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
311571 1skl 6168 cing 4-filtered-FRED STAR entry full


data_FRED_restraints_with_modified_coordinates_PDB_code_1skl

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




save_entry_information
    _Entry.Sf_category                  entry_information
    _Entry.Sf_framecode                 entry_information
    _Entry.ID                           rr_1skl
    _Entry.Title                        "wwPDB remediated NMR restraints for PDB entry 1skl"
    _Entry.NMR_STAR_version             3.1
    _Entry.Experimental_method          NMR
    _Entry.Experimental_method_subtype  solution
    _Entry.Details                      "Contains the remediated restraint lists and coordinates for PDB entry 1skl"

save_


save_assembly
    _Assembly.Sf_category           assembly
    _Assembly.Sf_framecode          assembly
    _Assembly.Entry_ID              rr_1skl
    _Assembly.ID                    1
    _Assembly.Name                  1skl
    _Assembly.Number_of_components  1
    _Assembly.Organic_ligands       0
    _Assembly.Metal_ions            0
    _Assembly.Non_standard_bonds    no
    _Assembly.Paramagnetic          no
    _Assembly.Thiol_state           "not present"
    _Assembly.Molecular_mass        1066.2706

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

       1 "cyclic hexapeptide RR NAL NAL RF" 1 $cyclic_hexapeptide_RR_NAL__NAL_RF A . no . . . . . . rr_1skl 1 
    stop_

save_


save_cyclic_hexapeptide_RR_NAL__NAL_RF
    _Entity.Sf_category                      entity
    _Entity.Sf_framecode                     cyclic_hexapeptide_RR_NAL__NAL_RF
    _Entity.Entry_ID                         rr_1skl
    _Entity.ID                               1
    _Entity.Name                             cyclic_hexapeptide_RR_NAL__NAL_RF
    _Entity.Type                             non-polymer
    _Entity.Ambiguous_conformational_states  no
    _Entity.Ambiguous_chem_comp_sites        no
    _Entity.Nstd_chirality                   yes
    _Entity.Nstd_linkage                     yes
    _Entity.Nonpolymer_comp_ID               ARG
    _Entity.Nonpolymer_comp_label            $chem_comp_ARG
    _Entity.Number_of_monomers               6
    _Entity.Paramagnetic                     no
    _Entity.Thiol_state                      "not present"
    _Entity.Parent_entity_ID                 1

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

       1 . ARG . rr_1skl 1 
       2 . ARG . rr_1skl 1 
       3 . NAL . rr_1skl 1 
       4 . NAL . rr_1skl 1 
       5 . ARG . rr_1skl 1 
       6 . PHE . rr_1skl 1 
    stop_

save_


save_chem_comp_NAL
    _Chem_comp.Sf_category     chem_comp
    _Chem_comp.Sf_framecode    chem_comp_NAL
    _Chem_comp.Entry_ID        rr_1skl
    _Chem_comp.ID              NAL
    _Chem_comp.Name            BETA-(2-NAPHTHYL)-ALANINE
    _Chem_comp.Type            non-polymer
    _Chem_comp.PDB_code        NAL
    _Chem_comp.Formal_charge   0
    _Chem_comp.Paramagnetic    no
    _Chem_comp.Aromatic        yes
    _Chem_comp.Formula         "C13 H13 N O2"
    _Chem_comp.Formula_weight  215.2512

save_


save_conformer_statistics
    _Conformer_stat_list.Sf_category                    conformer_statistics
    _Conformer_stat_list.Sf_framecode                   conformer_statistics
    _Conformer_stat_list.Entry_ID                       rr_1skl
    _Conformer_stat_list.ID                             1
    _Conformer_stat_list.Conf_family_coord_set_ID       1
    _Conformer_stat_list.Conf_family_coord_set_label    $Original_constraints_and_structures
    _Conformer_stat_list.Conformer_submitted_total_num  10

save_


save_ensemble_of_conformers
    _Conformer_family_coord_set.Sf_category   conformer_family_coord_set
    _Conformer_family_coord_set.Sf_framecode  ensemble_of_conformers
    _Conformer_family_coord_set.Entry_ID      rr_1skl
    _Conformer_family_coord_set.ID            1

    loop_
       _Conformer_family_refinement.Refine_method
       _Conformer_family_refinement.Refine_details
       _Conformer_family_refinement.Entry_ID
       _Conformer_family_refinement.Conformer_family_coord_set_ID

