 
       19 4922 1 1  3 LYS N    N   3.177 -1.226   0.767 1.00 . A A .   4 LYS N    1 1 
       19 4923 1 1  3 LYS NZ   N   1.011 -6.149   4.027 1.00 . A A .   4 LYS NZ   1 1 
       19 4924 1 1  3 LYS O    O   0.308 -0.841   1.485 1.00 . A A .   4 LYS O    1 1 
       19 4925 1 1  4 ASN C    C  -1.998 -3.683   0.495 1.00 . A A .   5 ASN C    1 1 
       19 4926 1 1  4 ASN CA   C  -1.166 -2.546  -0.099 1.00 . A A .   5 ASN CA   1 1 
       19 4927 1 1  4 ASN CB   C  -1.328 -2.550  -1.626 1.00 . A A .   5 ASN CB   1 1 
       19 4928 1 1  4 ASN CG   C  -0.455 -1.525  -2.329 1.00 . A A .   5 ASN CG   1 1 
       19 4929 1 1  4 ASN H    H   0.726 -3.502  -0.092 1.00 . A A .   5 ASN H    1 1 
       19 4930 1 1  4 ASN HA   H  -1.499 -1.595   0.291 1.00 . A A .   5 ASN HA   1 1 
       19 4931 1 1  4 ASN HB2  H  -1.069 -3.529  -2.003 1.00 . A A .   5 ASN HB2  1 1 
       19 4932 1 1  4 ASN HB3  H  -2.360 -2.342  -1.869 1.00 . A A .   5 ASN HB3  1 1 
       19 4933 1 1  4 ASN HD21 H   1.009 -2.857  -2.504 1.00 . A A .   5 ASN HD21 1 1 
       19 4934 1 1  4 ASN HD22 H   1.327 -1.292  -3.167 1.00 . A A .   5 ASN HD22 1 1 
       19 4935 1 1  4 ASN N    N   0.230 -2.727   0.265 1.00 . A A .   5 ASN N    1 1 
       19 4936 1 1  4 ASN ND2  N   0.749 -1.931  -2.703 1.00 . A A .   5 ASN ND2  1 1 
       19 4937 1 1  4 ASN O    O  -1.877 -4.828   0.058 1.00 . A A .   5 ASN O    1 1 
       19 4938 1 1  4 ASN OD1  O  -0.858 -0.383  -2.539 1.00 . A A .   5 ASN OD1  1 1 
       19 4939 1 1  5 .   C    C  -4.778 -4.883   1.204 1.00 . A A .   6 O6H C    1 1 
       19 4940 1 1  5 .   CA   C  -3.656 -4.414   2.123 1.00 . A A .   6 O6H CA   1 1 
       19 4941 1 1  5 .   CB   C  -4.230 -3.937   3.460 1.00 . A A .   6 O6H CB   1 1 
       19 4942 1 1  5 .   CD1  C  -2.434 -4.620   5.111 1.00 . A A .   6 O6H CD1  1 1 
       19 4943 1 1  5 .   CD2  C  -2.913 -2.302   4.850 1.00 . A A .   6 O6H CD2  1 1 
       19 4944 1 1  5 .   CE1  C  -1.463 -4.319   6.048 1.00 . A A .   6 O6H CE1  1 1 
       19 4945 1 1  5 .   CE2  C  -1.951 -1.988   5.786 1.00 . A A .   6 O6H CE2  1 1 
       19 4946 1 1  5 .   CF1  C  -2.686 -6.058   4.763 1.00 . A A .   6 O6H CF1  1 1 
       19 4947 1 1  5 .   CF2  C  -3.699 -1.197   4.220 1.00 . A A .   6 O6H CF2  1 1 
       19 4948 1 1  5 .   CG   C  -3.176 -3.616   4.493 1.00 . A A .   6 O6H CG   1 1 
       19 4949 1 1  5 .   CH   C  -0.176 -2.656   7.391 1.00 . A A .   6 O6H CH   1 1 
       19 4950 1 1  5 .   CZ   C  -1.228 -2.999   6.379 1.00 . A A .   6 O6H CZ   1 1 
       19 4951 1 1  5 .   H1   H  -2.863 -2.474   1.845 1.00 . A A .   6 O6H H1   1 1 
       19 4952 1 1  5 .   HA   H  -3.013 -5.262   2.317 1.00 . A A .   6 O6H HA   1 1 
       19 4953 1 1  5 .   HB1  H  -4.866 -4.709   3.861 1.00 . A A .   6 O6H HB1  1 1 
       19 4954 1 1  5 .   HB2  H  -4.814 -3.044   3.293 1.00 . A A .   6 O6H HB2  1 1 
       19 4955 1 1  5 .   HE1  H  -0.894 -5.108   6.516 1.00 . A A .   6 O6H HE1  1 1 
       19 4956 1 1  5 .   HE2  H  -1.765 -0.959   6.049 1.00 . A A .   6 O6H HE2  1 1 
       19 4957 1 1  5 .   HF11 H  -3.204 -6.604   5.540 1.00 . A A .   6 O6H HF11 1 1 
       19 4958 1 1  5 .   HF12 H  -3.289 -6.184   3.877 1.00 . A A .   6 O6H HF12 1 1 
       19 4959 1 1  5 .   HF13 H  -1.782 -6.620   4.576 1.00 . A A .   6 O6H HF13 1 1 
       19 4960 1 1  5 .   HF21 H  -4.664 -1.047   4.678 1.00 . A A .   6 O6H HF21 1 1 
       19 4961 1 1  5 .   HF22 H  -3.903 -1.360   3.172 1.00 . A A .   6 O6H HF22 1 1 
       19 4962 1 1  5 .   HF23 H  -3.207 -0.238   4.271 1.00 . A A .   6 O6H HF23 1 1 
       19 4963 1 1  5 .   HH1  H  -0.171 -1.610   7.661 1.00 . A A .   6 O6H HH1  1 1 
       19 4964 1 1  5 .   HH2  H   0.826 -2.867   7.050 1.00 . A A .   6 O6H HH2  1 1 
       19 4965 1 1  5 .   HH3  H  -0.281 -3.194   8.322 1.00 . A A .   6 O6H HH3  1 1 
       19 4966 1 1  5 .   N    N  -2.822 -3.390   1.501 1.00 . A A .   6 O6H N    1 1 
       19 4967 1 1  5 .   O    O  -5.110 -6.065   1.173 1.00 . A A .   6 O6H O    1 1 
       19 4968 1 1  6 PHE C    C  -6.287 -4.231  -1.789 1.00 . A A .   7 PHE C    1 1 
       19 4969 1 1  6 PHE CA   C  -6.579 -4.252  -0.296 1.00 . A A .   7 PHE CA   1 1 
       19 4970 1 1  6 PHE CB   C  -7.694 -3.243   0.007 1.00 . A A .   7 PHE CB   1 1 
       19 4971 1 1  6 PHE CD1  C  -7.350 -1.487   1.759 1.00 . A A .   7 PHE CD1  1 1 
       19 4972 1 1  6 PHE CD2  C  -8.144 -3.627   2.451 1.00 . A A .   7 PHE CD2  1 1 
       19 4973 1 1  6 PHE CE1  C  -7.376 -1.049   3.068 1.00 . A A .   7 PHE CE1  1 1 
       19 4974 1 1  6 PHE CE2  C  -8.172 -3.195   3.762 1.00 . A A .   7 PHE CE2  1 1 
       19 4975 1 1  6 PHE CG   C  -7.733 -2.779   1.436 1.00 . A A .   7 PHE CG   1 1 
       19 4976 1 1  6 PHE CZ   C  -7.788 -1.906   4.072 1.00 . A A .   7 PHE CZ   1 1 
       19 4977 1 1  6 PHE H    H  -5.018 -3.039   0.469 1.00 . A A .   7 PHE H    1 1 
       19 4978 1 1  6 PHE HA   H  -6.913 -5.239  -0.019 1.00 . A A .   7 PHE HA   1 1 
       19 4979 1 1  6 PHE HB2  H  -7.561 -2.372  -0.617 1.00 . A A .   7 PHE HB2  1 1 
       19 4980 1 1  6 PHE HB3  H  -8.647 -3.697  -0.219 1.00 . A A .   7 PHE HB3  1 1 
       19 4981 1 1  6 PHE HD1  H  -7.027 -0.817   0.975 1.00 . A A .   7 PHE HD1  1 1 
       19 4982 1 1  6 PHE HD2  H  -8.445 -4.637   2.210 1.00 . A A .   7 PHE HD2  1 1 
       19 4983 1 1  6 PHE HE1  H  -7.075 -0.040   3.307 1.00 . A A .   7 PHE HE1  1 1 