       1 . rr_1skl 1 
    stop_

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

       . . . . rr_1skl 1 
    stop_

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

        1 .    1 . 1 1 1 ARG C    C  0.223  1.528  -4.487 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG C    . . rr_1skl 1 
        1 .    2 . 1 1 1 ARG CA   C  1.577  0.799  -4.614 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG CA   . . rr_1skl 1 
        1 .    3 . 1 1 1 ARG CB   C  1.495 -0.170  -5.811 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG CB   . . rr_1skl 1 
        1 .    4 . 1 1 1 ARG CD   C  2.700 -1.687  -7.421 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG CD   . . rr_1skl 1 
        1 .    5 . 1 1 1 ARG CG   C  2.840 -0.818  -6.164 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG CG   . . rr_1skl 1 
        1 .    6 . 1 1 1 ARG CZ   C  4.204 -3.039  -8.890 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG CZ   . . rr_1skl 1 
        1 .    7 . 1 1 1 ARG HA   H  2.347  1.539  -4.852 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HA   . . rr_1skl 1 
        1 .    8 . 1 1 1 ARG HB2  H  0.763 -0.951  -5.593 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HB2  . . rr_1skl 1 
        1 .    9 . 1 1 1 ARG HB3  H  1.147  0.387  -6.681 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HB3  . . rr_1skl 1 
        1 .   10 . 1 1 1 ARG HD2  H  1.945 -2.455  -7.243 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HD2  . . rr_1skl 1 
        1 .   11 . 1 1 1 ARG HD3  H  2.374 -1.059  -8.252 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HD3  . . rr_1skl 1 
        1 .   12 . 1 1 1 ARG HE   H  4.725 -2.233  -7.105 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HE   . . rr_1skl 1 
        1 .   13 . 1 1 1 ARG HG2  H  3.579 -0.037  -6.354 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HG2  . . rr_1skl 1 
        1 .   14 . 1 1 1 ARG HG3  H  3.182 -1.441  -5.337 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HG3  . . rr_1skl 1 
        1 .   15 . 1 1 1 ARG HH11 H  2.342 -2.805  -9.695 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HH11 . . rr_1skl 1 
        1 .   16 . 1 1 1 ARG HH12 H  3.461 -3.746 -10.655 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HH12 . . rr_1skl 1 
        1 .   17 . 1 1 1 ARG HH21 H  6.138 -3.461  -8.388 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HH21 . . rr_1skl 1 
        1 .   18 . 1 1 1 ARG HH22 H  5.597 -4.113  -9.918 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HH22 . . rr_1skl 1 
        1 .   19 . 1 1 1 ARG N    N  1.949  0.053  -3.409 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG N    . . rr_1skl 1 
        1 .   20 . 1 1 1 ARG NE   N  3.969 -2.332  -7.768 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG NE   . . rr_1skl 1 
        1 .   21 . 1 1 1 ARG NH1  N  3.260 -3.214  -9.822 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG NH1  . . rr_1skl 1 
        1 .   22 . 1 1 1 ARG NH2  N  5.410 -3.584  -9.085 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG NH2  . . rr_1skl 1 
        1 .   23 . 1 1 1 ARG O    O -0.033  2.447  -5.262 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG O    . . rr_1skl 1 
        1 .   24 . 1 1 2 ARG C    C -2.169  2.971  -2.872 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG C    . . rr_1skl 1 
        1 .   25 . 1 1 2 ARG CA   C -2.033  1.555  -3.460 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG CA   . . rr_1skl 1 
        1 .   26 . 1 1 2 ARG CB   C -2.873  0.541  -2.666 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG CB   . . rr_1skl 1 
        1 .   27 . 1 1 2 ARG CD   C -3.636 -1.836  -2.330 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG CD   . . rr_1skl 1 
        1 .   28 . 1 1 2 ARG CG   C -2.774 -0.903  -3.188 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG CG   . . rr_1skl 1 
        1 .   29 . 1 1 2 ARG CZ   C -2.643 -4.124  -2.616 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG CZ   . . rr_1skl 1 
        1 .   30 . 1 1 2 ARG H    H -0.368  0.365  -2.925 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG H    . . rr_1skl 1 
        1 .   31 . 1 1 2 ARG HA   H -2.448  1.586  -4.465 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HA   . . rr_1skl 1 
        1 .   32 . 1 1 2 ARG HB2  H -2.564  0.554  -1.619 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HB2  . . rr_1skl 1 
        1 .   33 . 1 1 2 ARG HB3  H -3.920  0.840  -2.739 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HB3  . . rr_1skl 1 
        1 .   34 . 1 1 2 ARG HD2  H -3.280 -1.816  -1.298 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HD2  . . rr_1skl 1 
        1 .   35 . 1 1 2 ARG HD3  H -4.667 -1.481  -2.343 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HD3  . . rr_1skl 1 
        1 .   36 . 1 1 2 ARG HE   H -4.394 -3.494  -3.412 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HE   . . rr_1skl 1 
        1 .   37 . 1 1 2 ARG HG2  H -3.120 -0.937  -4.222 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HG2  . . rr_1skl 1 
        1 .   38 . 1 1 2 ARG HG3  H -1.740 -1.245  -3.147 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HG3  . . rr_1skl 1 
        1 .   39 . 1 1 2 ARG HH11 H -1.467 -2.934  -1.445 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HH11 . . rr_1skl 1 
        1 .   40 . 1 1 2 ARG HH12 H -0.859 -4.551  -1.720 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HH12 . . rr_1skl 1 
        1 .   41 . 1 1 2 ARG HH21 H -3.561 -5.565  -3.731 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HH21 . . rr_1skl 1 
        1 .   42 . 1 1 2 ARG HH22 H -2.039 -6.033  -3.008 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HH22 . . rr_1skl 1 
        1 .   43 . 1 1 2 ARG N    N -0.645  1.116  -3.546 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG N    . . rr_1skl 1 
        1 .   44 . 1 1 2 ARG NE   N -3.610 -3.215  -2.837 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG NE   . . rr_1skl 1 
        1 .   45 . 1 1 2 ARG NH1  N -1.567 -3.847  -1.866 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG NH1  . . rr_1skl 1 
        1 .   46 . 1 1 2 ARG NH2  N -2.756 -5.340  -3.162 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG NH2  . . rr_1skl 1 
        1 .   47 . 1 1 2 ARG O    O -2.710  3.842  -3.545 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG O    . . rr_1skl 1 
        1 .   48 . 1 1 3 NAL C1   C -3.893  2.279   0.423 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C1   . . rr_1skl 1 
        1 .   49 . 1 1 3 NAL C10  C -1.945  4.405  -0.851 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C10  . . rr_1skl 1 
        1 .   50 . 1 1 3 NAL C11  C -1.173  4.464   0.481 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C11  . . rr_1skl 1 
        1 .   51 . 1 1 3 NAL C2   C -4.304  3.310  -0.434 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C2   . . rr_1skl 1 
        1 .   52 . 1 1 3 NAL C3   C -5.488  3.147  -1.173 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C3   . . rr_1skl 1 
        1 .   53 . 1 1 3 NAL C4   C -6.244  1.968  -1.071 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C4   . . rr_1skl 1 
        1 .   54 . 1 1 3 NAL C4A  C -5.807  0.926  -0.221 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C4A  . . rr_1skl 1 
        1 .   55 . 1 1 3 NAL C5   C -6.545 -0.275  -0.127 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C5   . . rr_1skl 1 
        1 .   56 . 1 1 3 NAL C6   C -6.091 -1.304   0.715 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C6   . . rr_1skl 1 
        1 .   57 . 1 1 3 NAL C7   C -4.907 -1.152   1.452 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C7   . . rr_1skl 1 
        1 .   58 . 1 1 3 NAL C8   C -4.174  0.042   1.357 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C8   . . rr_1skl 1 
        1 .   59 . 1 1 3 NAL C8A  C -4.621  1.086   0.529 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C8A  . . rr_1skl 1 
        1 .   60 . 1 1 3 NAL C9   C -3.466  4.586  -0.596 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C9   . . rr_1skl 1 
        1 .   61 . 1 1 3 NAL H1   H -2.979  2.389   0.992 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H1   . . rr_1skl 1 
        1 .   62 . 1 1 3 NAL H10  H -1.605  5.257  -1.450 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H10  . . rr_1skl 1 
        1 .   63 . 1 1 3 NAL H3   H -5.828  3.931  -1.844 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H3   . . rr_1skl 1 
        1 .   64 . 1 1 3 NAL H4   H -7.147  1.852  -1.645 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H4   . . rr_1skl 1 
        1 .   65 . 1 1 3 NAL H5   H -7.448 -0.403  -0.697 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H5   . . rr_1skl 1 
        1 .   66 . 1 1 3 NAL H6   H -6.662 -2.224   0.793 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H6   . . rr_1skl 1 
        1 .   67 . 1 1 3 NAL H7   H -4.560 -1.950   2.092 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H7   . . rr_1skl 1 
        1 .   68 . 1 1 3 NAL H8   H -3.257  0.155   1.927 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H8   . . rr_1skl 1 
        1 .   69 . 1 1 3 NAL H91  H -3.619  5.208   0.284 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H91  . . rr_1skl 1 
        1 .   70 . 1 1 3 NAL H92  H -3.871  5.143  -1.439 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H92  . . rr_1skl 1 
        1 .   71 . 1 1 3 NAL HN1  H -1.245  2.427  -1.142 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL HN1  . . rr_1skl 1 
        1 .   72 . 1 1 3 NAL N    N -1.702  3.190  -1.630 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL N    . . rr_1skl 1 
        1 .   73 . 1 1 3 NAL O2   O -1.113  5.531   1.098 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL O2   . . rr_1skl 1 
        1 .   74 . 1 1 4 NAL C1   C -0.916  0.931   4.676 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C1   . . rr_1skl 1 
        1 .   75 . 1 1 4 NAL C10  C  0.001  3.172   2.275 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C10  . . rr_1skl 1 
        1 .   76 . 1 1 4 NAL C11  C  0.847  1.902   2.242 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C11  . . rr_1skl 1 
        1 .   77 . 1 1 4 NAL C2   C -0.741  2.325   4.611 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C2   . . rr_1skl 1 
        1 .   78 . 1 1 4 NAL C3   C -0.255  3.021   5.731 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C3   . . rr_1skl 1 
        1 .   79 . 1 1 4 NAL C4   C  0.047  2.321   6.913 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C4   . . rr_1skl 1 
        1 .   80 . 1 1 4 NAL C4A  C -0.174  0.931   6.992 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C4A  . . rr_1skl 1 
        1 .   81 . 1 1 4 NAL C5   C  0.117  0.232   8.181 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C5   . . rr_1skl 1 
        1 .   82 . 1 1 4 NAL C6   C -0.128 -1.152   8.247 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C6   . . rr_1skl 1 
        1 .   83 . 1 1 4 NAL C7   C -0.658 -1.839   7.138 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C7   . . rr_1skl 1 
        1 .   84 . 1 1 4 NAL C8   C -0.933 -1.151   5.942 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C8   . . rr_1skl 1 
        1 .   85 . 1 1 4 NAL C8A  C -0.680  0.234   5.870 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C8A  . . rr_1skl 1 
        1 .   86 . 1 1 4 NAL C9   C -1.111  3.048   3.327 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C9   . . rr_1skl 1 
        1 .   87 . 1 1 4 NAL H1   H -1.198  0.395   3.783 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H1   . . rr_1skl 1 
        1 .   88 . 1 1 4 NAL H10  H  0.623  4.041   2.526 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H10  . . rr_1skl 1 
        1 .   89 . 1 1 4 NAL H3   H -0.108  4.092   5.688 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H3   . . rr_1skl 1 
        1 .   90 . 1 1 4 NAL H4   H  0.435  2.858   7.768 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H4   . . rr_1skl 1 
        1 .   91 . 1 1 4 NAL H5   H  0.526  0.755   9.039 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H5   . . rr_1skl 1 
        1 .   92 . 1 1 4 NAL H6   H  0.087 -1.689   9.160 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H6   . . rr_1skl 1 
        1 .   93 . 1 1 4 NAL H7   H -0.849 -2.899   7.205 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H7   . . rr_1skl 1 
        1 .   94 . 1 1 4 NAL H8   H -1.340 -1.687   5.084 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H8   . . rr_1skl 1 
        1 .   95 . 1 1 4 NAL H91  H -1.480  4.043   3.568 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H91  . . rr_1skl 1 
        1 .   96 . 1 1 4 NAL H92  H -1.941  2.492   2.891 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H92  . . rr_1skl 1 
        1 .   97 . 1 1 4 NAL HN1  H -0.665  2.505   0.384 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL HN1  . . rr_1skl 1 
        1 .   98 . 1 1 4 NAL N    N -0.598  3.341   0.951 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL N    . . rr_1skl 1 
        1 .   99 . 1 1 4 NAL O2   O  0.319  0.831   1.929 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL O2   . . rr_1skl 1 
        1 .  100 . 1 1 5 ARG C    C  3.228  0.043   1.281 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG C    . . rr_1skl 1 
        1 .  101 . 1 1 5 ARG CA   C  3.245  1.063   2.461 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG CA   . . rr_1skl 1 
        1 .  102 . 1 1 5 ARG CB   C  3.685  0.538   3.844 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG CB   . . rr_1skl 1 
        1 .  103 . 1 1 5 ARG CD   C  2.316 -1.615   3.927 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG CD   . . rr_1skl 1 
        1 .  104 . 1 1 5 ARG CG   C  2.732 -0.338   4.655 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG CG   . . rr_1skl 1 
        1 .  105 . 1 1 5 ARG CZ   C  2.215 -3.771   5.219 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG CZ   . . rr_1skl 1 
        1 .  106 . 1 1 5 ARG H    H  2.438  2.951   2.887 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG H    . . rr_1skl 1 
        1 .  107 . 1 1 5 ARG HA   H  4.055  1.717   2.171 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HA   . . rr_1skl 1 
        1 .  108 . 1 1 5 ARG HB2  H  4.622 -0.014   3.755 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HB2  . . rr_1skl 1 
        1 .  109 . 1 1 5 ARG HB3  H  3.896  1.398   4.487 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HB3  . . rr_1skl 1 
        1 .  110 . 1 1 5 ARG HD2  H  1.593 -1.368   3.153 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HD2  . . rr_1skl 1 
        1 .  111 . 1 1 5 ARG HD3  H  3.192 -2.058   3.457 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HD3  . . rr_1skl 1 
        1 .  112 . 1 1 5 ARG HE   H  0.831 -2.302   5.270 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HE   . . rr_1skl 1 
        1 .  113 . 1 1 5 ARG HG2  H  3.257 -0.600   5.572 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HG2  . . rr_1skl 1 
        1 .  114 . 1 1 5 ARG HG3  H  1.859  0.254   4.915 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HG3  . . rr_1skl 1 
        1 .  115 . 1 1 5 ARG HH11 H  3.890 -3.677   4.058 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HH11 . . rr_1skl 1 
        1 .  116 . 1 1 5 ARG HH12 H  3.725 -5.133   5.013 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HH12 . . rr_1skl 1 
        1 .  117 . 1 1 5 ARG HH21 H  0.665 -4.180   6.477 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HH21 . . rr_1skl 1 
        1 .  118 . 1 1 5 ARG HH22 H  1.897 -5.419   6.382 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HH22 . . rr_1skl 1 
        1 .  119 . 1 1 5 ARG N    N  2.148  2.034   2.568 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG N    . . rr_1skl 1 
        1 .  120 . 1 1 5 ARG NE   N  1.710 -2.578   4.861 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG NE   . . rr_1skl 1 
        1 .  121 . 1 1 5 ARG NH1  N  3.373 -4.233   4.724 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG NH1  . . rr_1skl 1 
        1 .  122 . 1 1 5 ARG NH2  N  1.537 -4.518   6.095 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG NH2  . . rr_1skl 1 
        1 .  123 . 1 1 5 ARG O    O  3.998 -0.915   1.281 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG O    . . rr_1skl 1 
        1 .  124 . 1 1 6 PHE C    C  2.133  0.583  -2.184 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE C    . . rr_1skl 1 
        1 .  125 . 1 1 6 PHE CA   C  2.275 -0.417  -1.012 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CA   . . rr_1skl 1 
        1 .  126 . 1 1 6 PHE CB   C  1.035 -1.342  -1.011 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CB   . . rr_1skl 1 
        1 .  127 . 1 1 6 PHE CD1  C  1.673 -3.227   0.562 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CD1  . . rr_1skl 1 
        1 .  128 . 1 1 6 PHE CD2  C -0.422 -2.043   0.941 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CD2  . . rr_1skl 1 
        1 .  129 . 1 1 6 PHE CE1  C  1.377 -4.085   1.635 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CE1  . . rr_1skl 1 
        1 .  130 . 1 1 6 PHE CE2  C -0.714 -2.898   2.017 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CE2  . . rr_1skl 1 
        1 .  131 . 1 1 6 PHE CG   C  0.775 -2.201   0.212 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CG   . . rr_1skl 1 
        1 .  132 . 1 1 6 PHE CZ   C  0.183 -3.924   2.359 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CZ   . . rr_1skl 1 
        1 .  133 . 1 1 6 PHE H    H  1.730  1.040   0.411 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE H    . . rr_1skl 1 
        1 .  134 . 1 1 6 PHE HA   H  3.168 -1.029  -1.181 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HA   . . rr_1skl 1 
        1 .  135 . 1 1 6 PHE HB2  H  0.154 -0.718  -1.176 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HB2  . . rr_1skl 1 
        1 .  136 . 1 1 6 PHE HB3  H  1.117 -2.022  -1.859 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HB3  . . rr_1skl 1 
        1 .  137 . 1 1 6 PHE HD1  H  2.582 -3.369  -0.005 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HD1  . . rr_1skl 1 
        1 .  138 . 1 1 6 PHE HD2  H -1.130 -1.275   0.669 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HD2  . . rr_1skl 1 
        1 .  139 . 1 1 6 PHE HE1  H  2.066 -4.874   1.899 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HE1  . . rr_1skl 1 
        1 .  140 . 1 1 6 PHE HE2  H -1.632 -2.772   2.572 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HE2  . . rr_1skl 1 
        1 .  141 . 1 1 6 PHE HZ   H -0.042 -4.586   3.184 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HZ   . . rr_1skl 1 
        1 .  142 . 1 1 6 PHE N    N  2.403  0.291   0.248 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE N    . . rr_1skl 1 
        1 .  143 . 1 1 6 PHE O    O  2.132  1.796  -1.980 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE O    . . rr_1skl 1 
        2 .  144 . 1 1 1 ARG C    C  0.309  1.098  -4.698 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG C    . . rr_1skl 1 
        2 .  145 . 1 1 1 ARG CA   C  1.809  0.757  -4.579 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG CA   . . rr_1skl 1 
        2 .  146 . 1 1 1 ARG CB   C  2.379  0.085  -5.846 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG CB   . . rr_1skl 1 
        2 .  147 . 1 1 1 ARG CD   C  4.792  0.989  -5.582 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG CD   . . rr_1skl 1 
        2 .  148 . 1 1 1 ARG CG   C  3.885 -0.235  -5.779 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG CG   . . rr_1skl 1 
        2 .  149 . 1 1 1 ARG CZ   C  4.341  3.161  -6.782 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG CZ   . . rr_1skl 1 
        2 .  150 . 1 1 1 ARG HA   H  2.340  1.694  -4.419 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HA   . . rr_1skl 1 
        2 .  151 . 1 1 1 ARG HB2  H  1.840 -0.847  -6.024 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HB2  . . rr_1skl 1 
        2 .  152 . 1 1 1 ARG HB3  H  2.203  0.740  -6.702 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HB3  . . rr_1skl 1 
        2 .  153 . 1 1 1 ARG HD2  H  4.508  1.519  -4.673 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HD2  . . rr_1skl 1 
        2 .  154 . 1 1 1 ARG HD3  H  5.816  0.637  -5.451 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HD3  . . rr_1skl 1 
        2 .  155 . 1 1 1 ARG HE   H  5.122  1.494  -7.612 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HE   . . rr_1skl 1 
        2 .  156 . 1 1 1 ARG HG2  H  4.068 -0.934  -4.962 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HG2  . . rr_1skl 1 
        2 .  157 . 1 1 1 ARG HG3  H  4.174 -0.735  -6.705 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HG3  . . rr_1skl 1 
        2 .  158 . 1 1 1 ARG HH11 H  3.800  3.287  -4.817 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HH11 . . rr_1skl 1 
        2 .  159 . 1 1 1 ARG HH12 H  3.545  4.738  -5.759 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HH12 . . rr_1skl 1 
        2 .  160 . 1 1 1 ARG HH21 H  4.778  3.389  -8.761 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HH21 . . rr_1skl 1 
        2 .  161 . 1 1 1 ARG HH22 H  4.097  4.796  -7.977 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HH22 . . rr_1skl 1 
        2 .  162 . 1 1 1 ARG N    N  2.029 -0.111  -3.423 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG N    . . rr_1skl 1 
        2 .  163 . 1 1 1 ARG NE   N  4.768  1.886  -6.751 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG NE   . . rr_1skl 1 
        2 .  164 . 1 1 1 ARG NH1  N  3.853  3.778  -5.697 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG NH1  . . rr_1skl 1 
        2 .  165 . 1 1 1 ARG NH2  N  4.408  3.837  -7.934 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG NH2  . . rr_1skl 1 
        2 .  166 . 1 1 1 ARG O    O -0.279  0.953  -5.771 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG O    . . rr_1skl 1 
        2 .  167 . 1 1 2 ARG C    C -2.079  3.014  -2.750 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG C    . . rr_1skl 1 
        2 .  168 . 1 1 2 ARG CA   C -1.759  1.686  -3.449 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG CA   . . rr_1skl 1 