       19 4984 1 1  6 PHE HE2  H  -8.494 -3.864   4.544 1.00 . A A .   7 PHE HE2  1 1 
       19 4985 1 1  6 PHE HZ   H  -7.811 -1.569   5.098 1.00 . A A .   7 PHE HZ   1 1 
       19 4986 1 1  6 PHE N    N  -5.381 -3.947   0.477 1.00 . A A .   7 PHE N    1 1 
       19 4987 1 1  6 PHE O    O  -7.046 -4.782  -2.587 1.00 . A A .   7 PHE O    1 1 
       19 4988 1 1  7 DTR C    C  -4.575 -1.935  -3.879 1.00 . A A .   8 DTR C    1 1 
       19 4989 1 1  7 DTR CA   C  -4.886 -3.402  -3.571 1.00 . A A .   8 DTR CA   1 1 
       19 4990 1 1  7 DTR CB   C  -3.711 -4.295  -3.989 1.00 . A A .   8 DTR CB   1 1 
       19 4991 1 1  7 DTR CD1  C  -2.358 -3.561  -6.040 1.00 . A A .   8 DTR CD1  1 1 
       19 4992 1 1  7 DTR CD2  C  -4.186 -4.761  -6.521 1.00 . A A .   8 DTR CD2  1 1 
       19 4993 1 1  7 DTR CE2  C  -3.545 -4.419  -7.725 1.00 . A A .   8 DTR CE2  1 1 
       19 4994 1 1  7 DTR CE3  C  -5.359 -5.517  -6.573 1.00 . A A .   8 DTR CE3  1 1 
       19 4995 1 1  7 DTR CG   C  -3.410 -4.204  -5.453 1.00 . A A .   8 DTR CG   1 1 
       19 4996 1 1  7 DTR CH2  C  -5.187 -5.545  -8.990 1.00 . A A .   8 DTR CH2  1 1 
       19 4997 1 1  7 DTR CZ2  C  -4.039 -4.806  -8.967 1.00 . A A .   8 DTR CZ2  1 1 
       19 4998 1 1  7 DTR CZ3  C  -5.847 -5.900  -7.808 1.00 . A A .   8 DTR CZ3  1 1 
       19 4999 1 1  7 DTR H    H  -4.601 -3.204  -1.491 1.00 . A A .   8 DTR H    1 1 
       19 5000 1 1  7 DTR HA   H  -5.735 -3.737  -4.149 1.00 . A A .   8 DTR HA   1 1 
       19 5001 1 1  7 DTR HB2  H  -2.826 -3.998  -3.443 1.00 . A A .   8 DTR HB2  1 1 
       19 5002 1 1  7 DTR HB3  H  -3.947 -5.321  -3.757 1.00 . A A .   8 DTR HB3  1 1 
       19 5003 1 1  7 DTR HD1  H  -1.587 -3.034  -5.496 1.00 . A A .   8 DTR HD1  1 1 
       19 5004 1 1  7 DTR HE1  H  -1.792 -3.309  -8.052 1.00 . A A .   8 DTR HE1  1 1 
       19 5005 1 1  7 DTR HE3  H  -5.883 -5.800  -5.672 1.00 . A A .   8 DTR HE3  1 1 
       19 5006 1 1  7 DTR HH2  H  -5.606 -5.866  -9.933 1.00 . A A .   8 DTR HH2  1 1 
       19 5007 1 1  7 DTR HZ2  H  -3.541 -4.540  -9.887 1.00 . A A .   8 DTR HZ2  1 1 
       19 5008 1 1  7 DTR HZ3  H  -6.753 -6.484  -7.868 1.00 . A A .   8 DTR HZ3  1 1 
       19 5009 1 1  7 DTR N    N  -5.203 -3.578  -2.169 1.00 . A A .   8 DTR N    1 1 
       19 5010 1 1  7 DTR NE1  N  -2.434 -3.685  -7.406 1.00 . A A .   8 DTR NE1  1 1 
       19 5011 1 1  7 DTR O    O  -3.765 -1.327  -3.189 1.00 . A A .   8 DTR O    1 1 
       19 5012 1 1  8 LYS C    C  -5.719  1.035  -4.577 1.00 . A A .   9 LYS C    1 1 
       19 5013 1 1  8 LYS CA   C  -4.901 -0.008  -5.328 1.00 . A A .   9 LYS CA   1 1 
       19 5014 1 1  8 LYS CB   C  -5.129  0.122  -6.836 1.00 . A A .   9 LYS CB   1 1 
       19 5015 1 1  8 LYS CD   C  -6.679 -0.192  -8.790 1.00 . A A .   9 LYS CD   1 1 
       19 5016 1 1  8 LYS CE   C  -5.820 -1.279  -9.424 1.00 . A A .   9 LYS CE   1 1 
       19 5017 1 1  8 LYS CG   C  -6.551 -0.201  -7.275 1.00 . A A .   9 LYS CG   1 1 
       19 5018 1 1  8 LYS H    H  -5.944 -1.840  -5.347 1.00 . A A .   9 LYS H    1 1 
       19 5019 1 1  8 LYS HA   H  -3.853  0.158  -5.120 1.00 . A A .   9 LYS HA   1 1 
       19 5020 1 1  8 LYS HB2  H  -4.903  1.134  -7.136 1.00 . A A .   9 LYS HB2  1 1 
       19 5021 1 1  8 LYS HB3  H  -4.456 -0.552  -7.347 1.00 . A A .   9 LYS HB3  1 1 
       19 5022 1 1  8 LYS HD2  H  -7.711 -0.362  -9.056 1.00 . A A .   9 LYS HD2  1 1 
       19 5023 1 1  8 LYS HD3  H  -6.362  0.769  -9.165 1.00 . A A .   9 LYS HD3  1 1 
       19 5024 1 1  8 LYS HE2  H  -4.811 -1.180  -9.057 1.00 . A A .   9 LYS HE2  1 1 
       19 5025 1 1  8 LYS HE3  H  -6.213 -2.243  -9.139 1.00 . A A .   9 LYS HE3  1 1 
       19 5026 1 1  8 LYS HG2  H  -6.818 -1.180  -6.907 1.00 . A A .   9 LYS HG2  1 1 
       19 5027 1 1  8 LYS HG3  H  -7.220  0.539  -6.861 1.00 . A A .   9 LYS HG3  1 1 
       19 5028 1 1  8 LYS HZ1  H  -5.190 -1.925 -11.307 1.00 . A A .   9 LYS HZ1  1 1 
       19 5029 1 1  8 LYS HZ2  H  -5.433 -0.252 -11.204 1.00 . A A .   9 LYS HZ2  1 1 
       19 5030 1 1  8 LYS HZ3  H  -6.766 -1.297 -11.290 1.00 . A A .   9 LYS HZ3  1 1 
       19 5031 1 1  8 LYS N    N  -5.229 -1.358  -4.886 1.00 . A A .   9 LYS N    1 1 
       19 5032 1 1  8 LYS NZ   N  -5.802 -1.184 -10.906 1.00 . A A .   9 LYS NZ   1 1 
       19 5033 1 1  8 LYS O    O  -5.585  2.233  -4.814 1.00 . A A .   9 LYS O    1 1 
       19 5034 1 1  9 THR C    C  -6.628  2.109  -1.742 1.00 . A A .  10 THR C    1 1 
       19 5035 1 1  9 THR CA   C  -7.411  1.475  -2.898 1.00 . A A .  10 THR CA   1 1 
       19 5036 1 1  9 THR CB   C  -8.630  0.714  -2.341 1.00 . A A .  10 THR CB   1 1 
       19 5037 1 1  9 THR CG2  C  -9.676  1.673  -1.791 1.00 . A A .  10 THR CG2  1 1 
       19 5038 1 1  9 THR H    H  -6.644 -0.391  -3.540 1.00 . A A .  10 THR H    1 1 
       19 5039 1 1  9 THR HA   H  -7.762  2.253  -3.556 1.00 . A A .  10 THR HA   1 1 
       19 5040 1 1  9 THR HB   H  -8.299  0.066  -1.543 1.00 . A A .  10 THR HB   1 1 
       19 5041 1 1  9 THR HG1  H  -9.582 -0.894  -2.999 1.00 . A A .  10 THR HG1  1 1 
       19 5042 1 1  9 THR HG21 H  -9.241  2.265  -1.000 1.00 . A A .  10 THR HG21 1 1 
       19 5043 1 1  9 THR HG22 H -10.510  1.107  -1.400 1.00 . A A .  10 THR HG22 1 1 
       19 5044 1 1  9 THR HG23 H -10.021  2.323  -2.582 1.00 . A A .  10 THR HG23 1 1 
       19 5045 1 1  9 THR N    N  -6.565  0.576  -3.671 1.00 . A A .  10 THR N    1 1 
       19 5046 1 1  9 THR O    O  -6.928  3.221  -1.314 1.00 . A A .  10 THR O    1 1 
       19 5047 1 1  9 THR OG1  O  -9.213 -0.081  -3.382 1.00 . A A .  10 THR OG1  1 1 
       19 5048 1 1 10 PHE C    C  -3.280  1.739  -0.621 1.00 . A A .  11 PHE C    1 1 
       19 5049 1 1 10 PHE CA   C  -4.759  1.935  -0.201 1.00 . A A .  11 PHE CA   1 1 
       19 5050 1 1 10 PHE CB   C  -5.009  1.197   1.117 1.00 . A A .  11 PHE CB   1 1 
       19 5051 1 1 10 PHE CD1  C  -2.955  1.599   2.519 1.00 . A A .  11 PHE CD1  1 1 
       19 5052 1 1 10 PHE CD2  C  -5.011  2.592   3.205 1.00 . A A .  11 PHE CD2  1 1 
       19 5053 1 1 10 PHE CE1  C  -2.317  2.153   3.612 1.00 . A A .  11 PHE CE1  1 1 
       19 5054 1 1 10 PHE CE2  C  -4.378  3.150   4.299 1.00 . A A .  11 PHE CE2  1 1 
       19 5055 1 1 10 PHE CG   C  -4.309  1.811   2.302 1.00 . A A .  11 PHE CG   1 1 
       19 5056 1 1 10 PHE CZ   C  -3.030  2.929   4.503 1.00 . A A .  11 PHE CZ   1 1 
       19 5057 1 1 10 PHE H    H  -5.438  0.510  -1.596 1.00 . A A .  11 PHE H    1 1 
       19 5058 1 1 10 PHE HA   H  -5.011  2.974  -0.062 1.00 . A A .  11 PHE HA   1 1 
       19 5059 1 1 10 PHE HB2  H  -6.069  1.195   1.323 1.00 . A A .  11 PHE HB2  1 1 
       19 5060 1 1 10 PHE HB3  H  -4.665  0.178   1.019 1.00 . A A .  11 PHE HB3  1 1 
       19 5061 1 1 10 PHE HD1  H  -2.394  0.994   1.819 1.00 . A A .  11 PHE HD1  1 1 
       19 5062 1 1 10 PHE HD2  H  -6.064  2.765   3.047 1.00 . A A .  11 PHE HD2  1 1 
       19 5063 1 1 10 PHE HE1  H  -1.263  1.979   3.770 1.00 . A A .  11 PHE HE1  1 1 
       19 5064 1 1 10 PHE HE2  H  -4.938  3.756   4.996 1.00 . A A .  11 PHE HE2  1 1 
       19 5065 1 1 10 PHE HZ   H  -2.535  3.362   5.359 1.00 . A A .  11 PHE HZ   1 1 
       19 5066 1 1 10 PHE N    N  -5.620  1.402  -1.244 1.00 . A A .  11 PHE N    1 1 
       19 5067 1 1 10 PHE O    O  -2.833  0.592  -0.657 1.00 . A A .  11 PHE O    1 1 
       19 5068 1 1 11 THR C    C  -0.213  3.532  -0.575 1.00 . A A .  12 THR C    1 1 
       19 5069 1 1 11 THR CA   C  -1.130  2.599  -1.354 1.00 . A A .  12 THR CA   1 1 
       19 5070 1 1 11 THR CB   C  -0.950  2.840  -2.868 1.00 . A A .  12 THR CB   1 1 
       19 5071 1 1 11 THR CG2  C   0.486  2.577  -3.300 1.00 . A A .  12 THR CG2  1 1 
       19 5072 1 1 11 THR H    H  -2.862  3.710  -0.958 1.00 . A A .  12 THR H    1 1 
       19 5073 1 1 11 THR HA   H  -0.859  1.575  -1.137 1.00 . A A .  12 THR HA   1 1 
       19 5074 1 1 11 THR HB   H  -1.192  3.872  -3.084 1.00 . A A .  12 THR HB   1 1 
       19 5075 1 1 11 THR HG1  H  -1.815  1.096  -3.232 1.00 . A A .  12 THR HG1  1 1 
       19 5076 1 1 11 THR HG21 H   1.151  3.233  -2.756 1.00 . A A .  12 THR HG21 1 1 
       19 5077 1 1 11 THR HG22 H   0.583  2.765  -4.358 1.00 . A A .  12 THR HG22 1 1 
       19 5078 1 1 11 THR HG23 H   0.743  1.550  -3.091 1.00 . A A .  12 THR HG23 1 1 
       19 5079 1 1 11 THR N    N  -2.512  2.794  -0.961 1.00 . A A .  12 THR N    1 1 
       19 5080 1 1 11 THR O    O  -0.418  4.746  -0.556 1.00 . A A .  12 THR O    1 1 
       19 5081 1 1 11 THR OG1  O  -1.837  1.989  -3.609 1.00 . A A .  12 THR OG1  1 1 
       19 5082 1 1 12 SER C    C   3.175  3.344   0.378 1.00 . A A .  13 SER C    1 1 
       19 5083 1 1 12 SER CA   C   1.764  3.745   0.808 1.00 . A A .  13 SER CA   1 1 
       19 5084 1 1 12 SER CB   C   1.597  3.554   2.316 1.00 . A A .  13 SER CB   1 1 
       19 5085 1 1 12 SER H    H   0.845  1.983   0.100 1.00 . A A .  13 SER H    1 1 
       19 5086 1 1 12 SER HA   H   1.598  4.784   0.568 1.00 . A A .  13 SER HA   1 1 
       19 5087 1 1 12 SER HB2  H   1.722  2.510   2.561 1.00 . A A .  13 SER HB2  1 1 
       19 5088 1 1 12 SER HB3  H   2.342  4.138   2.834 1.00 . A A .  13 SER HB3  1 1 
       19 5089 1 1 12 SER HG   H  -0.108  3.267   3.245 1.00 . A A .  13 SER HG   1 1 
       19 5090 1 1 12 SER N    N   0.777  2.960   0.090 1.00 . A A .  13 SER N    1 1 
       19 5091 1 1 12 SER O    O   3.619  2.229   0.664 1.00 . A A .  13 SER O    1 1 
       19 5092 1 1 12 SER OG   O   0.309  3.973   2.742 1.00 . A A .  13 SER OG   1 1 
       19 5093 1 1 13 CYS C    C   6.100  5.185  -0.425 1.00 . A A .  14 CYS C    1 1 
       19 5094 1 1 13 CYS CA   C   5.228  3.988  -0.772 1.00 . A A .  14 CYS CA   1 1 
       19 5095 1 1 13 CYS CB   C   5.278  3.736  -2.281 1.00 . A A .  14 CYS CB   1 1 
       19 5096 1 1 13 CYS H    H   3.427  5.074  -0.608 1.00 . A A .  14 CYS H    1 1 
       19 5097 1 1 13 CYS HA   H   5.597  3.117  -0.251 1.00 . A A .  14 CYS HA   1 1 
       19 5098 1 1 13 CYS HB2  H   4.907  4.611  -2.795 1.00 . A A .  14 CYS HB2  1 1 
       19 5099 1 1 13 CYS HB3  H   6.303  3.563  -2.574 1.00 . A A .  14 CYS HB3  1 1 
       19 5100 1 1 13 CYS N    N   3.858  4.230  -0.345 1.00 . A A .  14 CYS N    1 1 
       19 5101 1 1 13 CYS O    O   5.800  6.312  -0.826 1.00 . A A .  14 CYS O    1 1 
       19 5102 1 1 13 CYS SG   S   4.291  2.308  -2.842 1.00 . A A .  14 CYS SG   1 1 
       19 5103 1 1 14 LYS C    C   9.509  5.459   0.750 1.00 . A A .  15 LYS C    1 1 
       19 5104 1 1 14 LYS CA   C   8.094  6.011   0.667 1.00 . A A .  15 LYS CA   1 1 
       19 5105 1 1 14 LYS CB   C   7.696  6.670   1.990 1.00 . A A .  15 LYS CB   1 1 
       19 5106 1 1 14 LYS CD   C   8.307  8.971   1.165 1.00 . A A .  15 LYS CD   1 1 
       19 5107 1 1 14 LYS CE   C   6.862  9.414   1.002 1.00 . A A .  15 LYS CE   1 1 
       19 5108 1 1 14 LYS CG   C   8.462  7.952   2.287 1.00 . A A .  15 LYS CG   1 1 