        2 .  169 . 1 1 2 ARG CB   C -2.398  0.500  -2.704 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG CB   . . rr_1skl 1 
        2 .  170 . 1 1 2 ARG CD   C -2.722 -1.911  -2.282 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG CD   . . rr_1skl 1 
        2 .  171 . 1 1 2 ARG CG   C -2.103 -0.898  -3.252 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG CG   . . rr_1skl 1 
        2 .  172 . 1 1 2 ARG CZ   C -3.394 -3.985  -3.517 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG CZ   . . rr_1skl 1 
        2 .  173 . 1 1 2 ARG H    H  0.222  1.612  -2.734 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG H    . . rr_1skl 1 
        2 .  174 . 1 1 2 ARG HA   H -2.218  1.725  -4.431 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HA   . . rr_1skl 1 
        2 .  175 . 1 1 2 ARG HB2  H -2.099  0.533  -1.655 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HB2  . . rr_1skl 1 
        2 .  176 . 1 1 2 ARG HB3  H -3.476  0.606  -2.777 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HB3  . . rr_1skl 1 
        2 .  177 . 1 1 2 ARG HD2  H -2.242 -1.818  -1.307 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HD2  . . rr_1skl 1 
        2 .  178 . 1 1 2 ARG HD3  H -3.783 -1.703  -2.153 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HD3  . . rr_1skl 1 
        2 .  179 . 1 1 2 ARG HE   H -1.667 -3.716  -2.491 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HE   . . rr_1skl 1 
        2 .  180 . 1 1 2 ARG HG2  H -2.550 -1.003  -4.241 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HG2  . . rr_1skl 1 
        2 .  181 . 1 1 2 ARG HG3  H -1.031 -1.072  -3.322 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HG3  . . rr_1skl 1 
        2 .  182 . 1 1 2 ARG HH11 H -4.799 -2.515  -3.692 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HH11 . . rr_1skl 1 
        2 .  183 . 1 1 2 ARG HH12 H -5.177 -4.012  -4.514 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HH12 . . rr_1skl 1 
        2 .  184 . 1 1 2 ARG HH21 H -2.217 -5.651  -3.548 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HH21 . . rr_1skl 1 
        2 .  185 . 1 1 2 ARG HH22 H -3.720 -5.778  -4.432 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HH22 . . rr_1skl 1 
        2 .  186 . 1 1 2 ARG N    N -0.319  1.502  -3.577 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG N    . . rr_1skl 1 
        2 .  187 . 1 1 2 ARG NE   N -2.534 -3.283  -2.758 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG NE   . . rr_1skl 1 
        2 .  188 . 1 1 2 ARG NH1  N -4.553 -3.462  -3.941 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG NH1  . . rr_1skl 1 
        2 .  189 . 1 1 2 ARG NH2  N -3.084 -5.240  -3.862 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG NH2  . . rr_1skl 1 
        2 .  190 . 1 1 2 ARG O    O -2.675  3.881  -3.388 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG O    . . rr_1skl 1 
        2 .  191 . 1 1 3 NAL C1   C -3.956  1.896   0.340 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C1   . . rr_1skl 1 
        2 .  192 . 1 1 3 NAL C10  C -2.149  4.301  -0.629 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C10  . . rr_1skl 1 
        2 .  193 . 1 1 3 NAL C11  C -1.504  4.362   0.774 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C11  . . rr_1skl 1 
        2 .  194 . 1 1 3 NAL C2   C -4.382  2.925  -0.523 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C2   . . rr_1skl 1 
        2 .  195 . 1 1 3 NAL C3   C -5.424  2.673  -1.438 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C3   . . rr_1skl 1 
        2 .  196 . 1 1 3 NAL C4   C -6.023  1.403  -1.502 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C4   . . rr_1skl 1 
        2 .  197 . 1 1 3 NAL C4A  C -5.577  0.369  -0.659 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C4A  . . rr_1skl 1 
        2 .  198 . 1 1 3 NAL C5   C -6.153 -0.913  -0.739 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C5   . . rr_1skl 1 
        2 .  199 . 1 1 3 NAL C6   C -5.690 -1.947   0.094 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C6   . . rr_1skl 1 
        2 .  200 . 1 1 3 NAL C7   C -4.652 -1.701   1.010 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C7   . . rr_1skl 1 
        2 .  201 . 1 1 3 NAL C8   C -4.078 -0.421   1.098 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C8   . . rr_1skl 1 
        2 .  202 . 1 1 3 NAL C8A  C -4.538  0.617   0.266 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C8A  . . rr_1skl 1 
        2 .  203 . 1 1 3 NAL C9   C -3.699  4.290  -0.510 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C9   . . rr_1skl 1 
        2 .  204 . 1 1 3 NAL H1   H -3.159  2.081   1.040 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H1   . . rr_1skl 1 
        2 .  205 . 1 1 3 NAL H10  H -1.862  5.221  -1.139 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H10  . . rr_1skl 1 
        2 .  206 . 1 1 3 NAL H3   H -5.761  3.451  -2.107 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H3   . . rr_1skl 1 
        2 .  207 . 1 1 3 NAL H4   H -6.816  1.223  -2.213 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H4   . . rr_1skl 1 
        2 .  208 . 1 1 3 NAL H5   H -6.949 -1.109  -1.443 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H5   . . rr_1skl 1 
        2 .  209 . 1 1 3 NAL H6   H -6.132 -2.930   0.029 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H6   . . rr_1skl 1 
        2 .  210 . 1 1 3 NAL H7   H -4.298 -2.497   1.649 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H7   . . rr_1skl 1 
        2 .  211 . 1 1 3 NAL H8   H -3.281 -0.239   1.806 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H8   . . rr_1skl 1 
        2 .  212 . 1 1 3 NAL H91  H -4.017  4.822   0.386 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H91  . . rr_1skl 1 
        2 .  213 . 1 1 3 NAL H92  H -4.089  4.868  -1.349 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H92  . . rr_1skl 1 
        2 .  214 . 1 1 3 NAL HN1  H -1.195  2.437  -1.006 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL HN1  . . rr_1skl 1 
        2 .  215 . 1 1 3 NAL N    N -1.702  3.177  -1.466 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL N    . . rr_1skl 1 
        2 .  216 . 1 1 3 NAL O2   O -1.837  5.279   1.526 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL O2   . . rr_1skl 1 
        2 .  217 . 1 1 4 NAL C1   C -0.480  0.420   4.863 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C1   . . rr_1skl 1 
        2 .  218 . 1 1 4 NAL C10  C -0.136  3.306   2.539 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C10  . . rr_1skl 1 
        2 .  219 . 1 1 4 NAL C11  C  1.338  2.897   2.634 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C11  . . rr_1skl 1 
        2 .  220 . 1 1 4 NAL C2   C -0.555  1.803   4.606 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C2   . . rr_1skl 1 
        2 .  221 . 1 1 4 NAL C3   C -0.184  2.723   5.606 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C3   . . rr_1skl 1 
        2 .  222 . 1 1 4 NAL C4   C  0.272  2.263   6.853 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C4   . . rr_1skl 1 
        2 .  223 . 1 1 4 NAL C4A  C  0.328  0.882   7.119 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C4A  . . rr_1skl 1 
        2 .  224 . 1 1 4 NAL C5   C  0.763  0.420   8.375 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C5   . . rr_1skl 1 
        2 .  225 . 1 1 4 NAL C6   C  0.791 -0.958   8.647 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C6   . . rr_1skl 1 
        2 .  226 . 1 1 4 NAL C7   C  0.377 -1.878   7.667 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C7   . . rr_1skl 1 
        2 .  227 . 1 1 4 NAL C8   C -0.049 -1.423   6.406 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C8   . . rr_1skl 1 
        2 .  228 . 1 1 4 NAL C8A  C -0.064 -0.043   6.125 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C8A  . . rr_1skl 1 
        2 .  229 . 1 1 4 NAL C9   C -1.045  2.292   3.254 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C9   . . rr_1skl 1 
        2 .  230 . 1 1 4 NAL H1   H -0.749 -0.285   4.089 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H1   . . rr_1skl 1 
        2 .  231 . 1 1 4 NAL H10  H -0.222  4.268   3.052 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H10  . . rr_1skl 1 
        2 .  232 . 1 1 4 NAL H3   H -0.239  3.785   5.418 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H3   . . rr_1skl 1 
        2 .  233 . 1 1 4 NAL H4   H  0.564  2.976   7.610 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H4   . . rr_1skl 1 
        2 .  234 . 1 1 4 NAL H5   H  1.071  1.122   9.137 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H5   . . rr_1skl 1 
        2 .  235 . 1 1 4 NAL H6   H  1.121 -1.311   9.613 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H6   . . rr_1skl 1 
        2 .  236 . 1 1 4 NAL H7   H  0.384 -2.935   7.887 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H7   . . rr_1skl 1 
        2 .  237 . 1 1 4 NAL H8   H -0.374 -2.136   5.660 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H8   . . rr_1skl 1 
        2 .  238 . 1 1 4 NAL H91  H -2.030  2.739   3.386 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H91  . . rr_1skl 1 
        2 .  239 . 1 1 4 NAL H92  H -1.169  1.425   2.602 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H92  . . rr_1skl 1 
        2 .  240 . 1 1 4 NAL HN1  H -0.330  2.713   0.499 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL HN1  . . rr_1skl 1 
        2 .  241 . 1 1 4 NAL N    N -0.607  3.431   1.153 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL N    . . rr_1skl 1 
        2 .  242 . 1 1 4 NAL O2   O  2.140  3.674   3.151 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL O2   . . rr_1skl 1 
        2 .  243 . 1 1 5 ARG C    C  3.296  0.413   0.770 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG C    . . rr_1skl 1 
        2 .  244 . 1 1 5 ARG CA   C  3.083  1.243   2.044 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG CA   . . rr_1skl 1 
        2 .  245 . 1 1 5 ARG CB   C  3.527  0.543   3.355 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG CB   . . rr_1skl 1 
        2 .  246 . 1 1 5 ARG CD   C  2.613 -1.845   3.052 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG CD   . . rr_1skl 1 
        2 .  247 . 1 1 5 ARG CG   C  3.845 -0.962   3.291 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG CG   . . rr_1skl 1 
        2 .  248 . 1 1 5 ARG CZ   C  2.611 -3.712   4.723 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG CZ   . . rr_1skl 1 
        2 .  249 . 1 1 5 ARG H    H  0.984  1.109   1.740 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG H    . . rr_1skl 1 
        2 .  250 . 1 1 5 ARG HA   H  3.703  2.131   1.938 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HA   . . rr_1skl 1 
        2 .  251 . 1 1 5 ARG HB2  H  4.439  1.042   3.686 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HB2  . . rr_1skl 1 
        2 .  252 . 1 1 5 ARG HB3  H  2.783  0.709   4.137 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HB3  . . rr_1skl 1 
        2 .  253 . 1 1 5 ARG HD2  H  1.790 -1.240   2.675 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HD2  . . rr_1skl 1 
        2 .  254 . 1 1 5 ARG HD3  H  2.857 -2.592   2.295 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HD3  . . rr_1skl 1 
        2 .  255 . 1 1 5 ARG HE   H  1.492 -2.028   4.844 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HE   . . rr_1skl 1 
        2 .  256 . 1 1 5 ARG HG2  H  4.574 -1.146   2.502 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HG2  . . rr_1skl 1 
        2 .  257 . 1 1 5 ARG HG3  H  4.322 -1.254   4.228 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HG3  . . rr_1skl 1 
        2 .  258 . 1 1 5 ARG HH11 H  3.900 -4.068   3.181 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HH11 . . rr_1skl 1 
        2 .  259 . 1 1 5 ARG HH12 H  3.835 -5.315   4.405 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HH12 . . rr_1skl 1 
        2 .  260 . 1 1 5 ARG HH21 H  1.447 -3.676   6.396 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HH21 . . rr_1skl 1 
        2 .  261 . 1 1 5 ARG HH22 H  2.452 -5.095   6.214 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HH22 . . rr_1skl 1 
        2 .  262 . 1 1 5 ARG N    N  1.696  1.706   2.134 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG N    . . rr_1skl 1 
        2 .  263 . 1 1 5 ARG NE   N  2.173 -2.519   4.282 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG NE   . . rr_1skl 1 
        2 .  264 . 1 1 5 ARG NH1  N  3.522 -4.425   4.046 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG NH1  . . rr_1skl 1 
        2 .  265 . 1 1 5 ARG NH2  N  2.128 -4.203   5.869 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG NH2  . . rr_1skl 1 
        2 .  266 . 1 1 5 ARG O    O  4.416  0.334   0.267 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG O    . . rr_1skl 1 
        2 .  267 . 1 1 6 PHE C    C  2.156  0.316  -2.163 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE C    . . rr_1skl 1 
        2 .  268 . 1 1 6 PHE CA   C  2.136 -0.774  -1.078 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CA   . . rr_1skl 1 
        2 .  269 . 1 1 6 PHE CB   C  0.832 -1.588  -1.152 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CB   . . rr_1skl 1 
        2 .  270 . 1 1 6 PHE CD1  C  1.299 -3.768   0.060 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CD1  . . rr_1skl 1 
        2 .  271 . 1 1 6 PHE CD2  C -0.344 -2.236   1.002 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CD2  . . rr_1skl 1 
        2 .  272 . 1 1 6 PHE CE1  C  1.071 -4.662   1.121 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CE1  . . rr_1skl 1 
        2 .  273 . 1 1 6 PHE CE2  C -0.571 -3.131   2.062 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CE2  . . rr_1skl 1 
        2 .  274 . 1 1 6 PHE CG   C  0.592 -2.552  -0.003 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CG   . . rr_1skl 1 
        2 .  275 . 1 1 6 PHE CZ   C  0.136 -4.345   2.121 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CZ   . . rr_1skl 1 
        2 .  276 . 1 1 6 PHE H    H  1.329 -0.063   0.716 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE H    . . rr_1skl 1 
        2 .  277 . 1 1 6 PHE HA   H  2.986 -1.445  -1.214 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HA   . . rr_1skl 1 
        2 .  278 . 1 1 6 PHE HB2  H  0.000 -0.885  -1.188 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HB2  . . rr_1skl 1 
        2 .  279 . 1 1 6 PHE HB3  H  0.826 -2.162  -2.080 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HB3  . . rr_1skl 1 
        2 .  280 . 1 1 6 PHE HD1  H  2.018 -4.018  -0.707 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HD1  . . rr_1skl 1 
        2 .  281 . 1 1 6 PHE HD2  H -0.891 -1.305   0.965 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HD2  . . rr_1skl 1 
        2 .  282 . 1 1 6 PHE HE1  H  1.615 -5.594   1.167 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HE1  . . rr_1skl 1 
        2 .  283 . 1 1 6 PHE HE2  H -1.288 -2.886   2.833 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HE2  . . rr_1skl 1 
        2 .  284 . 1 1 6 PHE HZ   H -0.037 -5.032   2.936 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HZ   . . rr_1skl 1 
        2 .  285 . 1 1 6 PHE N    N  2.207 -0.153   0.230 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE N    . . rr_1skl 1 
        2 .  286 . 1 1 6 PHE O    O  2.232  1.513  -1.874 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE O    . . rr_1skl 1 
        3 .  287 . 1 1 1 ARG C    C  0.365  1.767  -4.274 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG C    . . rr_1skl 1 
        3 .  288 . 1 1 1 ARG CA   C  1.714  1.028  -4.385 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG CA   . . rr_1skl 1 
        3 .  289 . 1 1 1 ARG CB   C  1.813  0.211  -5.692 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG CB   . . rr_1skl 1 
        3 .  290 . 1 1 1 ARG CD   C  0.083  0.882  -7.460 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG CD   . . rr_1skl 1 
        3 .  291 . 1 1 1 ARG CG   C  1.545  0.992  -6.995 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG CG   . . rr_1skl 1 
        3 .  292 . 1 1 1 ARG CZ   C -0.761  2.877  -8.740 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG CZ   . . rr_1skl 1 
        3 .  293 . 1 1 1 ARG HA   H  2.512  1.773  -4.391 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HA   . . rr_1skl 1 
        3 .  294 . 1 1 1 ARG HB2  H  2.828 -0.185  -5.750 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HB2  . . rr_1skl 1 
        3 .  295 . 1 1 1 ARG HB3  H  1.134 -0.642  -5.642 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HB3  . . rr_1skl 1 
        3 .  296 . 1 1 1 ARG HD2  H -0.134 -0.163  -7.683 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HD2  . . rr_1skl 1 
        3 .  297 . 1 1 1 ARG HD3  H -0.593  1.198  -6.668 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HD3  . . rr_1skl 1 
        3 .  298 . 1 1 1 ARG HE   H  0.130  1.252  -9.547 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HE   . . rr_1skl 1 
        3 .  299 . 1 1 1 ARG HG2  H  1.822  2.039  -6.866 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HG2  . . rr_1skl 1 
        3 .  300 . 1 1 1 ARG HG3  H  2.175  0.574  -7.781 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HG3  . . rr_1skl 1 
        3 .  301 . 1 1 1 ARG HH11 H -1.039  3.114  -6.730 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HH11 . . rr_1skl 1 
        3 .  302 . 1 1 1 ARG HH12 H -1.625  4.425  -7.727 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HH12 . . rr_1skl 1 
        3 .  303 . 1 1 1 ARG HH21 H -0.639  2.978 -10.774 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HH21 . . rr_1skl 1 
        3 .  304 . 1 1 1 ARG HH22 H -1.393  4.352  -9.999 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HH22 . . rr_1skl 1 
        3 .  305 . 1 1 1 ARG N    N  1.929  0.108  -3.257 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG N    . . rr_1skl 1 
        3 .  306 . 1 1 1 ARG NE   N -0.164  1.672  -8.677 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG NE   . . rr_1skl 1 
        3 .  307 . 1 1 1 ARG NH1  N -1.179  3.524  -7.642 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG NH1  . . rr_1skl 1 
        3 .  308 . 1 1 1 ARG NH2  N -0.945  3.449  -9.935 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG NH2  . . rr_1skl 1 
        3 .  309 . 1 1 1 ARG O    O  0.214  2.852  -4.834 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG O    . . rr_1skl 1 
        3 .  310 . 1 1 2 ARG C    C -2.229  2.980  -2.930 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG C    . . rr_1skl 1 
        3 .  311 . 1 1 2 ARG CA   C -2.005  1.578  -3.524 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG CA   . . rr_1skl 1 
        3 .  312 . 1 1 2 ARG CB   C -2.823  0.507  -2.775 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG CB   . . rr_1skl 1 
        3 .  313 . 1 1 2 ARG CD   C -3.253 -1.936  -2.300 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG CD   . . rr_1skl 1 
        3 .  314 . 1 1 2 ARG CG   C -2.624 -0.935  -3.277 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG CG   . . rr_1skl 1 
        3 .  315 . 1 1 2 ARG CZ   C -2.429 -4.284  -2.660 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG CZ   . . rr_1skl 1 
        3 .  316 . 1 1 2 ARG H    H -0.382  0.310  -3.092 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG H    . . rr_1skl 1 
        3 .  317 . 1 1 2 ARG HA   H -2.377  1.600  -4.544 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HA   . . rr_1skl 1 
        3 .  318 . 1 1 2 ARG HB2  H -2.573  0.546  -1.714 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HB2  . . rr_1skl 1 
        3 .  319 . 1 1 2 ARG HB3  H -3.879  0.743  -2.911 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HB3  . . rr_1skl 1 
        3 .  320 . 1 1 2 ARG HD2  H -2.681 -1.945  -1.371 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HD2  . . rr_1skl 1 
        3 .  321 . 1 1 2 ARG HD3  H -4.267 -1.622  -2.060 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HD3  . . rr_1skl 1 
        3 .  322 . 1 1 2 ARG HE   H -4.061 -3.463  -3.525 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HE   . . rr_1skl 1 
        3 .  323 . 1 1 2 ARG HG2  H -3.090 -1.033  -4.258 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HG2  . . rr_1skl 1 
        3 .  324 . 1 1 2 ARG HG3  H -1.566 -1.179  -3.367 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HG3  . . rr_1skl 1 
        3 .  325 . 1 1 2 ARG HH11 H -1.256 -3.281  -1.324 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HH11 . . rr_1skl 1 
        3 .  326 . 1 1 2 ARG HH12 H -0.759 -4.921  -1.675 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HH12 . . rr_1skl 1 
        3 .  327 . 1 1 2 ARG HH21 H -3.370 -5.566  -3.938 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HH21 . . rr_1skl 1 
        3 .  328 . 1 1 2 ARG HH22 H -1.951 -6.207  -3.144 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HH22 . . rr_1skl 1 
        3 .  329 . 1 1 2 ARG N    N -0.604  1.178  -3.557 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG N    . . rr_1skl 1 
        3 .  330 . 1 1 2 ARG NE   N -3.303 -3.286  -2.882 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG NE   . . rr_1skl 1 
        3 .  331 . 1 1 2 ARG NH1  N -1.394 -4.150  -1.820 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG NH1  . . rr_1skl 1 
        3 .  332 . 1 1 2 ARG NH2  N -2.597 -5.447  -3.299 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG NH2  . . rr_1skl 1 
        3 .  333 . 1 1 2 ARG O    O -2.755  3.845  -3.628 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG O    . . rr_1skl 1 
        3 .  334 . 1 1 3 NAL C1   C -4.231  2.228   0.155 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C1   . . rr_1skl 1 
        3 .  335 . 1 1 3 NAL C10  C -2.166  4.370  -0.842 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C10  . . rr_1skl 1 
        3 .  336 . 1 1 3 NAL C11  C -1.509  4.286   0.558 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C11  . . rr_1skl 1 
        3 .  337 . 1 1 3 NAL C2   C -4.533  3.264  -0.725 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C2   . . rr_1skl 1 