       19 5109 1 1 14 LYS H    H   7.338  4.041   0.647 1.00 . A A .  15 LYS H    1 1 
       19 5110 1 1 14 LYS HA   H   8.055  6.752  -0.120 1.00 . A A .  15 LYS HA   1 1 
       19 5111 1 1 14 LYS HB2  H   6.641  6.902   1.960 1.00 . A A .  15 LYS HB2  1 1 
       19 5112 1 1 14 LYS HB3  H   7.879  5.973   2.792 1.00 . A A .  15 LYS HB3  1 1 
       19 5113 1 1 14 LYS HD2  H   8.914  9.836   1.392 1.00 . A A .  15 LYS HD2  1 1 
       19 5114 1 1 14 LYS HD3  H   8.644  8.525   0.241 1.00 . A A .  15 LYS HD3  1 1 
       19 5115 1 1 14 LYS HE2  H   6.229  8.538   0.992 1.00 . A A .  15 LYS HE2  1 1 
       19 5116 1 1 14 LYS HE3  H   6.594 10.043   1.838 1.00 . A A .  15 LYS HE3  1 1 
       19 5117 1 1 14 LYS HG2  H   8.083  8.382   3.203 1.00 . A A .  15 LYS HG2  1 1 
       19 5118 1 1 14 LYS HG3  H   9.508  7.715   2.405 1.00 . A A .  15 LYS HG3  1 1 
       19 5119 1 1 14 LYS HZ1  H   6.884  9.572  -1.081 1.00 . A A .  15 LYS HZ1  1 1 
       19 5120 1 1 14 LYS HZ2  H   7.263 11.019  -0.280 1.00 . A A .  15 LYS HZ2  1 1 
       19 5121 1 1 14 LYS HZ3  H   5.660 10.477  -0.336 1.00 . A A .  15 LYS HZ3  1 1 
       19 5122 1 1 14 LYS N    N   7.166  4.950   0.321 1.00 . A A .  15 LYS N    1 1 
       19 5123 1 1 14 LYS NZ   N   6.654 10.173  -0.259 1.00 . A A .  15 LYS NZ   1 1 
       19 5124 1 1 14 LYS O    O  10.197  5.440  -0.293 1.00 . A A .  15 LYS O    1 1 
       19 5125 1 1 14 LYS OXT  O   9.923  5.039   1.846 1.00 . A A .  15 LYS OXT  1 1 
       19 5126 2 2  1 .   C1   C   8.399 -2.718   1.341 1.00 . B A . 101 OCA C1   1 1 
       19 5127 2 2  1 .   C2   C   7.684 -2.201   2.579 1.00 . B A . 101 OCA C2   1 1 
       19 5128 2 2  1 .   C3   C   8.630 -1.916   3.736 1.00 . B A . 101 OCA C3   1 1 
       19 5129 2 2  1 .   C4   C   8.063 -0.858   4.669 1.00 . B A . 101 OCA C4   1 1 
       19 5130 2 2  1 .   C5   C   6.693 -1.254   5.207 1.00 . B A . 101 OCA C5   1 1 
       19 5131 2 2  1 .   C6   C   5.644 -0.172   4.967 1.00 . B A . 101 OCA C6   1 1 
       19 5132 2 2  1 .   C7   C   6.247  1.227   4.950 1.00 . B A . 101 OCA C7   1 1 
       19 5133 2 2  1 .   C8   C   5.197  2.285   4.698 1.00 . B A . 101 OCA C8   1 1 
       19 5134 2 2  1 .   H21  H   7.168 -1.286   2.322 1.00 . B A . 101 OCA H21  1 1 
       19 5135 2 2  1 .   H22  H   6.963 -2.939   2.896 1.00 . B A . 101 OCA H22  1 1 
       19 5136 2 2  1 .   H31  H   8.788 -2.827   4.294 1.00 . B A . 101 OCA H31  1 1 
       19 5137 2 2  1 .   H32  H   9.572 -1.566   3.340 1.00 . B A . 101 OCA H32  1 1 
       19 5138 2 2  1 .   H41  H   8.740 -0.727   5.500 1.00 . B A . 101 OCA H41  1 1 
       19 5139 2 2  1 .   H42  H   7.972  0.071   4.127 1.00 . B A . 101 OCA H42  1 1 
       19 5140 2 2  1 .   H51  H   6.375 -2.162   4.713 1.00 . B A . 101 OCA H51  1 1 
       19 5141 2 2  1 .   H52  H   6.774 -1.433   6.268 1.00 . B A . 101 OCA H52  1 1 
       19 5142 2 2  1 .   H61  H   5.165 -0.356   4.016 1.00 . B A . 101 OCA H61  1 1 
       19 5143 2 2  1 .   H62  H   4.906 -0.223   5.756 1.00 . B A . 101 OCA H62  1 1 
       19 5144 2 2  1 .   H71  H   6.710  1.424   5.906 1.00 . B A . 101 OCA H71  1 1 
       19 5145 2 2  1 .   H72  H   6.987  1.285   4.166 1.00 . B A . 101 OCA H72  1 1 
       19 5146 2 2  1 .   H81  H   5.415  3.158   5.294 1.00 . B A . 101 OCA H81  1 1 
       19 5147 2 2  1 .   H82  H   4.224  1.898   4.966 1.00 . B A . 101 OCA H82  1 1 
       19 5148 2 2  1 .   H83  H   5.202  2.553   3.651 1.00 . B A . 101 OCA H83  1 1 
       19 5149 2 2  1 .   O1   O   8.627 -3.908   1.129 1.00 . B A . 101 OCA O1   1 1 
       20 5150 1 1  1 PRO C    C   7.233  0.427   0.423 1.00 . A A .   2 PRO C    1 1 
       20 5151 1 1  1 PRO CA   C   8.675  0.071   0.778 1.00 . A A .   2 PRO CA   1 1 
       20 5152 1 1  1 PRO CB   C   9.652  0.882  -0.088 1.00 . A A .   2 PRO CB   1 1 
       20 5153 1 1  1 PRO CD   C   9.716 -1.418  -0.806 1.00 . A A .   2 PRO CD   1 1 
       20 5154 1 1  1 PRO CG   C  10.469 -0.119  -0.851 1.00 . A A .   2 PRO CG   1 1 
       20 5155 1 1  1 PRO HA   H   8.849  0.293   1.820 1.00 . A A .   2 PRO HA   1 1 
       20 5156 1 1  1 PRO HB2  H   9.093  1.520  -0.756 1.00 . A A .   2 PRO HB2  1 1 
       20 5157 1 1  1 PRO HB3  H  10.277  1.489   0.552 1.00 . A A .   2 PRO HB3  1 1 
       20 5158 1 1  1 PRO HD2  H   9.024 -1.488  -1.631 1.00 . A A .   2 PRO HD2  1 1 
       20 5159 1 1  1 PRO HD3  H  10.400 -2.254  -0.808 1.00 . A A .   2 PRO HD3  1 1 
       20 5160 1 1  1 PRO HG2  H  10.584  0.208  -1.873 1.00 . A A .   2 PRO HG2  1 1 
       20 5161 1 1  1 PRO HG3  H  11.436 -0.232  -0.383 1.00 . A A .   2 PRO HG3  1 1 
       20 5162 1 1  1 PRO N    N   9.008 -1.324   0.471 1.00 . A A .   2 PRO N    1 1 
       20 5163 1 1  1 PRO O    O   6.733  1.475   0.817 1.00 . A A .   2 PRO O    1 1 
       20 5164 1 1  2 CYS C    C   4.309 -1.331  -0.147 1.00 . A A .   3 CYS C    1 1 
       20 5165 1 1  2 CYS CA   C   5.191 -0.231  -0.719 1.00 . A A .   3 CYS CA   1 1 
       20 5166 1 1  2 CYS CB   C   5.074 -0.210  -2.246 1.00 . A A .   3 CYS CB   1 1 
       20 5167 1 1  2 CYS H    H   7.030 -1.267  -0.610 1.00 . A A .   3 CYS H    1 1 
       20 5168 1 1  2 CYS HA   H   4.873  0.723  -0.323 1.00 . A A .   3 CYS HA   1 1 
       20 5169 1 1  2 CYS HB2  H   5.330 -1.185  -2.633 1.00 . A A .   3 CYS HB2  1 1 
       20 5170 1 1  2 CYS HB3  H   4.055  0.023  -2.517 1.00 . A A .   3 CYS HB3  1 1 
       20 5171 1 1  2 CYS N    N   6.575 -0.448  -0.321 1.00 . A A .   3 CYS N    1 1 
       20 5172 1 1  2 CYS O    O   4.574 -2.515  -0.359 1.00 . A A .   3 CYS O    1 1 
       20 5173 1 1  2 CYS SG   S   6.158  1.009  -3.062 1.00 . A A .   3 CYS SG   1 1 
       20 5174 1 1  3 LYS C    C   0.921 -1.597   0.829 1.00 . A A .   4 LYS C    1 1 
       20 5175 1 1  3 LYS CA   C   2.367 -1.921   1.175 1.00 . A A .   4 LYS CA   1 1 
       20 5176 1 1  3 LYS CB   C   2.550 -1.971   2.698 1.00 . A A .   4 LYS CB   1 1 
       20 5177 1 1  3 LYS CD   C   1.714 -4.363   2.745 1.00 . A A .   4 LYS CD   1 1 
       20 5178 1 1  3 LYS CE   C   3.125 -4.933   2.711 1.00 . A A .   4 LYS CE   1 1 
       20 5179 1 1  3 LYS CG   C   1.657 -2.989   3.402 1.00 . A A .   4 LYS CG   1 1 
       20 5180 1 1  3 LYS H    H   3.104  0.011   0.717 1.00 . A A .   4 LYS H    1 1 
       20 5181 1 1  3 LYS HA   H   2.610 -2.888   0.763 1.00 . A A .   4 LYS HA   1 1 
       20 5182 1 1  3 LYS HB2  H   3.579 -2.217   2.917 1.00 . A A .   4 LYS HB2  1 1 
       20 5183 1 1  3 LYS HB3  H   2.328 -0.993   3.105 1.00 . A A .   4 LYS HB3  1 1 
       20 5184 1 1  3 LYS HD2  H   1.081 -5.040   3.300 1.00 . A A .   4 LYS HD2  1 1 
       20 5185 1 1  3 LYS HD3  H   1.346 -4.279   1.731 1.00 . A A .   4 LYS HD3  1 1 
       20 5186 1 1  3 LYS HE2  H   3.765 -4.250   2.171 1.00 . A A .   4 LYS HE2  1 1 
       20 5187 1 1  3 LYS HE3  H   3.484 -5.037   3.725 1.00 . A A .   4 LYS HE3  1 1 
       20 5188 1 1  3 LYS HG2  H   1.977 -3.081   4.429 1.00 . A A .   4 LYS HG2  1 1 
       20 5189 1 1  3 LYS HG3  H   0.638 -2.631   3.376 1.00 . A A .   4 LYS HG3  1 1 
       20 5190 1 1  3 LYS HZ1  H   2.627 -6.959   2.605 1.00 . A A .   4 LYS HZ1  1 1 
       20 5191 1 1  3 LYS HZ2  H   4.150 -6.592   1.951 1.00 . A A .   4 LYS HZ2  1 1 
       20 5192 1 1  3 LYS HZ3  H   2.741 -6.199   1.096 1.00 . A A .   4 LYS HZ3  1 1 
       20 5193 1 1  3 LYS N    N   3.272 -0.948   0.582 1.00 . A A .   4 LYS N    1 1 
       20 5194 1 1  3 LYS NZ   N   3.163 -6.261   2.044 1.00 . A A .   4 LYS NZ   1 1 
       20 5195 1 1  3 LYS O    O   0.416 -0.521   1.157 1.00 . A A .   4 LYS O    1 1 
       20 5196 1 1  4 ASN C    C  -1.901 -3.540   0.533 1.00 . A A .   5 ASN C    1 1 
       20 5197 1 1  4 ASN CA   C  -1.143 -2.399  -0.146 1.00 . A A .   5 ASN CA   1 1 
       20 5198 1 1  4 ASN CB   C  -1.371 -2.473  -1.662 1.00 . A A .   5 ASN CB   1 1 
       20 5199 1 1  4 ASN CG   C  -0.399 -1.615  -2.453 1.00 . A A .   5 ASN CG   1 1 
       20 5200 1 1  4 ASN H    H   0.750 -3.336  -0.140 1.00 . A A .   5 ASN H    1 1 
       20 5201 1 1  4 ASN HA   H  -1.486 -1.445   0.226 1.00 . A A .   5 ASN HA   1 1 
       20 5202 1 1  4 ASN HB2  H  -1.260 -3.496  -1.985 1.00 . A A .   5 ASN HB2  1 1 
       20 5203 1 1  4 ASN HB3  H  -2.376 -2.139  -1.883 1.00 . A A .   5 ASN HB3  1 1 
       20 5204 1 1  4 ASN HD21 H  -1.644 -0.069  -2.370 1.00 . A A .   5 ASN HD21 1 1 
       20 5205 1 1  4 ASN HD22 H  -0.157  0.199  -3.215 1.00 . A A .   5 ASN HD22 1 1 
       20 5206 1 1  4 ASN N    N   0.267 -2.532   0.158 1.00 . A A .   5 ASN N    1 1 
       20 5207 1 1  4 ASN ND2  N  -0.770 -0.371  -2.705 1.00 . A A .   5 ASN ND2  1 1 
       20 5208 1 1  4 ASN O    O  -1.753 -4.695   0.139 1.00 . A A .   5 ASN O    1 1 
       20 5209 1 1  4 ASN OD1  O   0.678 -2.071  -2.836 1.00 . A A .   5 ASN OD1  1 1 
       20 5210 1 1  5 .   C    C  -4.582 -4.819   1.433 1.00 . A A .   6 O6H C    1 1 
       20 5211 1 1  5 .   CA   C  -3.436 -4.267   2.276 1.00 . A A .   6 O6H CA   1 1 
       20 5212 1 1  5 .   CB   C  -3.971 -3.752   3.619 1.00 . A A .   6 O6H CB   1 1 
       20 5213 1 1  5 .   CD1  C  -2.695 -1.978   4.878 1.00 . A A .   6 O6H CD1  1 1 
       20 5214 1 1  5 .   CD2  C  -2.069 -4.251   5.213 1.00 . A A .   6 O6H CD2  1 1 
       20 5215 1 1  5 .   CE1  C  -1.714 -1.568   5.757 1.00 . A A .   6 O6H CE1  1 1 
       20 5216 1 1  5 .   CE2  C  -1.084 -3.853   6.098 1.00 . A A .   6 O6H CE2  1 1 
       20 5217 1 1  5 .   CF1  C  -3.566 -0.945   4.233 1.00 . A A .   6 O6H CF1  1 1 
       20 5218 1 1  5 .   CF2  C  -2.246 -5.717   4.938 1.00 . A A .   6 O6H CF2  1 1 
       20 5219 1 1  5 .   CG   C  -2.895 -3.322   4.587 1.00 . A A .   6 O6H CG   1 1 
       20 5220 1 1  5 .   CH   C   0.155 -2.069   7.319 1.00 . A A .   6 O6H CH   1 1 
       20 5221 1 1  5 .   CZ   C  -0.912 -2.509   6.362 1.00 . A A .   6 O6H CZ   1 1 
       20 5222 1 1  5 .   H1   H  -2.744 -2.308   1.878 1.00 . A A .   6 O6H H1   1 1 
       20 5223 1 1  5 .   HA   H  -2.749 -5.076   2.474 1.00 . A A .   6 O6H HA   1 1 
       20 5224 1 1  5 .   HB1  H  -4.548 -4.534   4.089 1.00 . A A .   6 O6H HB1  1 1 
       20 5225 1 1  5 .   HB2  H  -4.610 -2.900   3.438 1.00 . A A .   6 O6H HB2  1 1 
       20 5226 1 1  5 .   HE1  H  -1.575 -0.518   5.967 1.00 . A A .   6 O6H HE1  1 1 
       20 5227 1 1  5 .   HE2  H  -0.452 -4.587   6.576 1.00 . A A .   6 O6H HE2  1 1 
       20 5228 1 1  5 .   HF11 H  -4.105 -1.317   3.375 1.00 . A A .   6 O6H HF11 1 1 
       20 5229 1 1  5 .   HF12 H  -3.018 -0.085   3.875 1.00 . A A .   6 O6H HF12 1 1 
       20 5230 1 1  5 .   HF13 H  -4.318 -0.548   4.895 1.00 . A A .   6 O6H HF13 1 1 
       20 5231 1 1  5 .   HF21 H  -3.278 -6.038   4.969 1.00 . A A .   6 O6H HF21 1 1 
       20 5232 1 1  5 .   HF22 H  -1.730 -6.351   5.642 1.00 . A A .   6 O6H HF22 1 1 
       20 5233 1 1  5 .   HF23 H  -1.884 -6.017   3.965 1.00 . A A .   6 O6H HF23 1 1 