        3 .  338 . 1 1 3 NAL C3   C -5.599  3.093  -1.664 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C3   . . rr_1skl 1 
        3 .  339 . 1 1 3 NAL C4   C -6.309  1.895  -1.704 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C4   . . rr_1skl 1 
        3 .  340 . 1 1 3 NAL C4A  C -5.971  0.840  -0.826 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C4A  . . rr_1skl 1 
        3 .  341 . 1 1 3 NAL C5   C -6.670 -0.396  -0.897 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C5   . . rr_1skl 1 
        3 .  342 . 1 1 3 NAL C6   C -6.322 -1.441  -0.047 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C6   . . rr_1skl 1 
        3 .  343 . 1 1 3 NAL C7   C -5.268 -1.269   0.896 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C7   . . rr_1skl 1 
        3 .  344 . 1 1 3 NAL C8   C -4.590 -0.060   0.969 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C8   . . rr_1skl 1 
        3 .  345 . 1 1 3 NAL C8A  C -4.943  1.007   0.097 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C8A  . . rr_1skl 1 
        3 .  346 . 1 1 3 NAL C9   C -3.709  4.547  -0.758 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C9   . . rr_1skl 1 
        3 .  347 . 1 1 3 NAL H1   H -3.421  2.343   0.862 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H1   . . rr_1skl 1 
        3 .  348 . 1 1 3 NAL H10  H -1.750  5.247  -1.340 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H10  . . rr_1skl 1 
        3 .  349 . 1 1 3 NAL H3   H -5.839  3.886  -2.351 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H3   . . rr_1skl 1 
        3 .  350 . 1 1 3 NAL H4   H -7.107  1.770  -2.425 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H4   . . rr_1skl 1 
        3 .  351 . 1 1 3 NAL H5   H -7.467 -0.526  -1.616 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H5   . . rr_1skl 1 
        3 .  352 . 1 1 3 NAL H6   H -6.842 -2.385  -0.096 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H6   . . rr_1skl 1 
        3 .  353 . 1 1 3 NAL H7   H -5.006 -2.088   1.549 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H7   . . rr_1skl 1 
        3 .  354 . 1 1 3 NAL H8   H -3.791  0.075   1.684 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H8   . . rr_1skl 1 
        3 .  355 . 1 1 3 NAL H91  H -3.976  5.152   0.109 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H91  . . rr_1skl 1 
        3 .  356 . 1 1 3 NAL H92  H -4.011  5.127  -1.627 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H92  . . rr_1skl 1 
        3 .  357 . 1 1 3 NAL HN1  H -1.401  2.434  -1.166 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL HN1  . . rr_1skl 1 
        3 .  358 . 1 1 3 NAL N    N -1.844  3.191  -1.660 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL N    . . rr_1skl 1 
        3 .  359 . 1 1 3 NAL O2   O -1.898  5.018   1.470 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL O2   . . rr_1skl 1 
        3 .  360 . 1 1 4 NAL C1   C  0.024  0.069   4.167 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C1   . . rr_1skl 1 
        3 .  361 . 1 1 4 NAL C10  C  0.058  2.997   2.033 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C10  . . rr_1skl 1 
        3 .  362 . 1 1 4 NAL C11  C  1.522  2.564   1.789 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C11  . . rr_1skl 1 
        3 .  363 . 1 1 4 NAL C2   C -0.491  1.368   3.999 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C2   . . rr_1skl 1 
        3 .  364 . 1 1 4 NAL C3   C -0.661  2.199   5.125 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C3   . . rr_1skl 1 
        3 .  365 . 1 1 4 NAL C4   C -0.324  1.730   6.403 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C4   . . rr_1skl 1 
        3 .  366 . 1 1 4 NAL C4A  C  0.198  0.430   6.566 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C4A  . . rr_1skl 1 
        3 .  367 . 1 1 4 NAL C5   C  0.561 -0.041   7.845 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C5   . . rr_1skl 1 
        3 .  368 . 1 1 4 NAL C6   C  1.100 -1.326   7.996 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C6   . . rr_1skl 1 
        3 .  369 . 1 1 4 NAL C7   C  1.287 -2.152   6.869 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C7   . . rr_1skl 1 
        3 .  370 . 1 1 4 NAL C8   C  0.928 -1.689   5.595 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C8   . . rr_1skl 1 
        3 .  371 . 1 1 4 NAL C8A  C  0.378 -0.399   5.443 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C8A  . . rr_1skl 1 
        3 .  372 . 1 1 4 NAL C9   C -0.837  1.878   2.611 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C9   . . rr_1skl 1 
        3 .  373 . 1 1 4 NAL H1   H  0.187 -0.559   3.306 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H1   . . rr_1skl 1 
        3 .  374 . 1 1 4 NAL H10  H  0.059  3.847   2.717 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H10  . . rr_1skl 1 
        3 .  375 . 1 1 4 NAL H3   H -1.043  3.201   4.999 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H3   . . rr_1skl 1 
        3 .  376 . 1 1 4 NAL H4   H -0.458  2.374   7.261 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H4   . . rr_1skl 1 
        3 .  377 . 1 1 4 NAL H5   H  0.428  0.589   8.712 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H5   . . rr_1skl 1 
        3 .  378 . 1 1 4 NAL H6   H  1.378 -1.685   8.976 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H6   . . rr_1skl 1 
        3 .  379 . 1 1 4 NAL H7   H  1.708 -3.139   6.988 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H7   . . rr_1skl 1 
        3 .  380 . 1 1 4 NAL H8   H  1.085 -2.323   4.733 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H8   . . rr_1skl 1 
        3 .  381 . 1 1 4 NAL H91  H -1.863  2.245   2.654 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H91  . . rr_1skl 1 
        3 .  382 . 1 1 4 NAL H92  H -0.830  1.040   1.913 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H92  . . rr_1skl 1 
        3 .  383 . 1 1 4 NAL HN1  H -0.233  2.841  -0.054 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL HN1  . . rr_1skl 1 
        3 .  384 . 1 1 4 NAL N    N -0.534  3.379   0.746 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL N    . . rr_1skl 1 
        3 .  385 . 1 1 4 NAL O2   O  2.140  3.029   0.833 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL O2   . . rr_1skl 1 
        3 .  386 . 1 1 5 ARG C    C  3.337  0.107   1.126 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG C    . . rr_1skl 1 
        3 .  387 . 1 1 5 ARG CA   C  3.370  0.998   2.411 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG CA   . . rr_1skl 1 
        3 .  388 . 1 1 5 ARG CB   C  3.827  0.187   3.657 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG CB   . . rr_1skl 1 
        3 .  389 . 1 1 5 ARG CD   C  3.486  2.114   5.338 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG CD   . . rr_1skl 1 
        3 .  390 . 1 1 5 ARG CG   C  4.434  1.043   4.787 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG CG   . . rr_1skl 1 
        3 .  391 . 1 1 5 ARG CZ   C  4.058  4.214   6.587 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG CZ   . . rr_1skl 1 
        3 .  392 . 1 1 5 ARG H    H  1.610  1.506   3.518 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG H    . . rr_1skl 1 
        3 .  393 . 1 1 5 ARG HA   H  4.120  1.766   2.226 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HA   . . rr_1skl 1 
        3 .  394 . 1 1 5 ARG HB2  H  3.010 -0.413   4.062 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HB2  . . rr_1skl 1 
        3 .  395 . 1 1 5 ARG HB3  H  4.608 -0.527   3.377 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HB3  . . rr_1skl 1 
        3 .  396 . 1 1 5 ARG HD2  H  3.230  2.799   4.534 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HD2  . . rr_1skl 1 
        3 .  397 . 1 1 5 ARG HD3  H  2.578  1.632   5.699 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HD3  . . rr_1skl 1 
        3 .  398 . 1 1 5 ARG HE   H  4.592  2.338   7.134 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HE   . . rr_1skl 1 
        3 .  399 . 1 1 5 ARG HG2  H  4.725  0.377   5.602 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HG2  . . rr_1skl 1 
        3 .  400 . 1 1 5 ARG HG3  H  5.339  1.526   4.414 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HG3  . . rr_1skl 1 
        3 .  401 . 1 1 5 ARG HH11 H  2.963  4.615   4.910 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HH11 . . rr_1skl 1 
        3 .  402 . 1 1 5 ARG HH12 H  3.421  6.012   5.856 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HH12 . . rr_1skl 1 
        3 .  403 . 1 1 5 ARG HH21 H  5.151  4.188   8.309 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HH21 . . rr_1skl 1 
        3 .  404 . 1 1 5 ARG HH22 H  4.649  5.771   7.762 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HH22 . . rr_1skl 1 
        3 .  405 . 1 1 5 ARG N    N  2.092  1.693   2.643 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG N    . . rr_1skl 1 
        3 .  406 . 1 1 5 ARG NE   N  4.099  2.876   6.437 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG NE   . . rr_1skl 1 
        3 .  407 . 1 1 5 ARG NH1  N  3.426  5.012   5.714 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG NH1  . . rr_1skl 1 
        3 .  408 . 1 1 5 ARG NH2  N  4.669  4.769   7.640 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG NH2  . . rr_1skl 1 
        3 .  409 . 1 1 5 ARG O    O  4.363 -0.463   0.780 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG O    . . rr_1skl 1 
        3 .  410 . 1 1 6 PHE C    C  2.086  0.503  -1.987 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE C    . . rr_1skl 1 
        3 .  411 . 1 1 6 PHE CA   C  2.039 -0.593  -0.898 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CA   . . rr_1skl 1 
        3 .  412 . 1 1 6 PHE CB   C  0.685 -1.329  -0.971 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CB   . . rr_1skl 1 
        3 .  413 . 1 1 6 PHE CD1  C  0.920 -2.958   0.991 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CD1  . . rr_1skl 1 
        3 .  414 . 1 1 6 PHE CD2  C -1.075 -1.575   0.823 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CD2  . . rr_1skl 1 
        3 .  415 . 1 1 6 PHE CE1  C  0.444 -3.503   2.184 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CE1  . . rr_1skl 1 
        3 .  416 . 1 1 6 PHE CE2  C -1.565 -2.139   2.026 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CE2  . . rr_1skl 1 
        3 .  417 . 1 1 6 PHE CG   C  0.162 -1.971   0.306 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CG   . . rr_1skl 1 
        3 .  418 . 1 1 6 PHE CZ   C -0.807 -3.080   2.715 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CZ   . . rr_1skl 1 
        3 .  419 . 1 1 6 PHE H    H  1.386  0.526   0.759 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE H    . . rr_1skl 1 
        3 .  420 . 1 1 6 PHE HA   H  2.841 -1.311  -1.063 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HA   . . rr_1skl 1 
        3 .  421 . 1 1 6 PHE HB2  H -0.073 -0.623  -1.317 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HB2  . . rr_1skl 1 
        3 .  422 . 1 1 6 PHE HB3  H  0.773 -2.113  -1.729 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HB3  . . rr_1skl 1 
        3 .  423 . 1 1 6 PHE HD1  H  1.876 -3.270   0.595 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HD1  . . rr_1skl 1 
        3 .  424 . 1 1 6 PHE HD2  H -1.665 -0.820   0.323 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HD2  . . rr_1skl 1 
        3 .  425 . 1 1 6 PHE HE1  H  1.028 -4.235   2.721 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HE1  . . rr_1skl 1 
        3 .  426 . 1 1 6 PHE HE2  H -2.514 -1.811   2.424 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HE2  . . rr_1skl 1 
        3 .  427 . 1 1 6 PHE HZ   H -1.156 -3.465   3.664 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HZ   . . rr_1skl 1 
        3 .  428 . 1 1 6 PHE N    N  2.195  0.032   0.427 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE N    . . rr_1skl 1 
        3 .  429 . 1 1 6 PHE O    O  2.207  1.692  -1.691 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE O    . . rr_1skl 1 
        4 .  430 . 1 1 1 ARG C    C  0.403  1.502  -4.576 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG C    . . rr_1skl 1 
        4 .  431 . 1 1 1 ARG CA   C  1.818  0.885  -4.489 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG CA   . . rr_1skl 1 
        4 .  432 . 1 1 1 ARG CB   C  2.232  0.174  -5.792 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG CB   . . rr_1skl 1 
        4 .  433 . 1 1 1 ARG CD   C  2.016 -1.764  -7.376 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG CD   . . rr_1skl 1 
        4 .  434 . 1 1 1 ARG CG   C  1.490 -1.143  -6.076 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG CG   . . rr_1skl 1 
        4 .  435 . 1 1 1 ARG CZ   C  2.275 -4.106  -8.218 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG CZ   . . rr_1skl 1 
        4 .  436 . 1 1 1 ARG HA   H  2.509  1.717  -4.347 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HA   . . rr_1skl 1 
        4 .  437 . 1 1 1 ARG HB2  H  2.088  0.854  -6.633 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HB2  . . rr_1skl 1 
        4 .  438 . 1 1 1 ARG HB3  H  3.300 -0.041  -5.728 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HB3  . . rr_1skl 1 
        4 .  439 . 1 1 1 ARG HD2  H  1.630 -1.203  -8.228 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HD2  . . rr_1skl 1 
        4 .  440 . 1 1 1 ARG HD3  H  3.104 -1.702  -7.378 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HD3  . . rr_1skl 1 
        4 .  441 . 1 1 1 ARG HE   H  0.816 -3.469  -6.964 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HE   . . rr_1skl 1 
        4 .  442 . 1 1 1 ARG HG2  H  1.667 -1.843  -5.259 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HG2  . . rr_1skl 1 
        4 .  443 . 1 1 1 ARG HG3  H  0.418 -0.962  -6.164 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HG3  . . rr_1skl 1 
        4 .  444 . 1 1 1 ARG HH11 H  3.669 -2.842  -9.011 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HH11 . . rr_1skl 1 
        4 .  445 . 1 1 1 ARG HH12 H  3.815 -4.516  -9.497 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HH12 . . rr_1skl 1 
        4 .  446 . 1 1 1 ARG HH21 H  1.059 -5.630  -7.617 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HH21 . . rr_1skl 1 
        4 .  447 . 1 1 1 ARG HH22 H  2.345 -6.083  -8.712 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HH22 . . rr_1skl 1 
        4 .  448 . 1 1 1 ARG N    N  2.004 -0.028  -3.358 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG N    . . rr_1skl 1 
        4 .  449 . 1 1 1 ARG NE   N  1.621 -3.176  -7.498 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG NE   . . rr_1skl 1 
        4 .  450 . 1 1 1 ARG NH1  N  3.341 -3.796  -8.969 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG NH1  . . rr_1skl 1 
        4 .  451 . 1 1 1 ARG NH2  N  1.856 -5.376  -8.182 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG NH2  . . rr_1skl 1 
        4 .  452 . 1 1 1 ARG O    O  0.114  2.201  -5.547 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG O    . . rr_1skl 1 
        4 .  453 . 1 1 2 ARG C    C -2.081  3.001  -2.837 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG C    . . rr_1skl 1 
        4 .  454 . 1 1 2 ARG CA   C -1.867  1.676  -3.586 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG CA   . . rr_1skl 1 
        4 .  455 . 1 1 2 ARG CB   C -2.758  0.589  -2.956 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG CB   . . rr_1skl 1 
        4 .  456 . 1 1 2 ARG CD   C -3.501 -1.793  -2.793 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG CD   . . rr_1skl 1 
        4 .  457 . 1 1 2 ARG CG   C -2.563 -0.824  -3.520 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG CG   . . rr_1skl 1 
        4 .  458 . 1 1 2 ARG CZ   C -3.660 -4.258  -2.437 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG CZ   . . rr_1skl 1 
        4 .  459 . 1 1 2 ARG H    H -0.180  0.661  -2.826 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG H    . . rr_1skl 1 
        4 .  460 . 1 1 2 ARG HA   H -2.195  1.808  -4.617 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HA   . . rr_1skl 1 
        4 .  461 . 1 1 2 ARG HB2  H -2.561  0.548  -1.884 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HB2  . . rr_1skl 1 
        4 .  462 . 1 1 2 ARG HB3  H -3.801  0.876  -3.109 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HB3  . . rr_1skl 1 
        4 .  463 . 1 1 2 ARG HD2  H -3.425 -1.624  -1.718 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HD2  . . rr_1skl 1 
        4 .  464 . 1 1 2 ARG HD3  H -4.529 -1.606  -3.106 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HD3  . . rr_1skl 1 
        4 .  465 . 1 1 2 ARG HE   H -2.437 -3.347  -3.771 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HE   . . rr_1skl 1 
        4 .  466 . 1 1 2 ARG HG2  H -2.781 -0.832  -4.589 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HG2  . . rr_1skl 1 
        4 .  467 . 1 1 2 ARG HG3  H -1.534 -1.145  -3.358 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HG3  . . rr_1skl 1 
        4 .  468 . 1 1 2 ARG HH11 H -4.980 -3.216  -1.279 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HH11 . . rr_1skl 1 
        4 .  469 . 1 1 2 ARG HH12 H -4.990 -4.950  -1.050 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HH12 . . rr_1skl 1 
        4 .  470 . 1 1 2 ARG HH21 H -2.474 -5.590  -3.426 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HH21 . . rr_1skl 1 
        4 .  471 . 1 1 2 ARG HH22 H -3.575 -6.288  -2.260 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HH22 . . rr_1skl 1 
        4 .  472 . 1 1 2 ARG N    N -0.471  1.253  -3.585 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG N    . . rr_1skl 1 
        4 .  473 . 1 1 2 ARG NE   N -3.147 -3.191  -3.071 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG NE   . . rr_1skl 1 
        4 .  474 . 1 1 2 ARG NH1  N -4.620 -4.131  -1.511 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG NH1  . . rr_1skl 1 
        4 .  475 . 1 1 2 ARG NH2  N -3.200 -5.478  -2.733 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG NH2  . . rr_1skl 1 
        4 .  476 . 1 1 2 ARG O    O -2.596  3.936  -3.449 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG O    . . rr_1skl 1 
        4 .  477 . 1 1 3 NAL C1   C -3.696  1.738   0.410 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C1   . . rr_1skl 1 
        4 .  478 . 1 1 3 NAL C10  C -2.129  4.206  -0.678 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C10  . . rr_1skl 1 
        4 .  479 . 1 1 3 NAL C11  C -1.443  4.322   0.705 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C11  . . rr_1skl 1 
        4 .  480 . 1 1 3 NAL C2   C -4.336  2.787  -0.281 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C2   . . rr_1skl 1 
        4 .  481 . 1 1 3 NAL C3   C -5.630  2.571  -0.794 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C3   . . rr_1skl 1 
        4 .  482 . 1 1 3 NAL C4   C -6.267  1.327  -0.634 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C4   . . rr_1skl 1 
        4 .  483 . 1 1 3 NAL C4A  C -5.614  0.280   0.040 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C4A  . . rr_1skl 1 
        4 .  484 . 1 1 3 NAL C5   C -6.241 -0.971   0.198 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C5   . . rr_1skl 1 
        4 .  485 . 1 1 3 NAL C6   C -5.578 -2.011   0.873 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C6   . . rr_1skl 1 
        4 .  486 . 1 1 3 NAL C7   C -4.284 -1.807   1.384 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C7   . . rr_1skl 1 
        4 .  487 . 1 1 3 NAL C8   C -3.657 -0.559   1.231 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C8   . . rr_1skl 1 
        4 .  488 . 1 1 3 NAL C8A  C -4.321  0.487   0.563 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C8A  . . rr_1skl 1 
        4 .  489 . 1 1 3 NAL C9   C -3.671  4.151  -0.491 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C9   . . rr_1skl 1 
        4 .  490 . 1 1 3 NAL H1   H -2.708  1.875   0.808 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H1   . . rr_1skl 1 
        4 .  491 . 1 1 3 NAL H10  H -1.894  5.129  -1.208 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H10  . . rr_1skl 1 
        4 .  492 . 1 1 3 NAL H3   H -6.144  3.364  -1.316 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H3   . . rr_1skl 1 
        4 .  493 . 1 1 3 NAL H4   H -7.261  1.182  -1.034 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H4   . . rr_1skl 1 
        4 .  494 . 1 1 3 NAL H5   H -7.235 -1.135  -0.194 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H5   . . rr_1skl 1 
        4 .  495 . 1 1 3 NAL H6   H -6.062 -2.968   0.998 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H6   . . rr_1skl 1 
        4 .  496 . 1 1 3 NAL H7   H -3.775 -2.608   1.900 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H7   . . rr_1skl 1 
        4 .  497 . 1 1 3 NAL H8   H -2.665 -0.406   1.630 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H8   . . rr_1skl 1 
        4 .  498 . 1 1 3 NAL H91  H -3.971  4.801   0.330 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H91  . . rr_1skl 1 
        4 .  499 . 1 1 3 NAL H92  H -4.115  4.590  -1.385 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H92  . . rr_1skl 1 
        4 .  500 . 1 1 3 NAL HN1  H -1.276  2.297  -1.092 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL HN1  . . rr_1skl 1 
        4 .  501 . 1 1 3 NAL N    N -1.717  3.087  -1.538 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL N    . . rr_1skl 1 
        4 .  502 . 1 1 3 NAL O2   O -1.758  5.277   1.418 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL O2   . . rr_1skl 1 
        4 .  503 . 1 1 4 NAL C1   C -0.491  0.169   4.254 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C1   . . rr_1skl 1 
        4 .  504 . 1 1 4 NAL C10  C -0.057  3.365   2.512 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C10  . . rr_1skl 1 
        4 .  505 . 1 1 4 NAL C11  C  1.406  2.923   2.619 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C11  . . rr_1skl 1 
        4 .  506 . 1 1 4 NAL C2   C -0.415  1.568   4.401 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C2   . . rr_1skl 1 
        4 .  507 . 1 1 4 NAL C3   C  0.186  2.117   5.550 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C3   . . rr_1skl 1 
        4 .  508 . 1 1 4 NAL C4   C  0.711  1.270   6.543 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C4   . . rr_1skl 1 
        4 .  509 . 1 1 4 NAL C4A  C  0.621 -0.129   6.403 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C4A  . . rr_1skl 1 
        4 .  510 . 1 1 4 NAL C5   C  1.126 -0.982   7.403 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C5   . . rr_1skl 1 
        4 .  511 . 1 1 4 NAL C6   C  1.016 -2.377   7.262 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C6   . . rr_1skl 1 
        4 .  512 . 1 1 4 NAL C7   C  0.399 -2.925   6.124 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C7   . . rr_1skl 1 
        4 .  513 . 1 1 4 NAL C8   C -0.102 -2.077   5.121 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C8   . . rr_1skl 1 
        4 .  514 . 1 1 4 NAL C8A  C  0.010 -0.680   5.256 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C8A  . . rr_1skl 1 
        4 .  515 . 1 1 4 NAL C9   C -1.013  2.461   3.326 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C9   . . rr_1skl 1 
        4 .  516 . 1 1 4 NAL H1   H -0.948 -0.253   3.370 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H1   . . rr_1skl 1 
        4 .  517 . 1 1 4 NAL H10  H -0.098  4.366   2.950 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H10  . . rr_1skl 1 
        4 .  518 . 1 1 4 NAL H3   H  0.246  3.189   5.671 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H3   . . rr_1skl 1 
        4 .  519 . 1 1 4 NAL H4   H  1.172  1.700   7.421 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H4   . . rr_1skl 1 
        4 .  520 . 1 1 4 NAL H5   H  1.593 -0.570   8.285 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H5   . . rr_1skl 1 
        4 .  521 . 1 1 4 NAL H6   H  1.397 -3.029   8.034 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H6   . . rr_1skl 1 
        4 .  522 . 1 1 4 NAL H7   H  0.308 -3.996   6.020 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H7   . . rr_1skl 1 
        4 .  523 . 1 1 4 NAL H8   H -0.578 -2.502   4.251 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H8   . . rr_1skl 1 
        4 .  524 . 1 1 4 NAL H91  H -1.774  3.092   3.785 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H91  . . rr_1skl 1 
        4 .  525 . 1 1 4 NAL H92  H -1.537  1.801   2.636 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H92  . . rr_1skl 1 
        4 .  526 . 1 1 4 NAL HN1  H -0.274  2.657   0.503 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL HN1  . . rr_1skl 1 
        4 .  527 . 1 1 4 NAL N    N -0.541  3.411   1.120 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL N    . . rr_1skl 1 
        4 .  528 . 1 1 4 NAL O2   O  2.219  3.674   3.156 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL O2   . . rr_1skl 1 
        4 .  529 . 1 1 5 ARG C    C  3.297  0.310   0.833 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG C    . . rr_1skl 1 
        4 .  530 . 1 1 5 ARG CA   C  3.116  1.223   2.053 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG CA   . . rr_1skl 1 
        4 .  531 . 1 1 5 ARG CB   C  3.541  0.649   3.427 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG CB   . . rr_1skl 1 
        4 .  532 . 1 1 5 ARG CD   C  2.990 -1.849   3.238 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG CD   . . rr_1skl 1 
        4 .  533 . 1 1 5 ARG CG   C  4.064 -0.792   3.521 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG CG   . . rr_1skl 1 
        4 .  534 . 1 1 5 ARG CZ   C  4.088 -3.992   3.949 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG CZ   . . rr_1skl 1 
        4 .  535 . 1 1 5 ARG H    H  1.023  1.158   1.699 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG H    . . rr_1skl 1 
        4 .  536 . 1 1 5 ARG HA   H  3.758  2.084   1.867 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HA   . . rr_1skl 1 
        4 .  537 . 1 1 5 ARG HB2  H  4.335  1.295   3.803 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HB2  . . rr_1skl 1 
        4 .  538 . 1 1 5 ARG HB3  H  2.717  0.747   4.135 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HB3  . . rr_1skl 1 
        4 .  539 . 1 1 5 ARG HD2  H  2.007 -1.426   3.436 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HD2  . . rr_1skl 1 
        4 .  540 . 1 1 5 ARG HD3  H  3.035 -2.140   2.190 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HD3  . . rr_1skl 1 
        4 .  541 . 1 1 5 ARG HE   H  2.535 -3.101   4.887 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HE   . . rr_1skl 1 
        4 .  542 . 1 1 5 ARG HG2  H  4.909 -0.934   2.847 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HG2  . . rr_1skl 1 
        4 .  543 . 1 1 5 ARG HG3  H  4.430 -0.928   4.540 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HG3  . . rr_1skl 1 
        4 .  544 . 1 1 5 ARG HH11 H  4.918 -3.247   2.240 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HH11 . . rr_1skl 1 
        4 .  545 . 1 1 5 ARG HH12 H  5.648 -4.716   2.848 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HH12 . . rr_1skl 1 
        4 .  546 . 1 1 5 ARG HH21 H  3.519 -4.984   5.638 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HH21 . . rr_1skl 1 
        4 .  547 . 1 1 5 ARG HH22 H  4.857 -5.696   4.766 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HH22 . . rr_1skl 1 
        4 .  548 . 1 1 5 ARG N    N  1.744  1.732   2.109 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG N    . . rr_1skl 1 
        4 .  549 . 1 1 5 ARG NE   N  3.157 -3.034   4.094 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG NE   . . rr_1skl 1 
        4 .  550 . 1 1 5 ARG NH1  N  4.954 -3.987   2.926 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG NH1  . . rr_1skl 1 
        4 .  551 . 1 1 5 ARG NH2  N  4.156 -4.975   4.854 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG NH2  . . rr_1skl 1 
        4 .  552 . 1 1 5 ARG O    O  4.422  0.118   0.372 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG O    . . rr_1skl 1 
        4 .  553 . 1 1 6 PHE C    C  2.042  0.342  -2.075 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE C    . . rr_1skl 1 
        4 .  554 . 1 1 6 PHE CA   C  2.116 -0.797  -1.040 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CA   . . rr_1skl 1 
        4 .  555 . 1 1 6 PHE CB   C  0.874 -1.701  -1.142 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CB   . . rr_1skl 1 
        4 .  556 . 1 1 6 PHE CD1  C  1.780 -3.626   0.250 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CD1  . . rr_1skl 1 
        4 .  557 . 1 1 6 PHE CD2  C -0.470 -2.812   0.699 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CD2  . . rr_1skl 1 
        4 .  558 . 1 1 6 PHE CE1  C  1.644 -4.570   1.283 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CE1  . . rr_1skl 1 
        4 .  559 . 1 1 6 PHE CE2  C -0.608 -3.761   1.727 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CE2  . . rr_1skl 1 
        4 .  560 . 1 1 6 PHE CG   C  0.727 -2.735  -0.038 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CG   . . rr_1skl 1 
        4 .  561 . 1 1 6 PHE CZ   C  0.451 -4.635   2.024 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CZ   . . rr_1skl 1 
        4 .  562 . 1 1 6 PHE H    H  1.304 -0.040   0.748 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE H    . . rr_1skl 1 
        4 .  563 . 1 1 6 PHE HA   H  3.010 -1.395  -1.222 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HA   . . rr_1skl 1 
        4 .  564 . 1 1 6 PHE HB2  H -0.014 -1.067  -1.151 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HB2  . . rr_1skl 1 
        4 .  565 . 1 1 6 PHE HB3  H  0.907 -2.236  -2.093 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HB3  . . rr_1skl 1 
        4 .  566 . 1 1 6 PHE HD1  H  2.701 -3.582  -0.312 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HD1  . . rr_1skl 1 
        4 .  567 . 1 1 6 PHE HD2  H -1.289 -2.145   0.478 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HD2  . . rr_1skl 1 
        4 .  568 . 1 1 6 PHE HE1  H  2.457 -5.242   1.510 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HE1  . . rr_1skl 1 
        4 .  569 . 1 1 6 PHE HE2  H -1.528 -3.815   2.291 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HE2  . . rr_1skl 1 
        4 .  570 . 1 1 6 PHE HZ   H  0.348 -5.360   2.819 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HZ   . . rr_1skl 1 
        4 .  571 . 1 1 6 PHE N    N  2.182 -0.193   0.280 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE N    . . rr_1skl 1 
        4 .  572 . 1 1 6 PHE O    O  1.980  1.525  -1.729 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE O    . . rr_1skl 1 
        5 .  573 . 1 1 1 ARG C    C  0.396  1.953  -4.160 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG C    . . rr_1skl 1 
        5 .  574 . 1 1 1 ARG CA   C  1.806  1.329  -4.054 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG CA   . . rr_1skl 1 
        5 .  575 . 1 1 1 ARG CB   C  2.264  0.767  -5.415 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG CB   . . rr_1skl 1 
        5 .  576 . 1 1 1 ARG CD   C  3.082  1.313  -7.763 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG CD   . . rr_1skl 1 
        5 .  577 . 1 1 1 ARG CG   C  2.632  1.881  -6.412 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG CG   . . rr_1skl 1 
        5 .  578 . 1 1 1 ARG CZ   C  2.788  3.221  -9.376 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG CZ   . . rr_1skl 1 
        5 .  579 . 1 1 1 ARG HA   H  2.498  2.132  -3.797 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HA   . . rr_1skl 1 
        5 .  580 . 1 1 1 ARG HB2  H  3.151  0.150  -5.261 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HB2  . . rr_1skl 1 
        5 .  581 . 1 1 1 ARG HB3  H  1.477  0.139  -5.836 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HB3  . . rr_1skl 1 
        5 .  582 . 1 1 1 ARG HD2  H  3.900  0.612  -7.600 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HD2  . . rr_1skl 1 
        5 .  583 . 1 1 1 ARG HD3  H  2.255  0.777  -8.231 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HD3  . . rr_1skl 1 
        5 .  584 . 1 1 1 ARG HE   H  4.559  2.475  -8.746 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HE   . . rr_1skl 1 
        5 .  585 . 1 1 1 ARG HG2  H  1.774  2.528  -6.582 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HG2  . . rr_1skl 1 
        5 .  586 . 1 1 1 ARG HG3  H  3.442  2.477  -5.990 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HG3  . . rr_1skl 1 
        5 .  587 . 1 1 1 ARG HH11 H  0.989  2.479  -8.758 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HH11 . . rr_1skl 1 
        5 .  588 . 1 1 1 ARG HH12 H  0.902  3.820  -9.879 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HH12 . . rr_1skl 1 
        5 .  589 . 1 1 1 ARG HH21 H  4.382  4.202 -10.184 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HH21 . . rr_1skl 1 
        5 .  590 . 1 1 1 ARG HH22 H  2.811  4.789 -10.679 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HH22 . . rr_1skl 1 
        5 .  591 . 1 1 1 ARG N    N  1.941  0.276  -3.024 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG N    . . rr_1skl 1 
        5 .  592 . 1 1 1 ARG NE   N  3.557  2.376  -8.665 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG NE   . . rr_1skl 1 
        5 .  593 . 1 1 1 ARG NH1  N  1.449  3.166  -9.336 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG NH1  . . rr_1skl 1 
        5 .  594 . 1 1 1 ARG NH2  N  3.375  4.146 -10.143 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG NH2  . . rr_1skl 1 
        5 .  595 . 1 1 1 ARG O    O  0.262  3.074  -4.648 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG O    . . rr_1skl 1 
        5 .  596 . 1 1 2 ARG C    C -2.337  2.956  -3.017 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG C    . . rr_1skl 1 
        5 .  597 . 1 1 2 ARG CA   C -2.040  1.634  -3.743 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG CA   . . rr_1skl 1 
        5 .  598 . 1 1 2 ARG CB   C -2.913  0.513  -3.148 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG CB   . . rr_1skl 1 
        5 .  599 . 1 1 2 ARG CD   C -1.746 -1.724  -2.886 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG CD   . . rr_1skl 1 
        5 .  600 . 1 1 2 ARG CG   C -2.696 -0.882  -3.742 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG CG   . . rr_1skl 1 
        5 .  601 . 1 1 2 ARG CZ   C -0.535 -3.465  -4.227 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG CZ   . . rr_1skl 1 
        5 .  602 . 1 1 2 ARG H    H -0.442  0.341  -3.280 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG H    . . rr_1skl 1 
        5 .  603 . 1 1 2 ARG HA   H -2.318  1.751  -4.787 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HA   . . rr_1skl 1 
        5 .  604 . 1 1 2 ARG HB2  H -2.751  0.465  -2.073 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HB2  . . rr_1skl 1 
        5 .  605 . 1 1 2 ARG HB3  H -3.956  0.763  -3.321 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HB3  . . rr_1skl 1 
        5 .  606 . 1 1 2 ARG HD2  H -0.782 -1.227  -2.785 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HD2  . . rr_1skl 1 
        5 .  607 . 1 1 2 ARG HD3  H -2.162 -1.846  -1.882 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HD3  . . rr_1skl 1 
        5 .  608 . 1 1 2 ARG HE   H -2.375 -3.660  -3.392 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HE   . . rr_1skl 1 
        5 .  609 . 1 1 2 ARG HG2  H -3.660 -1.393  -3.778 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HG2  . . rr_1skl 1 
        5 .  610 . 1 1 2 ARG HG3  H -2.318 -0.801  -4.763 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HG3  . . rr_1skl 1 
        5 .  611 . 1 1 2 ARG HH11 H  0.546 -1.737  -4.103 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HH11 . . rr_1skl 1 
        5 .  612 . 1 1 2 ARG HH12 H  1.287 -3.018  -5.036 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HH12 . . rr_1skl 1 
        5 .  613 . 1 1 2 ARG HH21 H -1.338 -5.307  -4.570 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HH21 . . rr_1skl 1 
        5 .  614 . 1 1 2 ARG HH22 H  0.225 -5.025  -5.299 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HH22 . . rr_1skl 1 
        5 .  615 . 1 1 2 ARG N    N -0.637  1.242  -3.688 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG N    . . rr_1skl 1 
        5 .  616 . 1 1 2 ARG NE   N -1.578 -3.049  -3.489 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG NE   . . rr_1skl 1 
        5 .  617 . 1 1 2 ARG NH1  N  0.521 -2.674  -4.472 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG NH1  . . rr_1skl 1 
        5 .  618 . 1 1 2 ARG NH2  N -0.552 -4.700  -4.739 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG NH2  . . rr_1skl 1 
        5 .  619 . 1 1 2 ARG O    O -3.006  3.810  -3.598 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG O    . . rr_1skl 1 
        5 .  620 . 1 1 3 NAL C1   C -3.812  1.673   0.154 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C1   . . rr_1skl 1 
        5 .  621 . 1 1 3 NAL C10  C -2.261  4.202  -0.858 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C10  . . rr_1skl 1 
        5 .  622 . 1 1 3 NAL C11  C -1.470  4.208   0.475 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C11  . . rr_1skl 1 
        5 .  623 . 1 1 3 NAL C2   C -4.422  2.728  -0.553 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C2   . . rr_1skl 1 
        5 .  624 . 1 1 3 NAL C3   C -5.605  2.473  -1.276 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C3   . . rr_1skl 1 
        5 .  625 . 1 1 3 NAL C4   C -6.154  1.178  -1.314 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C4   . . rr_1skl 1 
        5 .  626 . 1 1 3 NAL C4A  C -5.521  0.122  -0.633 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C4A  . . rr_1skl 1 
        5 .  627 . 1 1 3 NAL C5   C -6.034 -1.187  -0.708 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C5   . . rr_1skl 1 
        5 .  628 . 1 1 3 NAL C6   C -5.375 -2.240  -0.048 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C6   . . rr_1skl 1 
        5 .  629 . 1 1 3 NAL C7   C -4.208 -1.986   0.696 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C7   . . rr_1skl 1 
        5 .  630 . 1 1 3 NAL C8   C -3.698 -0.679   0.778 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C8   . . rr_1skl 1 
        5 .  631 . 1 1 3 NAL C8A  C -4.350  0.375   0.113 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C8A  . . rr_1skl 1 
        5 .  632 . 1 1 3 NAL C9   C -3.790  4.121  -0.592 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C9   . . rr_1skl 1 
        5 .  633 . 1 1 3 NAL H1   H -2.891  1.843   0.681 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H1   . . rr_1skl 1 
        5 .  634 . 1 1 3 NAL H10  H -2.051  5.150  -1.355 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H10  . . rr_1skl 1 
        5 .  635 . 1 1 3 NAL H3   H -6.088  3.268  -1.826 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H3   . . rr_1skl 1 
        5 .  636 . 1 1 3 NAL H4   H -7.052  0.995  -1.887 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H4   . . rr_1skl 1 
        5 .  637 . 1 1 3 NAL H5   H -6.928 -1.390  -1.280 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H5   . . rr_1skl 1 
        5 .  638 . 1 1 3 NAL H6   H -5.767 -3.244  -0.111 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H6   . . rr_1skl 1 
        5 .  639 . 1 1 3 NAL H7   H -3.705 -2.796   1.203 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H7   . . rr_1skl 1 
        5 .  640 . 1 1 3 NAL H8   H -2.801 -0.487   1.349 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H8   . . rr_1skl 1 
        5 .  641 . 1 1 3 NAL H91  H -4.043  4.638   0.332 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H91  . . rr_1skl 1 
        5 .  642 . 1 1 3 NAL H92  H -4.281  4.682  -1.389 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H92  . . rr_1skl 1 
        5 .  643 . 1 1 3 NAL HN1  H -1.304  2.383  -1.362 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL HN1  . . rr_1skl 1 
        5 .  644 . 1 1 3 NAL N    N -1.865  3.116  -1.766 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL N    . . rr_1skl 1 
        5 .  645 . 1 1 3 NAL O2   O -1.777  5.014   1.354 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL O2   . . rr_1skl 1 
        5 .  646 . 1 1 4 NAL C1   C  0.020  0.337   4.427 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C1   . . rr_1skl 1 
        5 .  647 . 1 1 4 NAL C10  C  0.194  3.048   1.927 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C10  . . rr_1skl 1 
        5 .  648 . 1 1 4 NAL C11  C  1.635  2.553   1.666 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C11  . . rr_1skl 1 
        5 .  649 . 1 1 4 NAL C2   C -0.294  1.669   4.094 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C2   . . rr_1skl 1 
        5 .  650 . 1 1 4 NAL C3   C -0.206  2.669   5.076 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C3   . . rr_1skl 1 
        5 .  651 . 1 1 4 NAL C4   C  0.196  2.354   6.395 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C4   . . rr_1skl 1 
        5 .  652 . 1 1 4 NAL C4A  C  0.514  1.009   6.707 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C4A  . . rr_1skl 1 
        5 .  653 . 1 1 4 NAL C5   C  0.934  0.694   8.026 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C5   . . rr_1skl 1 
        5 .  654 . 1 1 4 NAL C6   C  1.255 -0.645   8.337 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C6   . . rr_1skl 1 
        5 .  655 . 1 1 4 NAL C7   C  1.167 -1.643   7.361 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C7   . . rr_1skl 1 
        5 .  656 . 1 1 4 NAL C8   C  0.752 -1.317   6.059 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C8   . . rr_1skl 1 
        5 .  657 . 1 1 4 NAL C8A  C  0.424  0.008   5.730 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C8A  . . rr_1skl 1 
        5 .  658 . 1 1 4 NAL C9   C -0.692  2.022   2.670 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C9   . . rr_1skl 1 
        5 .  659 . 1 1 4 NAL H1   H -0.018 -0.438   3.663 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H1   . . rr_1skl 1 
        5 .  660 . 1 1 4 NAL H10  H  0.257  3.963   2.519 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H10  . . rr_1skl 1 
        5 .  661 . 1 1 4 NAL H3   H -0.436  3.700   4.835 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H3   . . rr_1skl 1 
        5 .  662 . 1 1 4 NAL H4   H  0.260  3.116   7.139 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H4   . . rr_1skl 1 
        5 .  663 . 1 1 4 NAL H5   H  1.008  1.450   8.771 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H5   . . rr_1skl 1 
        5 .  664 . 1 1 4 NAL H6   H  1.568 -0.893   9.344 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H6   . . rr_1skl 1 
        5 .  665 . 1 1 4 NAL H7   H  1.415 -2.661   7.616 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H7   . . rr_1skl 1 
        5 .  666 . 1 1 4 NAL H8   H  0.680 -2.096   5.306 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H8   . . rr_1skl 1 
        5 .  667 . 1 1 4 NAL H91  H -1.708  2.414   2.717 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H91  . . rr_1skl 1 
        5 .  668 . 1 1 4 NAL H92  H -0.732  1.108   2.070 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H92  . . rr_1skl 1 
        5 .  669 . 1 1 4 NAL HN1  H -0.240  2.707  -0.119 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL HN1  . . rr_1skl 1 
        5 .  670 . 1 1 4 NAL N    N -0.478  3.318   0.649 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL N    . . rr_1skl 1 
        5 .  671 . 1 1 4 NAL O2   O  2.237  2.932   0.659 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL O2   . . rr_1skl 1 
        5 .  672 . 1 1 5 ARG C    C  3.425  0.125   1.077 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG C    . . rr_1skl 1 
        5 .  673 . 1 1 5 ARG CA   C  3.460  0.978   2.351 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG CA   . . rr_1skl 1 
        5 .  674 . 1 1 5 ARG CB   C  3.846  0.115   3.585 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG CB   . . rr_1skl 1 
        5 .  675 . 1 1 5 ARG CD   C  3.941  2.200   5.071 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG CD   . . rr_1skl 1 