       20 5234 1 1  5 .   HH1  H  -0.195 -1.359   8.054 1.00 . A A .   6 O6H HH1  1 1 
       20 5235 1 1  5 .   HH2  H   0.993 -1.591   6.835 1.00 . A A .   6 O6H HH2  1 1 
       20 5236 1 1  5 .   HH3  H   0.580 -2.883   7.889 1.00 . A A .   6 O6H HH3  1 1 
       20 5237 1 1  5 .   N    N  -2.684 -3.234   1.569 1.00 . A A .   6 O6H N    1 1 
       20 5238 1 1  5 .   O    O  -4.862 -6.017   1.458 1.00 . A A .   6 O6H O    1 1 
       20 5239 1 1  6 PHE C    C  -6.273 -4.324  -1.490 1.00 . A A .   7 PHE C    1 1 
       20 5240 1 1  6 PHE CA   C  -6.485 -4.307   0.015 1.00 . A A .   7 PHE CA   1 1 
       20 5241 1 1  6 PHE CB   C  -7.616 -3.335   0.360 1.00 . A A .   7 PHE CB   1 1 
       20 5242 1 1  6 PHE CD1  C  -7.300 -1.509   2.043 1.00 . A A .   7 PHE CD1  1 1 
       20 5243 1 1  6 PHE CD2  C  -7.799 -3.701   2.840 1.00 . A A .   7 PHE CD2  1 1 
       20 5244 1 1  6 PHE CE1  C  -7.242 -1.045   3.341 1.00 . A A .   7 PHE CE1  1 1 
       20 5245 1 1  6 PHE CE2  C  -7.747 -3.242   4.142 1.00 . A A .   7 PHE CE2  1 1 
       20 5246 1 1  6 PHE CG   C  -7.577 -2.839   1.777 1.00 . A A .   7 PHE CG   1 1 
       20 5247 1 1  6 PHE CZ   C  -7.466 -1.911   4.393 1.00 . A A .   7 PHE CZ   1 1 
       20 5248 1 1  6 PHE H    H  -4.934 -3.017   0.656 1.00 . A A .   7 PHE H    1 1 
       20 5249 1 1  6 PHE HA   H  -6.763 -5.298   0.341 1.00 . A A .   7 PHE HA   1 1 
       20 5250 1 1  6 PHE HB2  H  -7.553 -2.477  -0.292 1.00 . A A .   7 PHE HB2  1 1 
       20 5251 1 1  6 PHE HB3  H  -8.565 -3.828   0.206 1.00 . A A .   7 PHE HB3  1 1 
       20 5252 1 1  6 PHE HD1  H  -7.125 -0.830   1.222 1.00 . A A .   7 PHE HD1  1 1 
       20 5253 1 1  6 PHE HD2  H  -8.020 -4.739   2.643 1.00 . A A .   7 PHE HD2  1 1 
       20 5254 1 1  6 PHE HE1  H  -7.028 -0.005   3.534 1.00 . A A .   7 PHE HE1  1 1 
       20 5255 1 1  6 PHE HE2  H  -7.922 -3.923   4.962 1.00 . A A .   7 PHE HE2  1 1 
       20 5256 1 1  6 PHE HZ   H  -7.415 -1.551   5.409 1.00 . A A .   7 PHE HZ   1 1 
       20 5257 1 1  6 PHE N    N  -5.260 -3.936   0.713 1.00 . A A .   7 PHE N    1 1 
       20 5258 1 1  6 PHE O    O  -7.057 -4.916  -2.229 1.00 . A A .   7 PHE O    1 1 
       20 5259 1 1  7 DTR C    C  -4.826 -2.061  -3.795 1.00 . A A .   8 DTR C    1 1 
       20 5260 1 1  7 DTR CA   C  -4.988 -3.523  -3.370 1.00 . A A .   8 DTR CA   1 1 
       20 5261 1 1  7 DTR CB   C  -3.750 -4.326  -3.790 1.00 . A A .   8 DTR CB   1 1 
       20 5262 1 1  7 DTR CD1  C  -2.395 -3.408  -5.765 1.00 . A A .   8 DTR CD1  1 1 
       20 5263 1 1  7 DTR CD2  C  -4.134 -4.689  -6.355 1.00 . A A .   8 DTR CD2  1 1 
       20 5264 1 1  7 DTR CE2  C  -3.488 -4.242  -7.522 1.00 . A A .   8 DTR CE2  1 1 
       20 5265 1 1  7 DTR CE3  C  -5.253 -5.512  -6.479 1.00 . A A .   8 DTR CE3  1 1 
       20 5266 1 1  7 DTR CG   C  -3.419 -4.144  -5.241 1.00 . A A .   8 DTR CG   1 1 
       20 5267 1 1  7 DTR CH2  C  -5.029 -5.396  -8.886 1.00 . A A .   8 DTR CH2  1 1 
       20 5268 1 1  7 DTR CZ2  C  -3.930 -4.590  -8.795 1.00 . A A .   8 DTR CZ2  1 1 
       20 5269 1 1  7 DTR CZ3  C  -5.689 -5.858  -7.741 1.00 . A A .   8 DTR CZ3  1 1 
       20 5270 1 1  7 DTR H    H  -4.619 -3.220  -1.317 1.00 . A A .   8 DTR H    1 1 
       20 5271 1 1  7 DTR HA   H  -5.822 -3.978  -3.889 1.00 . A A .   8 DTR HA   1 1 
       20 5272 1 1  7 DTR HB2  H  -2.901 -4.002  -3.207 1.00 . A A .   8 DTR HB2  1 1 
       20 5273 1 1  7 DTR HB3  H  -3.929 -5.375  -3.614 1.00 . A A .   8 DTR HB3  1 1 
       20 5274 1 1  7 DTR HD1  H  -1.671 -2.866  -5.175 1.00 . A A .   8 DTR HD1  1 1 
       20 5275 1 1  7 DTR HE1  H  -1.798 -3.007  -7.747 1.00 . A A .   8 DTR HE1  1 1 
       20 5276 1 1  7 DTR HE3  H  -5.776 -5.876  -5.606 1.00 . A A .   8 DTR HE3  1 1 
       20 5277 1 1  7 DTR HH2  H  -5.405 -5.691  -9.855 1.00 . A A .   8 DTR HH2  1 1 
       20 5278 1 1  7 DTR HZ2  H  -3.434 -4.238  -9.687 1.00 . A A .   8 DTR HZ2  1 1 
       20 5279 1 1  7 DTR HZ3  H  -6.553 -6.492  -7.855 1.00 . A A .   8 DTR HZ3  1 1 
       20 5280 1 1  7 DTR N    N  -5.236 -3.641  -1.948 1.00 . A A .   8 DTR N    1 1 
       20 5281 1 1  7 DTR NE1  N  -2.432 -3.460  -7.137 1.00 . A A .   8 DTR NE1  1 1 
       20 5282 1 1  7 DTR O    O  -3.993 -1.345  -3.240 1.00 . A A .   8 DTR O    1 1 
       20 5283 1 1  8 LYS C    C  -6.130  0.812  -4.636 1.00 . A A .   9 LYS C    1 1 
       20 5284 1 1  8 LYS CA   C  -5.407 -0.307  -5.381 1.00 . A A .   9 LYS CA   1 1 
       20 5285 1 1  8 LYS CB   C  -5.878 -0.353  -6.837 1.00 . A A .   9 LYS CB   1 1 
       20 5286 1 1  8 LYS CD   C  -7.793 -0.771  -8.428 1.00 . A A .   9 LYS CD   1 1 
       20 5287 1 1  8 LYS CE   C  -7.279 -2.071  -9.022 1.00 . A A .   9 LYS CE   1 1 
       20 5288 1 1  8 LYS CG   C  -7.370 -0.616  -6.977 1.00 . A A .   9 LYS CG   1 1 
       20 5289 1 1  8 LYS H    H  -6.401 -2.135  -5.042 1.00 . A A .   9 LYS H    1 1 
       20 5290 1 1  8 LYS HA   H  -4.347 -0.111  -5.363 1.00 . A A .   9 LYS HA   1 1 
       20 5291 1 1  8 LYS HB2  H  -5.652  0.593  -7.308 1.00 . A A .   9 LYS HB2  1 1 
       20 5292 1 1  8 LYS HB3  H  -5.345 -1.139  -7.353 1.00 . A A .   9 LYS HB3  1 1 
       20 5293 1 1  8 LYS HD2  H  -8.872 -0.766  -8.480 1.00 . A A .   9 LYS HD2  1 1 
       20 5294 1 1  8 LYS HD3  H  -7.399  0.056  -8.998 1.00 . A A .   9 LYS HD3  1 1 
       20 5295 1 1  8 LYS HE2  H  -6.204 -2.021  -9.093 1.00 . A A .   9 LYS HE2  1 1 
       20 5296 1 1  8 LYS HE3  H  -7.561 -2.886  -8.372 1.00 . A A .   9 LYS HE3  1 1 
       20 5297 1 1  8 LYS HG2  H  -7.615 -1.523  -6.447 1.00 . A A .   9 LYS HG2  1 1 
       20 5298 1 1  8 LYS HG3  H  -7.907  0.210  -6.544 1.00 . A A .   9 LYS HG3  1 1 
       20 5299 1 1  8 LYS HZ1  H  -8.883 -2.290 -10.345 1.00 . A A .   9 LYS HZ1  1 1 
       20 5300 1 1  8 LYS HZ2  H  -7.543 -3.250 -10.726 1.00 . A A .   9 LYS HZ2  1 1 
       20 5301 1 1  8 LYS HZ3  H  -7.510 -1.583 -11.043 1.00 . A A .   9 LYS HZ3  1 1 
       20 5302 1 1  8 LYS N    N  -5.636 -1.601  -4.751 1.00 . A A .   9 LYS N    1 1 
       20 5303 1 1  8 LYS NZ   N  -7.842 -2.315 -10.376 1.00 . A A .   9 LYS NZ   1 1 
       20 5304 1 1  8 LYS O    O  -6.020  1.983  -4.999 1.00 . A A .   9 LYS O    1 1 
       20 5305 1 1  9 THR C    C  -6.674  2.138  -1.801 1.00 . A A .  10 THR C    1 1 
       20 5306 1 1  9 THR CA   C  -7.597  1.420  -2.795 1.00 . A A .  10 THR CA   1 1 
       20 5307 1 1  9 THR CB   C  -8.736  0.724  -2.027 1.00 . A A .  10 THR CB   1 1 
       20 5308 1 1  9 THR CG2  C  -9.761  1.734  -1.530 1.00 . A A .  10 THR CG2  1 1 
       20 5309 1 1  9 THR H    H  -6.937 -0.505  -3.373 1.00 . A A .  10 THR H    1 1 
       20 5310 1 1  9 THR HA   H  -8.031  2.146  -3.465 1.00 . A A .  10 THR HA   1 1 
       20 5311 1 1  9 THR HB   H  -8.316  0.204  -1.179 1.00 . A A .  10 THR HB   1 1 
       20 5312 1 1  9 THR HG1  H  -9.622  0.217  -3.721 1.00 . A A .  10 THR HG1  1 1 
       20 5313 1 1  9 THR HG21 H -10.188  2.257  -2.372 1.00 . A A .  10 THR HG21 1 1 
       20 5314 1 1  9 THR HG22 H  -9.280  2.441  -0.870 1.00 . A A .  10 THR HG22 1 1 
       20 5315 1 1  9 THR HG23 H -10.544  1.217  -0.995 1.00 . A A .  10 THR HG23 1 1 
       20 5316 1 1  9 THR N    N  -6.860  0.447  -3.591 1.00 . A A .  10 THR N    1 1 
       20 5317 1 1  9 THR O    O  -6.928  3.278  -1.415 1.00 . A A .  10 THR O    1 1 
       20 5318 1 1  9 THR OG1  O  -9.377 -0.223  -2.890 1.00 . A A .  10 THR OG1  1 1 
       20 5319 1 1 10 PHE C    C  -3.212  1.876  -1.047 1.00 . A A .  11 PHE C    1 1 
       20 5320 1 1 10 PHE CA   C  -4.641  2.041  -0.472 1.00 . A A .  11 PHE CA   1 1 
       20 5321 1 1 10 PHE CB   C  -4.731  1.307   0.871 1.00 . A A .  11 PHE CB   1 1 
       20 5322 1 1 10 PHE CD1  C  -4.309  2.830   2.820 1.00 . A A .  11 PHE CD1  1 1 
       20 5323 1 1 10 PHE CD2  C  -2.525  1.435   2.070 1.00 . A A .  11 PHE CD2  1 1 
       20 5324 1 1 10 PHE CE1  C  -3.491  3.345   3.808 1.00 . A A .  11 PHE CE1  1 1 
       20 5325 1 1 10 PHE CE2  C  -1.705  1.947   3.054 1.00 . A A .  11 PHE CE2  1 1 
       20 5326 1 1 10 PHE CG   C  -3.836  1.870   1.940 1.00 . A A .  11 PHE CG   1 1 
       20 5327 1 1 10 PHE CZ   C  -2.189  2.903   3.926 1.00 . A A .  11 PHE CZ   1 1 
       20 5328 1 1 10 PHE H    H  -5.433  0.576  -1.757 1.00 . A A .  11 PHE H    1 1 
       20 5329 1 1 10 PHE HA   H  -4.905  3.076  -0.319 1.00 . A A .  11 PHE HA   1 1 
       20 5330 1 1 10 PHE HB2  H  -5.748  1.360   1.233 1.00 . A A .  11 PHE HB2  1 1 
       20 5331 1 1 10 PHE HB3  H  -4.462  0.270   0.725 1.00 . A A .  11 PHE HB3  1 1 
       20 5332 1 1 10 PHE HD1  H  -5.327  3.177   2.729 1.00 . A A .  11 PHE HD1  1 1 
       20 5333 1 1 10 PHE HD2  H  -2.146  0.689   1.389 1.00 . A A .  11 PHE HD2  1 1 
       20 5334 1 1 10 PHE HE1  H  -3.872  4.094   4.487 1.00 . A A .  11 PHE HE1  1 1 
       20 5335 1 1 10 PHE HE2  H  -0.687  1.600   3.145 1.00 . A A .  11 PHE HE2  1 1 
       20 5336 1 1 10 PHE HZ   H  -1.548  3.305   4.696 1.00 . A A .  11 PHE HZ   1 1 
       20 5337 1 1 10 PHE N    N  -5.599  1.470  -1.404 1.00 . A A .  11 PHE N    1 1 
       20 5338 1 1 10 PHE O    O  -2.762  0.738  -1.172 1.00 . A A .  11 PHE O    1 1 
       20 5339 1 1 11 THR C    C  -0.180  3.732  -1.208 1.00 . A A .  12 THR C    1 1 
       20 5340 1 1 11 THR CA   C  -1.137  2.772  -1.919 1.00 . A A .  12 THR CA   1 1 
       20 5341 1 1 11 THR CB   C  -1.047  2.939  -3.456 1.00 . A A .  12 THR CB   1 1 
       20 5342 1 1 11 THR CG2  C  -1.523  4.316  -3.906 1.00 . A A .  12 THR CG2  1 1 
       20 5343 1 1 11 THR H    H  -2.860  3.861  -1.409 1.00 . A A .  12 THR H    1 1 
       20 5344 1 1 11 THR HA   H  -0.839  1.760  -1.678 1.00 . A A .  12 THR HA   1 1 
       20 5345 1 1 11 THR HB   H  -1.685  2.195  -3.912 1.00 . A A .  12 THR HB   1 1 
       20 5346 1 1 11 THR HG1  H   0.592  3.476  -4.432 1.00 . A A .  12 THR HG1  1 1 
       20 5347 1 1 11 THR HG21 H  -2.553  4.455  -3.614 1.00 . A A .  12 THR HG21 1 1 
       20 5348 1 1 11 THR HG22 H  -1.441  4.393  -4.981 1.00 . A A .  12 THR HG22 1 1 
       20 5349 1 1 11 THR HG23 H  -0.912  5.078  -3.444 1.00 . A A .  12 THR HG23 1 1 
       20 5350 1 1 11 THR N    N  -2.493  2.948  -1.436 1.00 . A A .  12 THR N    1 1 
       20 5351 1 1 11 THR O    O  -0.295  4.955  -1.315 1.00 . A A .  12 THR O    1 1 
       20 5352 1 1 11 THR OG1  O   0.298  2.720  -3.900 1.00 . A A .  12 THR OG1  1 1 
       20 5353 1 1 12 SER C    C   3.132  3.421   0.033 1.00 . A A .  13 SER C    1 1 
       20 5354 1 1 12 SER CA   C   1.721  3.969   0.268 1.00 . A A .  13 SER CA   1 1 
       20 5355 1 1 12 SER CB   C   1.401  3.995   1.763 1.00 . A A .  13 SER CB   1 1 
       20 5356 1 1 12 SER H    H   0.753  2.196  -0.341 1.00 . A A .  13 SER H    1 1 
       20 5357 1 1 12 SER HA   H   1.659  4.975  -0.116 1.00 . A A .  13 SER HA   1 1 
       20 5358 1 1 12 SER HB2  H   1.437  2.989   2.155 1.00 . A A .  13 SER HB2  1 1 