        5 .  676 . 1 1 5 ARG CG   C  4.637  0.907   4.633 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG CG   . . rr_1skl 1 
        5 .  677 . 1 1 5 ARG CZ   C  5.802  3.712   5.777 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG CZ   . . rr_1skl 1 
        5 .  678 . 1 1 5 ARG H    H  1.734  1.647   3.467 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG H    . . rr_1skl 1 
        5 .  679 . 1 1 5 ARG HA   H  4.252  1.712   2.197 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HA   . . rr_1skl 1 
        5 .  680 . 1 1 5 ARG HB2  H  2.965 -0.334   4.049 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HB2  . . rr_1skl 1 
        5 .  681 . 1 1 5 ARG HB3  H  4.490 -0.719   3.282 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HB3  . . rr_1skl 1 
        5 .  682 . 1 1 5 ARG HD2  H  3.792  2.837   4.197 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HD2  . . rr_1skl 1 
        5 .  683 . 1 1 5 ARG HD3  H  2.966  1.948   5.485 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HD3  . . rr_1skl 1 
        5 .  684 . 1 1 5 ARG HE   H  4.500  2.812   7.032 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HE   . . rr_1skl 1 
        5 .  685 . 1 1 5 ARG HG2  H  4.791  0.276   5.509 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HG2  . . rr_1skl 1 
        5 .  686 . 1 1 5 ARG HG3  H  5.613  1.155   4.214 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HG3  . . rr_1skl 1 
        5 .  687 . 1 1 5 ARG HH11 H  5.732  3.492   3.748 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HH11 . . rr_1skl 1 
        5 .  688 . 1 1 5 ARG HH12 H  7.017  4.515   4.349 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HH12 . . rr_1skl 1 
        5 .  689 . 1 1 5 ARG HH21 H  6.180  4.145   7.734 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HH21 . . rr_1skl 1 
        5 .  690 . 1 1 5 ARG HH22 H  7.267  4.879   6.577 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HH22 . . rr_1skl 1 
        5 .  691 . 1 1 5 ARG N    N  2.201  1.734   2.571 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG N    . . rr_1skl 1 
        5 .  692 . 1 1 5 ARG NE   N  4.747  2.933   6.059 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG NE   . . rr_1skl 1 
        5 .  693 . 1 1 5 ARG NH1  N  6.213  3.923   4.518 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG NH1  . . rr_1skl 1 
        5 .  694 . 1 1 5 ARG NH2  N  6.471  4.295   6.780 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG NH2  . . rr_1skl 1 
        5 .  695 . 1 1 5 ARG O    O  4.486 -0.234   0.558 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG O    . . rr_1skl 1 
        5 .  696 . 1 1 6 PHE C    C  1.589  0.395  -1.735 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE C    . . rr_1skl 1 
        5 .  697 . 1 1 6 PHE CA   C  2.001 -0.741  -0.774 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CA   . . rr_1skl 1 
        5 .  698 . 1 1 6 PHE CB   C  0.889 -1.795  -0.651 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CB   . . rr_1skl 1 
        5 .  699 . 1 1 6 PHE CD1  C  2.074 -3.318   1.019 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CD1  . . rr_1skl 1 
        5 .  700 . 1 1 6 PHE CD2  C -0.199 -2.583   1.489 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CD2  . . rr_1skl 1 
        5 .  701 . 1 1 6 PHE CE1  C  2.124 -3.950   2.272 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CE1  . . rr_1skl 1 
        5 .  702 . 1 1 6 PHE CE2  C -0.152 -3.222   2.740 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CE2  . . rr_1skl 1 
        5 .  703 . 1 1 6 PHE CG   C  0.915 -2.614   0.631 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CG   . . rr_1skl 1 
        5 .  704 . 1 1 6 PHE CZ   C  1.016 -3.890   3.139 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CZ   . . rr_1skl 1 
        5 .  705 . 1 1 6 PHE H    H  1.405  0.127   1.046 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE H    . . rr_1skl 1 
        5 .  706 . 1 1 6 PHE HA   H  2.909 -1.223  -1.140 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HA   . . rr_1skl 1 
        5 .  707 . 1 1 6 PHE HB2  H -0.065 -1.269  -0.681 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HB2  . . rr_1skl 1 
        5 .  708 . 1 1 6 PHE HB3  H  0.937 -2.470  -1.505 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HB3  . . rr_1skl 1 
        5 .  709 . 1 1 6 PHE HD1  H  2.939 -3.339   0.371 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HD1  . . rr_1skl 1 
        5 .  710 . 1 1 6 PHE HD2  H -1.089 -2.043   1.207 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HD2  . . rr_1skl 1 
        5 .  711 . 1 1 6 PHE HE1  H  3.024 -4.464   2.582 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HE1  . . rr_1skl 1 
        5 .  712 . 1 1 6 PHE HE2  H -1.001 -3.173   3.403 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HE2  . . rr_1skl 1 
        5 .  713 . 1 1 6 PHE HZ   H  1.060 -4.334   4.123 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HZ   . . rr_1skl 1 
        5 .  714 . 1 1 6 PHE N    N  2.228 -0.152   0.533 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE N    . . rr_1skl 1 
        5 .  715 . 1 1 6 PHE O    O  0.955  1.355  -1.303 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE O    . . rr_1skl 1 
        6 .  716 . 1 1 1 ARG C    C  0.248  1.635  -4.396 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG C    . . rr_1skl 1 
        6 .  717 . 1 1 1 ARG CA   C  1.648  1.008  -4.475 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG CA   . . rr_1skl 1 
        6 .  718 . 1 1 1 ARG CB   C  1.746  0.158  -5.755 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG CB   . . rr_1skl 1 
        6 .  719 . 1 1 1 ARG CD   C  3.224 -0.858  -7.519 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG CD   . . rr_1skl 1 
        6 .  720 . 1 1 1 ARG CG   C  3.197 -0.068  -6.204 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG CG   . . rr_1skl 1 
        6 .  721 . 1 1 1 ARG CZ   C  5.084 -0.225  -9.095 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG CZ   . . rr_1skl 1 
        6 .  722 . 1 1 1 ARG HA   H  2.366  1.819  -4.559 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HA   . . rr_1skl 1 
        6 .  723 . 1 1 1 ARG HB2  H  1.246 -0.801  -5.607 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HB2  . . rr_1skl 1 
        6 .  724 . 1 1 1 ARG HB3  H  1.231  0.683  -6.564 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HB3  . . rr_1skl 1 
        6 .  725 . 1 1 1 ARG HD2  H  2.853 -1.865  -7.329 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HD2  . . rr_1skl 1 
        6 .  726 . 1 1 1 ARG HD3  H  2.558 -0.383  -8.240 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HD3  . . rr_1skl 1 
        6 .  727 . 1 1 1 ARG HE   H  5.190 -1.642  -7.654 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HE   . . rr_1skl 1 
        6 .  728 . 1 1 1 ARG HG2  H  3.676  0.901  -6.357 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HG2  . . rr_1skl 1 
        6 .  729 . 1 1 1 ARG HG3  H  3.742 -0.619  -5.436 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HG3  . . rr_1skl 1 
        6 .  730 . 1 1 1 ARG HH11 H  3.408  0.891  -9.442 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HH11 . . rr_1skl 1 
        6 .  731 . 1 1 1 ARG HH12 H  4.769  1.236 -10.485 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HH12 . . rr_1skl 1 
        6 .  732 . 1 1 1 ARG HH21 H  6.911 -1.138  -9.051 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HH21 . . rr_1skl 1 
        6 .  733 . 1 1 1 ARG HH22 H  6.720  0.106 -10.265 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HH22 . . rr_1skl 1 
        6 .  734 . 1 1 1 ARG N    N  1.968  0.184  -3.299 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG N    . . rr_1skl 1 
        6 .  735 . 1 1 1 ARG NE   N  4.585 -0.953  -8.077 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG NE   . . rr_1skl 1 
        6 .  736 . 1 1 1 ARG NH1  N  4.361  0.712  -9.724 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG NH1  . . rr_1skl 1 
        6 .  737 . 1 1 1 ARG NH2  N  6.341 -0.437  -9.502 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG NH2  . . rr_1skl 1 
        6 .  738 . 1 1 1 ARG O    O  0.006  2.609  -5.140 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG O    . . rr_1skl 1 
        6 .  739 . 1 1 2 ARG C    C -2.260  2.954  -2.936 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG C    . . rr_1skl 1 
        6 .  740 . 1 1 2 ARG CA   C -2.053  1.568  -3.579 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG CA   . . rr_1skl 1 
        6 .  741 . 1 1 2 ARG CB   C -2.965  0.538  -2.905 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG CB   . . rr_1skl 1 
        6 .  742 . 1 1 2 ARG CD   C -2.073 -1.856  -2.626 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG CD   . . rr_1skl 1 
        6 .  743 . 1 1 2 ARG CG   C -2.913 -0.889  -3.478 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG CG   . . rr_1skl 1 
        6 .  744 . 1 1 2 ARG CZ   C -1.493 -4.292  -2.675 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG CZ   . . rr_1skl 1 
        6 .  745 . 1 1 2 ARG H    H -0.437  0.303  -3.023 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG H    . . rr_1skl 1 
        6 .  746 . 1 1 2 ARG HA   H -2.363  1.640  -4.616 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HA   . . rr_1skl 1 
        6 .  747 . 1 1 2 ARG HB2  H -2.749  0.505  -1.834 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HB2  . . rr_1skl 1 
        6 .  748 . 1 1 2 ARG HB3  H -3.983  0.891  -3.056 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HB3  . . rr_1skl 1 
        6 .  749 . 1 1 2 ARG HD2  H -1.059 -1.478  -2.561 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HD2  . . rr_1skl 1 
        6 .  750 . 1 1 2 ARG HD3  H -2.488 -1.924  -1.614 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HD3  . . rr_1skl 1 
        6 .  751 . 1 1 2 ARG HE   H -2.395 -3.270  -4.171 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HE   . . rr_1skl 1 
        6 .  752 . 1 1 2 ARG HG2  H -3.932 -1.270  -3.511 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HG2  . . rr_1skl 1 
        6 .  753 . 1 1 2 ARG HG3  H -2.526 -0.855  -4.495 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HG3  . . rr_1skl 1 
        6 .  754 . 1 1 2 ARG HH11 H -0.940 -3.425  -0.910 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HH11 . . rr_1skl 1 
        6 .  755 . 1 1 2 ARG HH12 H -0.566 -5.126  -1.057 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HH12 . . rr_1skl 1 
        6 .  756 . 1 1 2 ARG HH21 H -1.886 -5.462  -4.299 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HH21 . . rr_1skl 1 
        6 .  757 . 1 1 2 ARG HH22 H -1.098 -6.275  -2.965 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HH22 . . rr_1skl 1 
        6 .  758 . 1 1 2 ARG N    N -0.665  1.131  -3.573 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG N    . . rr_1skl 1 
        6 .  759 . 1 1 2 ARG NE   N -2.023 -3.192  -3.236 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG NE   . . rr_1skl 1 
        6 .  760 . 1 1 2 ARG NH1  N -0.960 -4.280  -1.446 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG NH1  . . rr_1skl 1 
        6 .  761 . 1 1 2 ARG NH2  N -1.492 -5.436  -3.369 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG NH2  . . rr_1skl 1 
        6 .  762 . 1 1 2 ARG O    O -2.842  3.823  -3.581 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG O    . . rr_1skl 1 
        6 .  763 . 1 1 3 NAL C1   C -3.902  1.934   0.234 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C1   . . rr_1skl 1 
        6 .  764 . 1 1 3 NAL C10  C -2.153  4.307  -0.846 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C10  . . rr_1skl 1 
        6 .  765 . 1 1 3 NAL C11  C -1.387  4.324   0.491 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C11  . . rr_1skl 1 
        6 .  766 . 1 1 3 NAL C2   C -4.414  2.993  -0.542 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C2   . . rr_1skl 1 
        6 .  767 . 1 1 3 NAL C3   C -5.572  2.779  -1.318 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C3   . . rr_1skl 1 
        6 .  768 . 1 1 3 NAL C4   C -6.203  1.514  -1.334 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C4   . . rr_1skl 1 
        6 .  769 . 1 1 3 NAL C4A  C -5.658  0.455  -0.596 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C4A  . . rr_1skl 1 
        6 .  770 . 1 1 3 NAL C5   C -6.240 -0.841  -0.644 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C5   . . rr_1skl 1 
        6 .  771 . 1 1 3 NAL C6   C -5.665 -1.902   0.068 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C6   . . rr_1skl 1 
        6 .  772 . 1 1 3 NAL C7   C -4.528 -1.682   0.868 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C7   . . rr_1skl 1 
        6 .  773 . 1 1 3 NAL C8   C -3.963 -0.397   0.940 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C8   . . rr_1skl 1 
        6 .  774 . 1 1 3 NAL C8A  C -4.514  0.663   0.199 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C8A  . . rr_1skl 1 
        6 .  775 . 1 1 3 NAL C9   C -3.691  4.350  -0.613 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C9   . . rr_1skl 1 
        6 .  776 . 1 1 3 NAL H1   H -3.012  2.070   0.814 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H1   . . rr_1skl 1 
        6 .  777 . 1 1 3 NAL H10  H -1.872  5.217  -1.386 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H10  . . rr_1skl 1 
        6 .  778 . 1 1 3 NAL H3   H -5.975  3.577  -1.924 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H3   . . rr_1skl 1 
        6 .  779 . 1 1 3 NAL H4   H -7.086  1.374  -1.932 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H4   . . rr_1skl 1 
        6 .  780 . 1 1 3 NAL H5   H -7.134 -1.011  -1.235 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H5   . . rr_1skl 1 
        6 .  781 . 1 1 3 NAL H6   H -6.101 -2.887   0.019 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H6   . . rr_1skl 1 
        6 .  782 . 1 1 3 NAL H7   H -4.100 -2.492   1.435 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H7   . . rr_1skl 1 
        6 .  783 . 1 1 3 NAL H8   H -3.101 -0.227   1.576 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H8   . . rr_1skl 1 
        6 .  784 . 1 1 3 NAL H91  H -3.928  4.925   0.277 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H91  . . rr_1skl 1 
        6 .  785 . 1 1 3 NAL H92  H -4.124  4.907  -1.443 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H92  . . rr_1skl 1 
        6 .  786 . 1 1 3 NAL HN1  H -1.357  2.385  -1.210 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL HN1  . . rr_1skl 1 
        6 .  787 . 1 1 3 NAL N    N -1.815  3.141  -1.679 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL N    . . rr_1skl 1 
        6 .  788 . 1 1 3 NAL O2   O -1.632  5.213   1.312 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL O2   . . rr_1skl 1 
        6 .  789 . 1 1 4 NAL C1   C -0.488  0.598   4.724 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C1   . . rr_1skl 1 
        6 .  790 . 1 1 4 NAL C10  C  0.130  3.139   2.066 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C10  . . rr_1skl 1 
        6 .  791 . 1 1 4 NAL C11  C  1.560  2.577   1.902 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C11  . . rr_1skl 1 
        6 .  792 . 1 1 4 NAL C2   C -0.521  1.939   4.297 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C2   . . rr_1skl 1 
        6 .  793 . 1 1 4 NAL C3   C -0.249  2.972   5.218 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C3   . . rr_1skl 1 
        6 .  794 . 1 1 4 NAL C4   C  0.124  2.657   6.539 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C4   . . rr_1skl 1 
        6 .  795 . 1 1 4 NAL C4A  C  0.195  1.313   6.956 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C4A  . . rr_1skl 1 
        6 .  796 . 1 1 4 NAL C5   C  0.591  0.980   8.265 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C5   . . rr_1skl 1 
        6 .  797 . 1 1 4 NAL C6   C  0.566 -0.361   8.691 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C6   . . rr_1skl 1 
        6 .  798 . 1 1 4 NAL C7   C  0.168 -1.374   7.805 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C7   . . rr_1skl 1 
        6 .  799 . 1 1 4 NAL C8   C -0.153 -1.060   6.475 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C8   . . rr_1skl 1 
        6 .  800 . 1 1 4 NAL C8A  C -0.145  0.283   6.050 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C8A  . . rr_1skl 1 
        6 .  801 . 1 1 4 NAL C9   C -0.861  2.246   2.852 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C9   . . rr_1skl 1 
        6 .  802 . 1 1 4 NAL H1   H -0.733 -0.196   4.035 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H1   . . rr_1skl 1 
        6 .  803 . 1 1 4 NAL H10  H  0.220  4.089   2.586 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H10  . . rr_1skl 1 
        6 .  804 . 1 1 4 NAL H3   H -0.330  4.014   4.920 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H3   . . rr_1skl 1 
        6 .  805 . 1 1 4 NAL H4   H  0.340  3.454   7.234 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H4   . . rr_1skl 1 
        6 .  806 . 1 1 4 NAL H5   H  0.911  1.741   8.956 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H5   . . rr_1skl 1 
        6 .  807 . 1 1 4 NAL H6   H  0.842 -0.613   9.707 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H6   . . rr_1skl 1 
        6 .  808 . 1 1 4 NAL H7   H  0.106 -2.391   8.149 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H7   . . rr_1skl 1 
        6 .  809 . 1 1 4 NAL H8   H -0.425 -1.848   5.788 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H8   . . rr_1skl 1 
        6 .  810 . 1 1 4 NAL H91  H -1.836  2.739   2.860 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H91  . . rr_1skl 1 
        6 .  811 . 1 1 4 NAL H92  H -0.991  1.306   2.306 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H92  . . rr_1skl 1 
        6 .  812 . 1 1 4 NAL HN1  H -0.267  2.689   0.019 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL HN1  . . rr_1skl 1 
        6 .  813 . 1 1 4 NAL N    N -0.479  3.367   0.746 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL N    . . rr_1skl 1 
        6 .  814 . 1 1 4 NAL O2   O  2.288  3.052   1.026 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL O2   . . rr_1skl 1 
        6 .  815 . 1 1 5 ARG C    C  3.304  0.007   1.270 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG C    . . rr_1skl 1 
        6 .  816 . 1 1 5 ARG CA   C  3.240  0.823   2.583 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG CA   . . rr_1skl 1 
        6 .  817 . 1 1 5 ARG CB   C  3.540 -0.061   3.837 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG CB   . . rr_1skl 1 
        6 .  818 . 1 1 5 ARG CD   C  3.563  1.906   5.414 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG CD   . . rr_1skl 1 
        6 .  819 . 1 1 5 ARG CG   C  4.325  0.681   4.930 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG CG   . . rr_1skl 1 
        6 .  820 . 1 1 5 ARG CZ   C  3.967  3.816   6.968 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG CZ   . . rr_1skl 1 
        6 .  821 . 1 1 5 ARG H    H  1.383  1.422   3.534 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG H    . . rr_1skl 1 
        6 .  822 . 1 1 5 ARG HA   H  4.056  1.549   2.499 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HA   . . rr_1skl 1 
        6 .  823 . 1 1 5 ARG HB2  H  2.621 -0.454   4.269 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HB2  . . rr_1skl 1 
        6 .  824 . 1 1 5 ARG HB3  H  4.151 -0.930   3.573 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HB3  . . rr_1skl 1 
        6 .  825 . 1 1 5 ARG HD2  H  3.481  2.606   4.584 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HD2  . . rr_1skl 1 
        6 .  826 . 1 1 5 ARG HD3  H  2.578  1.572   5.721 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HD3  . . rr_1skl 1 
        6 .  827 . 1 1 5 ARG HE   H  4.965  2.050   7.003 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HE   . . rr_1skl 1 
        6 .  828 . 1 1 5 ARG HG2  H  4.473  0.005   5.771 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HG2  . . rr_1skl 1 
        6 .  829 . 1 1 5 ARG HG3  H  5.301  0.986   4.545 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HG3  . . rr_1skl 1 
        6 .  830 . 1 1 5 ARG HH11 H  2.484  4.169   5.618 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HH11 . . rr_1skl 1 
        6 .  831 . 1 1 5 ARG HH12 H  2.816  5.491   6.714 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HH12 . . rr_1skl 1 
        6 .  832 . 1 1 5 ARG HH21 H  5.399  3.770   8.419 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HH21 . . rr_1skl 1 
        6 .  833 . 1 1 5 ARG HH22 H  4.491  5.259   8.318 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HH22 . . rr_1skl 1 
        6 .  834 . 1 1 5 ARG N    N  1.985  1.614   2.738 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG N    . . rr_1skl 1 
        6 .  835 . 1 1 5 ARG NE   N  4.237  2.571   6.538 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG NE   . . rr_1skl 1 
        6 .  836 . 1 1 5 ARG NH1  N  3.010  4.555   6.389 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG NH1  . . rr_1skl 1 
        6 .  837 . 1 1 5 ARG NH2  N  4.673  4.322   7.987 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG NH2  . . rr_1skl 1 
        6 .  838 . 1 1 5 ARG O    O  4.257 -0.744   1.061 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG O    . . rr_1skl 1 
        6 .  839 . 1 1 6 PHE C    C  1.987  0.628  -2.032 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE C    . . rr_1skl 1 
        6 .  840 . 1 1 6 PHE CA   C  2.221 -0.437  -0.936 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CA   . . rr_1skl 1 
        6 .  841 . 1 1 6 PHE CB   C  1.068 -1.452  -0.907 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CB   . . rr_1skl 1 
        6 .  842 . 1 1 6 PHE CD1  C  1.953 -3.282   0.593 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CD1  . . rr_1skl 1 
        6 .  843 . 1 1 6 PHE CD2  C -0.076 -2.122   1.276 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CD2  . . rr_1skl 1 
        6 .  844 . 1 1 6 PHE CE1  C  1.897 -4.067   1.760 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CE1  . . rr_1skl 1 