       20 5359 1 1 12 SER HB3  H   2.126  4.610   2.275 1.00 . A A .  13 SER HB3  1 1 
       20 5360 1 1 12 SER HG   H  -0.322  4.682   1.136 1.00 . A A .  13 SER HG   1 1 
       20 5361 1 1 12 SER N    N   0.735  3.172  -0.436 1.00 . A A .  13 SER N    1 1 
       20 5362 1 1 12 SER O    O   3.430  2.285   0.412 1.00 . A A .  13 SER O    1 1 
       20 5363 1 1 12 SER OG   O   0.105  4.527   1.985 1.00 . A A .  13 SER OG   1 1 
       20 5364 1 1 13 CYS C    C   6.256  4.778   0.024 1.00 . A A .  14 CYS C    1 1 
       20 5365 1 1 13 CYS CA   C   5.375  3.848  -0.795 1.00 . A A .  14 CYS CA   1 1 
       20 5366 1 1 13 CYS CB   C   5.765  3.909  -2.273 1.00 . A A .  14 CYS CB   1 1 
       20 5367 1 1 13 CYS H    H   3.664  5.061  -0.998 1.00 . A A .  14 CYS H    1 1 
       20 5368 1 1 13 CYS HA   H   5.504  2.837  -0.436 1.00 . A A .  14 CYS HA   1 1 
       20 5369 1 1 13 CYS HB2  H   5.488  4.874  -2.670 1.00 . A A .  14 CYS HB2  1 1 
       20 5370 1 1 13 CYS HB3  H   6.834  3.782  -2.362 1.00 . A A .  14 CYS HB3  1 1 
       20 5371 1 1 13 CYS N    N   3.980  4.210  -0.618 1.00 . A A .  14 CYS N    1 1 
       20 5372 1 1 13 CYS O    O   6.184  5.997  -0.124 1.00 . A A .  14 CYS O    1 1 
       20 5373 1 1 13 CYS SG   S   4.966  2.636  -3.306 1.00 . A A .  14 CYS SG   1 1 
       20 5374 1 1 14 LYS C    C   8.924  5.793   0.927 1.00 . A A .  15 LYS C    1 1 
       20 5375 1 1 14 LYS CA   C   7.955  4.958   1.758 1.00 . A A .  15 LYS CA   1 1 
       20 5376 1 1 14 LYS CB   C   8.744  4.038   2.687 1.00 . A A .  15 LYS CB   1 1 
       20 5377 1 1 14 LYS CD   C  10.565  3.904   4.426 1.00 . A A .  15 LYS CD   1 1 
       20 5378 1 1 14 LYS CE   C  11.427  4.719   5.374 1.00 . A A .  15 LYS CE   1 1 
       20 5379 1 1 14 LYS CG   C   9.609  4.805   3.669 1.00 . A A .  15 LYS CG   1 1 
       20 5380 1 1 14 LYS H    H   7.067  3.213   0.962 1.00 . A A .  15 LYS H    1 1 
       20 5381 1 1 14 LYS HA   H   7.346  5.622   2.353 1.00 . A A .  15 LYS HA   1 1 
       20 5382 1 1 14 LYS HB2  H   8.053  3.425   3.246 1.00 . A A .  15 LYS HB2  1 1 
       20 5383 1 1 14 LYS HB3  H   9.384  3.402   2.094 1.00 . A A .  15 LYS HB3  1 1 
       20 5384 1 1 14 LYS HD2  H   9.996  3.186   4.996 1.00 . A A .  15 LYS HD2  1 1 
       20 5385 1 1 14 LYS HD3  H  11.201  3.391   3.721 1.00 . A A .  15 LYS HD3  1 1 
       20 5386 1 1 14 LYS HE2  H  10.790  5.184   6.110 1.00 . A A .  15 LYS HE2  1 1 
       20 5387 1 1 14 LYS HE3  H  12.123  4.054   5.866 1.00 . A A .  15 LYS HE3  1 1 
       20 5388 1 1 14 LYS HG2  H  10.184  5.539   3.125 1.00 . A A .  15 LYS HG2  1 1 
       20 5389 1 1 14 LYS HG3  H   8.966  5.307   4.378 1.00 . A A .  15 LYS HG3  1 1 
       20 5390 1 1 14 LYS HZ1  H  12.971  5.352   4.114 1.00 . A A .  15 LYS HZ1  1 1 
       20 5391 1 1 14 LYS HZ2  H  12.585  6.461   5.341 1.00 . A A .  15 LYS HZ2  1 1 
       20 5392 1 1 14 LYS HZ3  H  11.563  6.291   3.999 1.00 . A A .  15 LYS HZ3  1 1 
       20 5393 1 1 14 LYS N    N   7.067  4.193   0.897 1.00 . A A .  15 LYS N    1 1 
       20 5394 1 1 14 LYS NZ   N  12.190  5.776   4.658 1.00 . A A .  15 LYS NZ   1 1 
       20 5395 1 1 14 LYS O    O   9.680  5.206   0.127 1.00 . A A .  15 LYS O    1 1 
       20 5396 1 1 14 LYS OXT  O   8.935  7.033   1.093 1.00 . A A .  15 LYS OXT  1 1 
       20 5397 2 2  1 .   C1   C   8.720 -2.372   1.278 1.00 . B A . 101 OCA C1   1 1 
       20 5398 2 2  1 .   C2   C   8.014 -1.906   2.546 1.00 . B A . 101 OCA C2   1 1 
       20 5399 2 2  1 .   C3   C   8.979 -1.542   3.665 1.00 . B A . 101 OCA C3   1 1 
       20 5400 2 2  1 .   C4   C   8.232 -1.152   4.932 1.00 . B A . 101 OCA C4   1 1 
       20 5401 2 2  1 .   C5   C   8.351  0.336   5.218 1.00 . B A . 101 OCA C5   1 1 
       20 5402 2 2  1 .   C6   C   9.387  0.616   6.298 1.00 . B A . 101 OCA C6   1 1 
       20 5403 2 2  1 .   C7   C   8.936  1.724   7.242 1.00 . B A . 101 OCA C7   1 1 
       20 5404 2 2  1 .   C8   C   7.707  1.326   8.034 1.00 . B A . 101 OCA C8   1 1 
       20 5405 2 2  1 .   H21  H   7.418 -1.036   2.310 1.00 . B A . 101 OCA H21  1 1 
       20 5406 2 2  1 .   H22  H   7.368 -2.699   2.890 1.00 . B A . 101 OCA H22  1 1 
       20 5407 2 2  1 .   H31  H   9.591 -0.711   3.347 1.00 . B A . 101 OCA H31  1 1 
       20 5408 2 2  1 .   H32  H   9.607 -2.395   3.878 1.00 . B A . 101 OCA H32  1 1 
       20 5409 2 2  1 .   H41  H   7.188 -1.404   4.815 1.00 . B A . 101 OCA H41  1 1 
       20 5410 2 2  1 .   H42  H   8.646 -1.702   5.765 1.00 . B A . 101 OCA H42  1 1 
       20 5411 2 2  1 .   H51  H   8.642  0.845   4.311 1.00 . B A . 101 OCA H51  1 1 
       20 5412 2 2  1 .   H52  H   7.393  0.706   5.550 1.00 . B A . 101 OCA H52  1 1 
       20 5413 2 2  1 .   H61  H   9.548 -0.285   6.870 1.00 . B A . 101 OCA H61  1 1 
       20 5414 2 2  1 .   H62  H  10.312  0.916   5.827 1.00 . B A . 101 OCA H62  1 1 
       20 5415 2 2  1 .   H71  H   9.734  1.942   7.936 1.00 . B A . 101 OCA H71  1 1 
       20 5416 2 2  1 .   H72  H   8.700  2.606   6.666 1.00 . B A . 101 OCA H72  1 1 
       20 5417 2 2  1 .   H81  H   7.338  2.181   8.582 1.00 . B A . 101 OCA H81  1 1 
       20 5418 2 2  1 .   H82  H   7.965  0.539   8.726 1.00 . B A . 101 OCA H82  1 1 
       20 5419 2 2  1 .   H83  H   6.942  0.975   7.358 1.00 . B A . 101 OCA H83  1 1 
       20 5420 2 2  1 .   O1   O   9.041 -3.540   1.061 1.00 . B A . 101 OCA O1   1 1 
    stop_

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