        6 .  845 . 1 1 6 PHE CE2  C -0.135 -2.913   2.442 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CE2  . . rr_1skl 1 
        6 .  846 . 1 1 6 PHE CG   C  0.971 -2.309   0.347 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CG   . . rr_1skl 1 
        6 .  847 . 1 1 6 PHE CZ   C  0.853 -3.881   2.682 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CZ   . . rr_1skl 1 
        6 .  848 . 1 1 6 PHE H    H  1.565  0.798   0.638 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE H    . . rr_1skl 1 
        6 .  849 . 1 1 6 PHE HA   H  3.145 -0.964  -1.171 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HA   . . rr_1skl 1 
        6 .  850 . 1 1 6 PHE HB2  H  0.137 -0.896  -1.005 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HB2  . . rr_1skl 1 
        6 .  851 . 1 1 6 PHE HB3  H  1.170 -2.110  -1.769 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HB3  . . rr_1skl 1 
        6 .  852 . 1 1 6 PHE HD1  H  2.764 -3.420  -0.106 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HD1  . . rr_1skl 1 
        6 .  853 . 1 1 6 PHE HD2  H -0.833 -1.369   1.110 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HD2  . . rr_1skl 1 
        6 .  854 . 1 1 6 PHE HE1  H  2.662 -4.804   1.948 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HE1  . . rr_1skl 1 
        6 .  855 . 1 1 6 PHE HE2  H -0.933 -2.770   3.155 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HE2  . . rr_1skl 1 
        6 .  856 . 1 1 6 PHE HZ   H  0.816 -4.481   3.581 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HZ   . . rr_1skl 1 
        6 .  857 . 1 1 6 PHE N    N  2.324  0.187   0.377 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE N    . . rr_1skl 1 
        6 .  858 . 1 1 6 PHE O    O  1.799  1.810  -1.732 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE O    . . rr_1skl 1 
        7 .  859 . 1 1 1 ARG C    C  0.418  1.324  -4.662 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG C    . . rr_1skl 1 
        7 .  860 . 1 1 1 ARG CA   C  1.692  0.452  -4.586 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG CA   . . rr_1skl 1 
        7 .  861 . 1 1 1 ARG CB   C  1.704 -0.528  -5.778 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG CB   . . rr_1skl 1 
        7 .  862 . 1 1 1 ARG CD   C  2.923 -2.239  -7.152 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG CD   . . rr_1skl 1 
        7 .  863 . 1 1 1 ARG CG   C  2.965 -1.401  -5.868 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG CG   . . rr_1skl 1 
        7 .  864 . 1 1 1 ARG CZ   C  4.148 -4.404  -6.823 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG CZ   . . rr_1skl 1 
        7 .  865 . 1 1 1 ARG HA   H  2.554  1.115  -4.677 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HA   . . rr_1skl 1 
        7 .  866 . 1 1 1 ARG HB2  H  0.829 -1.178  -5.710 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HB2  . . rr_1skl 1 
        7 .  867 . 1 1 1 ARG HB3  H  1.629  0.045  -6.703 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HB3  . . rr_1skl 1 
        7 .  868 . 1 1 1 ARG HD2  H  2.002 -2.823  -7.175 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HD2  . . rr_1skl 1 
        7 .  869 . 1 1 1 ARG HD3  H  2.922 -1.570  -8.013 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HD3  . . rr_1skl 1 
        7 .  870 . 1 1 1 ARG HE   H  4.905 -2.749  -7.707 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HE   . . rr_1skl 1 
        7 .  871 . 1 1 1 ARG HG2  H  3.850 -0.762  -5.884 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HG2  . . rr_1skl 1 
        7 .  872 . 1 1 1 ARG HG3  H  3.018 -2.068  -5.007 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HG3  . . rr_1skl 1 
        7 .  873 . 1 1 1 ARG HH11 H  2.250 -4.488  -6.076 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HH11 . . rr_1skl 1 
        7 .  874 . 1 1 1 ARG HH12 H  3.187 -5.955  -5.905 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HH12 . . rr_1skl 1 
        7 .  875 . 1 1 1 ARG HH21 H  6.066 -4.669  -7.463 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HH21 . . rr_1skl 1 
        7 .  876 . 1 1 1 ARG HH22 H  5.338 -6.056  -6.687 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HH22 . . rr_1skl 1 
        7 .  877 . 1 1 1 ARG N    N  1.845 -0.316  -3.349 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG N    . . rr_1skl 1 
        7 .  878 . 1 1 1 ARG NE   N  4.086 -3.133  -7.257 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG NE   . . rr_1skl 1 
        7 .  879 . 1 1 1 ARG NH1  N  3.111 -4.997  -6.214 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG NH1  . . rr_1skl 1 
        7 .  880 . 1 1 1 ARG NH2  N  5.277 -5.099  -7.003 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG NH2  . . rr_1skl 1 
        7 .  881 . 1 1 1 ARG O    O  0.171  1.897  -5.724 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG O    . . rr_1skl 1 
        7 .  882 . 1 1 2 ARG C    C -1.915  3.281  -2.813 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG C    . . rr_1skl 1 
        7 .  883 . 1 1 2 ARG CA   C -1.729  2.015  -3.660 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG CA   . . rr_1skl 1 
        7 .  884 . 1 1 2 ARG CB   C -2.795  0.959  -3.302 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG CB   . . rr_1skl 1 
        7 .  885 . 1 1 2 ARG CD   C -1.899 -1.430  -3.394 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG CD   . . rr_1skl 1 
        7 .  886 . 1 1 2 ARG CG   C -2.721 -0.348  -4.106 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG CG   . . rr_1skl 1 
        7 .  887 . 1 1 2 ARG CZ   C -1.484 -3.867  -3.785 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG CZ   . . rr_1skl 1 
        7 .  888 . 1 1 2 ARG H    H -0.131  0.973  -2.731 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG H    . . rr_1skl 1 
        7 .  889 . 1 1 2 ARG HA   H -1.937  2.304  -4.687 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HA   . . rr_1skl 1 
        7 .  890 . 1 1 2 ARG HB2  H -2.746  0.728  -2.238 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HB2  . . rr_1skl 1 
        7 .  891 . 1 1 2 ARG HB3  H -3.769  1.401  -3.508 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HB3  . . rr_1skl 1 
        7 .  892 . 1 1 2 ARG HD2  H -0.892 -1.067  -3.193 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HD2  . . rr_1skl 1 
        7 .  893 . 1 1 2 ARG HD3  H -2.382 -1.671  -2.446 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HD3  . . rr_1skl 1 
        7 .  894 . 1 1 2 ARG HE   H -2.014 -2.517  -5.202 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HE   . . rr_1skl 1 
        7 .  895 . 1 1 2 ARG HG2  H -3.735 -0.731  -4.233 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HG2  . . rr_1skl 1 
        7 .  896 . 1 1 2 ARG HG3  H -2.307 -0.152  -5.097 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HG3  . . rr_1skl 1 
        7 .  897 . 1 1 2 ARG HH11 H -1.266 -3.361  -1.819 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HH11 . . rr_1skl 1 
        7 .  898 . 1 1 2 ARG HH12 H -0.991 -5.047  -2.192 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HH12 . . rr_1skl 1 
        7 .  899 . 1 1 2 ARG HH21 H -1.636 -4.710  -5.636 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HH21 . . rr_1skl 1 
        7 .  900 . 1 1 2 ARG HH22 H -1.202 -5.808  -4.347 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HH22 . . rr_1skl 1 
        7 .  901 . 1 1 2 ARG N    N -0.389  1.434  -3.589 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG N    . . rr_1skl 1 
        7 .  902 . 1 1 2 ARG NE   N -1.805 -2.637  -4.222 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG NE   . . rr_1skl 1 
        7 .  903 . 1 1 2 ARG NH1  N -1.218 -4.110  -2.494 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG NH1  . . rr_1skl 1 
        7 .  904 . 1 1 2 ARG NH2  N -1.431 -4.876  -4.662 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG NH2  . . rr_1skl 1 
        7 .  905 . 1 1 2 ARG O    O -2.250  4.315  -3.390 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG O    . . rr_1skl 1 
        7 .  906 . 1 1 3 NAL C1   C -4.094  1.923  -0.018 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C1   . . rr_1skl 1 
        7 .  907 . 1 1 3 NAL C10  C -2.157  4.306  -0.584 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C10  . . rr_1skl 1 
        7 .  908 . 1 1 3 NAL C11  C -1.633  4.221   0.866 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C11  . . rr_1skl 1 
        7 .  909 . 1 1 3 NAL C2   C -4.486  3.081  -0.723 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C2   . . rr_1skl 1 
        7 .  910 . 1 1 3 NAL C3   C -5.600  3.017  -1.584 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C3   . . rr_1skl 1 
        7 .  911 . 1 1 3 NAL C4   C -6.301  1.812  -1.757 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C4   . . rr_1skl 1 
        7 .  912 . 1 1 3 NAL C4A  C -5.891  0.653  -1.073 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C4A  . . rr_1skl 1 
        7 .  913 . 1 1 3 NAL C5   C -6.572 -0.564  -1.266 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C5   . . rr_1skl 1 
        7 .  914 . 1 1 3 NAL C6   C -6.148 -1.722  -0.592 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C6   . . rr_1skl 1 
        7 .  915 . 1 1 3 NAL C7   C -5.044 -1.666   0.277 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C7   . . rr_1skl 1 
        7 .  916 . 1 1 3 NAL C8   C -4.363 -0.452   0.475 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C8   . . rr_1skl 1 
        7 .  917 . 1 1 3 NAL C8A  C -4.785  0.710  -0.198 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C8A  . . rr_1skl 1 
        7 .  918 . 1 1 3 NAL C9   C -3.709  4.391  -0.608 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C9   . . rr_1skl 1 
        7 .  919 . 1 1 3 NAL H1   H -3.234  1.950   0.632 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H1   . . rr_1skl 1 
        7 .  920 . 1 1 3 NAL H10  H -1.767  5.241  -0.988 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H10  . . rr_1skl 1 
        7 .  921 . 1 1 3 NAL H3   H -5.915  3.895  -2.130 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H3   . . rr_1skl 1 
        7 .  922 . 1 1 3 NAL H4   H -7.147  1.779  -2.428 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H4   . . rr_1skl 1 
        7 .  923 . 1 1 3 NAL H5   H -7.420 -0.614  -1.934 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H5   . . rr_1skl 1 
        7 .  924 . 1 1 3 NAL H6   H -6.671 -2.655  -0.741 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H6   . . rr_1skl 1 
        7 .  925 . 1 1 3 NAL H7   H -4.721 -2.558   0.795 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H7   . . rr_1skl 1 
        7 .  926 . 1 1 3 NAL H8   H -3.515 -0.417   1.144 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H8   . . rr_1skl 1 
        7 .  927 . 1 1 3 NAL H91  H -4.081  4.933   0.261 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H91  . . rr_1skl 1 
        7 .  928 . 1 1 3 NAL H92  H -3.976  5.005  -1.468 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H92  . . rr_1skl 1 
        7 .  929 . 1 1 3 NAL HN1  H -1.432  2.352  -1.059 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL HN1  . . rr_1skl 1 
        7 .  930 . 1 1 3 NAL N    N -1.727  3.220  -1.481 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL N    . . rr_1skl 1 
        7 .  931 . 1 1 3 NAL O2   O -2.101  4.987   1.709 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL O2   . . rr_1skl 1 
        7 .  932 . 1 1 4 NAL C1   C -0.081 -0.186   4.278 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C1   . . rr_1skl 1 
        7 .  933 . 1 1 4 NAL C10  C -0.270  3.063   2.568 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C10  . . rr_1skl 1 
        7 .  934 . 1 1 4 NAL C11  C  1.245  2.860   2.683 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C11  . . rr_1skl 1 
        7 .  935 . 1 1 4 NAL C2   C -0.480  1.165   4.322 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C2   . . rr_1skl 1 
        7 .  936 . 1 1 4 NAL C3   C -0.312  1.903   5.509 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C3   . . rr_1skl 1 
        7 .  937 . 1 1 4 NAL C4   C  0.282  1.305   6.635 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C4   . . rr_1skl 1 
        7 .  938 . 1 1 4 NAL C4A  C  0.711 -0.034   6.582 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C4A  . . rr_1skl 1 
        7 .  939 . 1 1 4 NAL C5   C  1.337 -0.629   7.695 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C5   . . rr_1skl 1 
        7 .  940 . 1 1 4 NAL C6   C  1.771 -1.964   7.632 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C6   . . rr_1skl 1 
        7 .  941 . 1 1 4 NAL C7   C  1.582 -2.711   6.457 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C7   . . rr_1skl 1 
        7 .  942 . 1 1 4 NAL C8   C  0.957 -2.122   5.344 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C8   . . rr_1skl 1 
        7 .  943 . 1 1 4 NAL C8A  C  0.521 -0.785   5.401 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C8A  . . rr_1skl 1 
        7 .  944 . 1 1 4 NAL C9   C -1.046  1.830   3.077 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C9   . . rr_1skl 1 
        7 .  945 . 1 1 4 NAL H1   H -0.205 -0.759   3.370 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H1   . . rr_1skl 1 
        7 .  946 . 1 1 4 NAL H10  H -0.524  3.911   3.206 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H10  . . rr_1skl 1 
        7 .  947 . 1 1 4 NAL H3   H -0.619  2.937   5.554 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H3   . . rr_1skl 1 
        7 .  948 . 1 1 4 NAL H4   H  0.419  1.885   7.537 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H4   . . rr_1skl 1 
        7 .  949 . 1 1 4 NAL H5   H  1.494 -0.061   8.599 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H5   . . rr_1skl 1 
        7 .  950 . 1 1 4 NAL H6   H  2.251 -2.416   8.488 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H6   . . rr_1skl 1 
        7 .  951 . 1 1 4 NAL H7   H  1.917 -3.737   6.409 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H7   . . rr_1skl 1 
        7 .  952 . 1 1 4 NAL H8   H  0.820 -2.699   4.444 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H8   . . rr_1skl 1 
        7 .  953 . 1 1 4 NAL H91  H -2.078  2.123   3.275 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H91  . . rr_1skl 1 
        7 .  954 . 1 1 4 NAL H92  H -1.072  1.086   2.278 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H92  . . rr_1skl 1 
        7 .  955 . 1 1 4 NAL HN1  H -0.299  2.734   0.462 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL HN1  . . rr_1skl 1 
        7 .  956 . 1 1 4 NAL N    N -0.684  3.324   1.184 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL N    . . rr_1skl 1 
        7 .  957 . 1 1 4 NAL O2   O  1.902  3.576   3.438 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL O2   . . rr_1skl 1 
        7 .  958 . 1 1 5 ARG C    C  3.425  0.498   0.796 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG C    . . rr_1skl 1 
        7 .  959 . 1 1 5 ARG CA   C  3.167  1.416   2.001 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG CA   . . rr_1skl 1 
        7 .  960 . 1 1 5 ARG CB   C  3.422  0.770   3.383 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG CB   . . rr_1skl 1 
        7 .  961 . 1 1 5 ARG CD   C  3.957 -1.704   3.060 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG CD   . . rr_1skl 1 
        7 .  962 . 1 1 5 ARG CG   C  4.483 -0.332   3.511 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG CG   . . rr_1skl 1 
        7 .  963 . 1 1 5 ARG CZ   C  5.742 -3.396   3.558 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG CZ   . . rr_1skl 1 
        7 .  964 . 1 1 5 ARG H    H  1.161  1.360   1.342 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG H    . . rr_1skl 1 
        7 .  965 . 1 1 5 ARG HA   H  3.827  2.280   1.901 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HA   . . rr_1skl 1 
        7 .  966 . 1 1 5 ARG HB2  H  3.709  1.574   4.062 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HB2  . . rr_1skl 1 
        7 .  967 . 1 1 5 ARG HB3  H  2.490  0.367   3.771 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HB3  . . rr_1skl 1 
        7 .  968 . 1 1 5 ARG HD2  H  2.881 -1.755   3.223 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HD2  . . rr_1skl 1 
        7 .  969 . 1 1 5 ARG HD3  H  4.145 -1.842   1.996 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HD3  . . rr_1skl 1 
        7 .  970 . 1 1 5 ARG HE   H  4.070 -3.090   4.658 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HE   . . rr_1skl 1 
        7 .  971 . 1 1 5 ARG HG2  H  5.384 -0.067   2.957 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HG2  . . rr_1skl 1 
        7 .  972 . 1 1 5 ARG HG3  H  4.746 -0.397   4.569 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HG3  . . rr_1skl 1 
        7 .  973 . 1 1 5 ARG HH11 H  6.169 -2.313   1.882 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HH11 . . rr_1skl 1 
        7 .  974 . 1 1 5 ARG HH12 H  7.363 -3.512   2.323 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HH12 . . rr_1skl 1 
        7 .  975 . 1 1 5 ARG HH21 H  5.636 -4.630   5.178 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HH21 . . rr_1skl 1 
        7 .  976 . 1 1 5 ARG HH22 H  7.062 -4.819   4.185 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HH22 . . rr_1skl 1 
        7 .  977 . 1 1 5 ARG N    N  1.779  1.879   1.949 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG N    . . rr_1skl 1 
        7 .  978 . 1 1 5 ARG NE   N  4.571 -2.796   3.831 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG NE   . . rr_1skl 1 
        7 .  979 . 1 1 5 ARG NH1  N  6.484 -3.049   2.497 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG NH1  . . rr_1skl 1 
        7 .  980 . 1 1 5 ARG NH2  N  6.181 -4.363   4.371 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG NH2  . . rr_1skl 1 
        7 .  981 . 1 1 5 ARG O    O  4.556  0.413   0.319 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG O    . . rr_1skl 1 
        7 .  982 . 1 1 6 PHE C    C  2.071  0.188  -2.129 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE C    . . rr_1skl 1 
        7 .  983 . 1 1 6 PHE CA   C  2.327 -0.831  -0.999 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CA   . . rr_1skl 1 
        7 .  984 . 1 1 6 PHE CB   C  1.244 -1.924  -0.930 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CB   . . rr_1skl 1 
        7 .  985 . 1 1 6 PHE CD1  C  2.676 -3.680   0.219 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CD1  . . rr_1skl 1 
        7 .  986 . 1 1 6 PHE CD2  C  0.470 -3.194   1.130 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CD2  . . rr_1skl 1 
        7 .  987 . 1 1 6 PHE CE1  C  2.891 -4.623   1.238 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CE1  . . rr_1skl 1 
        7 .  988 . 1 1 6 PHE CE2  C  0.681 -4.149   2.140 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CE2  . . rr_1skl 1 
        7 .  989 . 1 1 6 PHE CG   C  1.468 -2.954   0.165 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CG   . . rr_1skl 1 
        7 .  990 . 1 1 6 PHE CZ   C  1.894 -4.858   2.200 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CZ   . . rr_1skl 1 
        7 .  991 . 1 1 6 PHE H    H  1.479 -0.051   0.762 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE H    . . rr_1skl 1 
        7 .  992 . 1 1 6 PHE HA   H  3.291 -1.307  -1.182 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HA   . . rr_1skl 1 
        7 .  993 . 1 1 6 PHE HB2  H  0.274 -1.445  -0.787 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HB2  . . rr_1skl 1 
        7 .  994 . 1 1 6 PHE HB3  H  1.209 -2.460  -1.877 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HB3  . . rr_1skl 1 
        7 .  995 . 1 1 6 PHE HD1  H  3.446 -3.511  -0.519 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HD1  . . rr_1skl 1 
        7 .  996 . 1 1 6 PHE HD2  H -0.462 -2.649   1.099 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HD2  . . rr_1skl 1 
        7 .  997 . 1 1 6 PHE HE1  H  3.822 -5.169   1.281 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HE1  . . rr_1skl 1 
        7 .  998 . 1 1 6 PHE HE2  H -0.088 -4.335   2.875 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HE2  . . rr_1skl 1 
        7 .  999 . 1 1 6 PHE HZ   H  2.058 -5.584   2.982 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HZ   . . rr_1skl 1 
        7 . 1000 . 1 1 6 PHE N    N  2.361 -0.137   0.279 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE N    . . rr_1skl 1 
        7 . 1001 . 1 1 6 PHE O    O  2.096  1.400  -1.908 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE O    . . rr_1skl 1 
        8 . 1002 . 1 1 1 ARG C    C  0.439  1.269  -4.701 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG C    . . rr_1skl 1 
        8 . 1003 . 1 1 1 ARG CA   C  1.810  0.552  -4.611 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG CA   . . rr_1skl 1 
        8 . 1004 . 1 1 1 ARG CB   C  2.020 -0.341  -5.855 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG CB   . . rr_1skl 1 
        8 . 1005 . 1 1 1 ARG CD   C  4.553 -0.839  -5.487 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG CD   . . rr_1skl 1 
        8 . 1006 . 1 1 1 ARG CG   C  3.158 -1.380  -5.832 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG CG   . . rr_1skl 1 
        8 . 1007 . 1 1 1 ARG CZ   C  6.048 -0.880  -3.473 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG CZ   . . rr_1skl 1 
        8 . 1008 . 1 1 1 ARG HA   H  2.598  1.306  -4.583 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HA   . . rr_1skl 1 
        8 . 1009 . 1 1 1 ARG HB2  H  1.096 -0.890  -6.042 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HB2  . . rr_1skl 1 
        8 . 1010 . 1 1 1 ARG HB3  H  2.186  0.315  -6.712 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HB3  . . rr_1skl 1 
        8 . 1011 . 1 1 1 ARG HD2  H  5.288 -1.445  -6.017 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HD2  . . rr_1skl 1 
        8 . 1012 . 1 1 1 ARG HD3  H  4.646  0.194  -5.823 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HD3  . . rr_1skl 1 
        8 . 1013 . 1 1 1 ARG HE   H  4.035 -1.072  -3.443 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HE   . . rr_1skl 1 
        8 . 1014 . 1 1 1 ARG HG2  H  2.901 -2.190  -5.148 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HG2  . . rr_1skl 1 
        8 . 1015 . 1 1 1 ARG HG3  H  3.211 -1.815  -6.831 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HG3  . . rr_1skl 1 
        8 . 1016 . 1 1 1 ARG HH11 H  7.095 -0.572  -5.197 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HH11 . . rr_1skl 1 
        8 . 1017 . 1 1 1 ARG HH12 H  8.060 -0.657  -3.741 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HH12 . . rr_1skl 1 
        8 . 1018 . 1 1 1 ARG HH21 H  5.320 -1.173  -1.589 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HH21 . . rr_1skl 1 
        8 . 1019 . 1 1 1 ARG HH22 H  7.056 -1.003  -1.706 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HH22 . . rr_1skl 1 
        8 . 1020 . 1 1 1 ARG N    N  1.917 -0.269  -3.406 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG N    . . rr_1skl 1 
        8 . 1021 . 1 1 1 ARG NE   N  4.833 -0.928  -4.045 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG NE   . . rr_1skl 1 
        8 . 1022 . 1 1 1 ARG NH1  N  7.159 -0.688  -4.196 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG NH1  . . rr_1skl 1 
        8 . 1023 . 1 1 1 ARG NH2  N  6.149 -1.033  -2.148 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG NH2  . . rr_1skl 1 
        8 . 1024 . 1 1 1 ARG O    O  0.012  1.611  -5.804 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG O    . . rr_1skl 1 
        8 . 1025 . 1 1 2 ARG C    C -1.939  3.151  -2.748 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG C    . . rr_1skl 1 
        8 . 1026 . 1 1 2 ARG CA   C -1.670  1.859  -3.533 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG CA   . . rr_1skl 1 
        8 . 1027 . 1 1 2 ARG CB   C -2.520  0.693  -2.980 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG CB   . . rr_1skl 1 
        8 . 1028 . 1 1 2 ARG CD   C -3.009 -1.831  -2.939 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG CD   . . rr_1skl 1 
        8 . 1029 . 1 1 2 ARG CG   C -2.234 -0.684  -3.612 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG CG   . . rr_1skl 1 
        8 . 1030 . 1 1 2 ARG CZ   C -4.993 -2.202  -4.437 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG CZ   . . rr_1skl 1 
        8 . 1031 . 1 1 2 ARG H    H  0.158  1.218  -2.691 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG H    . . rr_1skl 1 
        8 . 1032 . 1 1 2 ARG HA   H -2.019  2.032  -4.546 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HA   . . rr_1skl 1 
        8 . 1033 . 1 1 2 ARG HB2  H -2.355  0.607  -1.906 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HB2  . . rr_1skl 1 
        8 . 1034 . 1 1 2 ARG HB3  H -3.564  0.950  -3.161 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HB3  . . rr_1skl 1 
        8 . 1035 . 1 1 2 ARG HD2  H -2.570 -2.779  -3.254 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HD2  . . rr_1skl 1 
        8 . 1036 . 1 1 2 ARG HD3  H -2.888 -1.756  -1.857 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HD3  . . rr_1skl 1 
        8 . 1037 . 1 1 2 ARG HE   H -5.082 -1.670  -2.492 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HE   . . rr_1skl 1 
        8 . 1038 . 1 1 2 ARG HG2  H -2.456 -0.648  -4.678 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HG2  . . rr_1skl 1 
        8 . 1039 . 1 1 2 ARG HG3  H -1.177 -0.921  -3.496 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HG3  . . rr_1skl 1 
        8 . 1040 . 1 1 2 ARG HH11 H -3.236 -2.571  -5.410 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HH11 . . rr_1skl 1 
        8 . 1041 . 1 1 2 ARG HH12 H -4.683 -2.823  -6.359 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HH12 . . rr_1skl 1 
        8 . 1042 . 1 1 2 ARG HH21 H -6.906 -1.935  -3.783 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HH21 . . rr_1skl 1 
        8 . 1043 . 1 1 2 ARG HH22 H -6.748 -2.465  -5.442 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HH22 . . rr_1skl 1 
        8 . 1044 . 1 1 2 ARG N    N -0.262  1.473  -3.568 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG N    . . rr_1skl 1 
        8 . 1045 . 1 1 2 ARG NE   N -4.448 -1.851  -3.258 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG NE   . . rr_1skl 1 
        8 . 1046 . 1 1 2 ARG NH1  N -4.242 -2.562  -5.489 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG NH1  . . rr_1skl 1 
        8 . 1047 . 1 1 2 ARG NH2  N -6.324 -2.201  -4.564 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG NH2  . . rr_1skl 1 
        8 . 1048 . 1 1 2 ARG O    O -2.371  4.124  -3.366 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG O    . . rr_1skl 1 
        8 . 1049 . 1 1 3 NAL C1   C -3.926  1.776   0.255 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C1   . . rr_1skl 1 
        8 . 1050 . 1 1 3 NAL C10  C -2.203  4.259  -0.555 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C10  . . rr_1skl 1 
        8 . 1051 . 1 1 3 NAL C11  C -1.628  4.273   0.880 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C11  . . rr_1skl 1 
        8 . 1052 . 1 1 3 NAL C2   C -4.423  2.837  -0.530 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C2   . . rr_1skl 1 
        8 . 1053 . 1 1 3 NAL C3   C -5.551  2.614  -1.346 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C3   . . rr_1skl 1 
        8 . 1054 . 1 1 3 NAL C4   C -6.169  1.352  -1.382 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C4   . . rr_1skl 1 
        8 . 1055 . 1 1 3 NAL C4A  C -5.663  0.295  -0.603 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C4A  . . rr_1skl 1 
        8 . 1056 . 1 1 3 NAL C5   C -6.275 -0.973  -0.638 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C5   . . rr_1skl 1 
        8 . 1057 . 1 1 3 NAL C6   C -5.754 -2.027   0.133 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C6   . . rr_1skl 1 
        8 . 1058 . 1 1 3 NAL C7   C -4.623 -1.817   0.942 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C7   . . rr_1skl 1 
        8 . 1059 . 1 1 3 NAL C8   C -4.014 -0.551   0.985 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C8   . . rr_1skl 1 
        8 . 1060 . 1 1 3 NAL C8A  C -4.533  0.508   0.215 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C8A  . . rr_1skl 1 
        8 . 1061 . 1 1 3 NAL C9   C -3.755  4.213  -0.529 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C9   . . rr_1skl 1 
        8 . 1062 . 1 1 3 NAL H1   H -3.058  1.924   0.872 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H1   . . rr_1skl 1 
        8 . 1063 . 1 1 3 NAL H10  H -1.904  5.205  -1.010 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H10  . . rr_1skl 1 
        8 . 1064 . 1 1 3 NAL H3   H -5.947  3.414  -1.954 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H3   . . rr_1skl 1 
        8 . 1065 . 1 1 3 NAL H4   H -7.032  1.199  -2.013 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H4   . . rr_1skl 1 
        8 . 1066 . 1 1 3 NAL H5   H -7.144 -1.142  -1.258 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H5   . . rr_1skl 1 
        8 . 1067 . 1 1 3 NAL H6   H -6.224 -2.999   0.105 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H6   . . rr_1skl 1 
        8 . 1068 . 1 1 3 NAL H7   H -4.226 -2.628   1.535 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H7   . . rr_1skl 1 
        8 . 1069 . 1 1 3 NAL H8   H -3.149 -0.395   1.613 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H8   . . rr_1skl 1 
        8 . 1070 . 1 1 3 NAL H91  H -4.139  4.778   0.320 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H91  . . rr_1skl 1 
        8 . 1071 . 1 1 3 NAL H92  H -4.102  4.745  -1.415 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H92  . . rr_1skl 1 
        8 . 1072 . 1 1 3 NAL HN1  H -1.344  2.355  -0.963 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL HN1  . . rr_1skl 1 
        8 . 1073 . 1 1 3 NAL N    N -1.715  3.174  -1.419 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL N    . . rr_1skl 1 
        8 . 1074 . 1 1 3 NAL O2   O -2.086  5.082   1.689 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL O2   . . rr_1skl 1 
        8 . 1075 . 1 1 4 NAL C1   C -0.016  0.067   4.326 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C1   . . rr_1skl 1 
        8 . 1076 . 1 1 4 NAL C10  C -0.205  3.224   2.612 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C10  . . rr_1skl 1 
        8 . 1077 . 1 1 4 NAL C11  C  1.292  2.902   2.689 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C11  . . rr_1skl 1 
        8 . 1078 . 1 1 4 NAL C2   C -0.456  1.399   4.447 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C2   . . rr_1skl 1 
        8 . 1079 . 1 1 4 NAL C3   C -0.300  2.074   5.672 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C3   . . rr_1skl 1 
        8 . 1080 . 1 1 4 NAL C4   C  0.306  1.425   6.764 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C4   . . rr_1skl 1 
        8 . 1081 . 1 1 4 NAL C4A  C  0.776  0.104   6.632 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C4A  . . rr_1skl 1 
        8 . 1082 . 1 1 4 NAL C5   C  1.417 -0.541   7.707 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C5   . . rr_1skl 1 
        8 . 1083 . 1 1 4 NAL C6   C  1.910 -1.849   7.554 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C6   . . rr_1skl 1 
        8 . 1084 . 1 1 4 NAL C7   C  1.770 -2.517   6.324 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C7   . . rr_1skl 1 
        8 . 1085 . 1 1 4 NAL C8   C  1.125 -1.880   5.250 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C8   . . rr_1skl 1 
        8 . 1086 . 1 1 4 NAL C8A  C  0.618 -0.576   5.404 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C8A  . . rr_1skl 1 
        8 . 1087 . 1 1 4 NAL C9   C -1.061  2.104   3.244 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C9   . . rr_1skl 1 
        8 . 1088 . 1 1 4 NAL H1   H -0.131 -0.456   3.390 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H1   . . rr_1skl 1 
        8 . 1089 . 1 1 4 NAL H10  H -0.359  4.141   3.186 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H10  . . rr_1skl 1 
        8 . 1090 . 1 1 4 NAL H3   H -0.633  3.097   5.772 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H3   . . rr_1skl 1 
        8 . 1091 . 1 1 4 NAL H4   H  0.425  1.953   7.699 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H4   . . rr_1skl 1 
        8 . 1092 . 1 1 4 NAL H5   H  1.540 -0.031   8.652 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H5   . . rr_1skl 1 
        8 . 1093 . 1 1 4 NAL H6   H  2.404 -2.339   8.380 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H6   . . rr_1skl 1 
        8 . 1094 . 1 1 4 NAL H7   H  2.159 -3.517   6.205 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H7   . . rr_1skl 1 
        8 . 1095 . 1 1 4 NAL H8   H  1.038 -2.390   4.301 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H8   . . rr_1skl 1 
        8 . 1096 . 1 1 4 NAL H91  H -2.027  2.521   3.529 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H91  . . rr_1skl 1 
        8 . 1097 . 1 1 4 NAL H92  H -1.254  1.346   2.482 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H92  . . rr_1skl 1 
        8 . 1098 . 1 1 4 NAL HN1  H -0.284  2.782   0.528 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL HN1  . . rr_1skl 1 
        8 . 1099 . 1 1 4 NAL N    N -0.658  3.409   1.226 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL N    . . rr_1skl 1 
        8 . 1100 . 1 1 4 NAL O2   O  2.020  3.577   3.415 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL O2   . . rr_1skl 1 
        8 . 1101 . 1 1 5 ARG C    C  3.304  0.478   0.696 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG C    . . rr_1skl 1 
        8 . 1102 . 1 1 5 ARG CA   C  3.121  1.388   1.920 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG CA   . . rr_1skl 1 
        8 . 1103 . 1 1 5 ARG CB   C  3.454  0.728   3.278 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG CB   . . rr_1skl 1 
        8 . 1104 . 1 1 5 ARG CD   C  3.893 -1.729   2.781 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG CD   . . rr_1skl 1 
        8 . 1105 . 1 1 5 ARG CG   C  4.482 -0.411   3.310 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG CG   . . rr_1skl 1 
        8 . 1106 . 1 1 5 ARG CZ   C  4.171 -4.157   3.318 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG CZ   . . rr_1skl 1 
        8 . 1107 . 1 1 5 ARG H    H  1.075  1.385   1.375 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG H    . . rr_1skl 1 
        8 . 1108 . 1 1 5 ARG HA   H  3.788  2.242   1.789 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HA   . . rr_1skl 1 
        8 . 1109 . 1 1 5 ARG HB2  H  3.816  1.516   3.940 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HB2  . . rr_1skl 1 
        8 . 1110 . 1 1 5 ARG HB3  H  2.542  0.348   3.726 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HB3  . . rr_1skl 1 
        8 . 1111 . 1 1 5 ARG HD2  H  2.807 -1.646   2.712 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HD2  . . rr_1skl 1 
        8 . 1112 . 1 1 5 ARG HD3  H  4.289 -1.915   1.783 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HD3  . . rr_1skl 1 
        8 . 1113 . 1 1 5 ARG HE   H  4.396 -2.634   4.632 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HE   . . rr_1skl 1 
        8 . 1114 . 1 1 5 ARG HG2  H  5.369 -0.138   2.738 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HG2  . . rr_1skl 1 
        8 . 1115 . 1 1 5 ARG HG3  H  4.783 -0.548   4.351 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HG3  . . rr_1skl 1 
        8 . 1116 . 1 1 5 ARG HH11 H  3.766 -3.846   1.343 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HH11 . . rr_1skl 1 
        8 . 1117 . 1 1 5 ARG HH12 H  3.910 -5.522   1.822 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HH12 . . rr_1skl 1 
        8 . 1118 . 1 1 5 ARG HH21 H  4.558 -4.817   5.208 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HH21 . . rr_1skl 1 
        8 . 1119 . 1 1 5 ARG HH22 H  4.355 -6.069   4.004 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HH22 . . rr_1skl 1 
        8 . 1120 . 1 1 5 ARG N    N  1.741  1.880   1.949 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG N    . . rr_1skl 1 
        8 . 1121 . 1 1 5 ARG NE   N  4.201 -2.861   3.667 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG NE   . . rr_1skl 1 
        8 . 1122 . 1 1 5 ARG NH1  N  3.932 -4.540   2.057 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG NH1  . . rr_1skl 1 
        8 . 1123 . 1 1 5 ARG NH2  N  4.381 -5.090   4.253 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG NH2  . . rr_1skl 1 
        8 . 1124 . 1 1 5 ARG O    O  4.400  0.417   0.140 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG O    . . rr_1skl 1 
        8 . 1125 . 1 1 6 PHE C    C  2.130  0.194  -2.170 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE C    . . rr_1skl 1 
        8 . 1126 . 1 1 6 PHE CA   C  2.121 -0.855  -1.039 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CA   . . rr_1skl 1 
        8 . 1127 . 1 1 6 PHE CB   C  0.820 -1.682  -1.077 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CB   . . rr_1skl 1 
        8 . 1128 . 1 1 6 PHE CD1  C  1.252 -4.032  -0.242 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CD1  . . rr_1skl 1 
        8 . 1129 . 1 1 6 PHE CD2  C -0.039 -2.514   1.160 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CD2  . . rr_1skl 1 
        8 . 1130 . 1 1 6 PHE CE1  C  1.077 -5.056   0.705 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CE1  . . rr_1skl 1 
        8 . 1131 . 1 1 6 PHE CE2  C -0.208 -3.538   2.109 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CE2  . . rr_1skl 1 
        8 . 1132 . 1 1 6 PHE CG   C  0.692 -2.759  -0.018 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CG   . . rr_1skl 1 
        8 . 1133 . 1 1 6 PHE CZ   C  0.351 -4.808   1.883 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CZ   . . rr_1skl 1 
        8 . 1134 . 1 1 6 PHE H    H  1.375 -0.138   0.793 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE H    . . rr_1skl 1 
        8 . 1135 . 1 1 6 PHE HA   H  2.971 -1.527  -1.166 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HA   . . rr_1skl 1 
        8 . 1136 . 1 1 6 PHE HB2  H -0.031 -1.003  -0.998 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HB2  . . rr_1skl 1 
        8 . 1137 . 1 1 6 PHE HB3  H  0.744 -2.187  -2.041 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HB3  . . rr_1skl 1 
        8 . 1138 . 1 1 6 PHE HD1  H  1.804 -4.231  -1.149 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HD1  . . rr_1skl 1 
        8 . 1139 . 1 1 6 PHE HD2  H -0.485 -1.546   1.331 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HD2  . . rr_1skl 1 
        8 . 1140 . 1 1 6 PHE HE1  H  1.499 -6.034   0.526 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HE1  . . rr_1skl 1 
        8 . 1141 . 1 1 6 PHE HE2  H -0.776 -3.351   3.008 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HE2  . . rr_1skl 1 
        8 . 1142 . 1 1 6 PHE HZ   H  0.217 -5.595   2.610 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HZ   . . rr_1skl 1 
        8 . 1143 . 1 1 6 PHE N    N  2.220 -0.179   0.247 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE N    . . rr_1skl 1 
        8 . 1144 . 1 1 6 PHE O    O  2.298  1.394  -1.939 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE O    . . rr_1skl 1 
        9 . 1145 . 1 1 1 ARG C    C  0.346  1.660  -4.366 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG C    . . rr_1skl 1 
        9 . 1146 . 1 1 1 ARG CA   C  1.746  1.000  -4.396 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG CA   . . rr_1skl 1 
        9 . 1147 . 1 1 1 ARG CB   C  1.961  0.150  -5.665 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG CB   . . rr_1skl 1 
        9 . 1148 . 1 1 1 ARG CD   C  2.430  0.009  -8.128 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG CD   . . rr_1skl 1 
        9 . 1149 . 1 1 1 ARG CG   C  2.022  0.941  -6.981 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG CG   . . rr_1skl 1 
        9 . 1150 . 1 1 1 ARG CZ   C  2.866  0.188 -10.582 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG CZ   . . rr_1skl 1 
        9 . 1151 . 1 1 1 ARG HA   H  2.499  1.790  -4.373 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HA   . . rr_1skl 1 
        9 . 1152 . 1 1 1 ARG HB2  H  2.908 -0.383  -5.556 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HB2  . . rr_1skl 1 
        9 . 1153 . 1 1 1 ARG HB3  H  1.164 -0.593  -5.735 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HB3  . . rr_1skl 1 
        9 . 1154 . 1 1 1 ARG HD2  H  3.429 -0.381  -7.930 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HD2  . . rr_1skl 1 
        9 . 1155 . 1 1 1 ARG HD3  H  1.728 -0.824  -8.180 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HD3  . . rr_1skl 1 
        9 . 1156 . 1 1 1 ARG HE   H  2.062  1.648  -9.428 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HE   . . rr_1skl 1 
        9 . 1157 . 1 1 1 ARG HG2  H  1.043  1.365  -7.205 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HG2  . . rr_1skl 1 
        9 . 1158 . 1 1 1 ARG HG3  H  2.753  1.745  -6.892 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HG3  . . rr_1skl 1 
        9 . 1159 . 1 1 1 ARG HH11 H  3.441 -1.616  -9.817 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HH11 . . rr_1skl 1 
        9 . 1160 . 1 1 1 ARG HH12 H  3.694 -1.417 -11.536 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HH12 . . rr_1skl 1 
        9 . 1161 . 1 1 1 ARG HH21 H  2.408  1.856 -11.664 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HH21 . . rr_1skl 1 
        9 . 1162 . 1 1 1 ARG HH22 H  3.112  0.541 -12.576 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HH22 . . rr_1skl 1 
        9 . 1163 . 1 1 1 ARG N    N  1.980  0.115  -3.255 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG N    . . rr_1skl 1 
        9 . 1164 . 1 1 1 ARG NE   N  2.432  0.709  -9.421 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG NE   . . rr_1skl 1 
        9 . 1165 . 1 1 1 ARG NH1  N  3.374 -1.051 -10.651 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG NH1  . . rr_1skl 1 
        9 . 1166 . 1 1 1 ARG NH2  N  2.790  0.922 -11.698 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG NH2  . . rr_1skl 1 
        9 . 1167 . 1 1 1 ARG O    O  0.086  2.570  -5.152 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG O    . . rr_1skl 1 
        9 . 1168 . 1 1 2 ARG C    C -2.230  2.962  -2.889 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG C    . . rr_1skl 1 
        9 . 1169 . 1 1 2 ARG CA   C -1.968  1.559  -3.458 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG CA   . . rr_1skl 1 
        9 . 1170 . 1 1 2 ARG CB   C -2.765  0.498  -2.671 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG CB   . . rr_1skl 1 
        9 . 1171 . 1 1 2 ARG CD   C -3.280 -1.969  -2.252 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG CD   . . rr_1skl 1 
        9 . 1172 . 1 1 2 ARG CG   C -2.467 -0.958  -3.077 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG CG   . . rr_1skl 1 
        9 . 1173 . 1 1 2 ARG CZ   C -5.268 -3.456  -2.641 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG CZ   . . rr_1skl 1 
        9 . 1174 . 1 1 2 ARG H    H -0.261  0.487  -2.828 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG H    . . rr_1skl 1 
        9 . 1175 . 1 1 2 ARG HA   H -2.338  1.543  -4.478 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HA   . . rr_1skl 1 
        9 . 1176 . 1 1 2 ARG HB2  H -2.547  0.601  -1.608 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HB2  . . rr_1skl 1 
        9 . 1177 . 1 1 2 ARG HB3  H -3.825  0.697  -2.838 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HB3  . . rr_1skl 1 
        9 . 1178 . 1 1 2 ARG HD2  H -2.629 -2.802  -1.977 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HD2  . . rr_1skl 1 
        9 . 1179 . 1 1 2 ARG HD3  H -3.621 -1.509  -1.322 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HD3  . . rr_1skl 1 
        9 . 1180 . 1 1 2 ARG HE   H -4.548 -2.112  -3.956 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HE   . . rr_1skl 1 
        9 . 1181 . 1 1 2 ARG HG2  H -2.665 -1.090  -4.143 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HG2  . . rr_1skl 1 
        9 . 1182 . 1 1 2 ARG HG3  H -1.413 -1.172  -2.910 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HG3  . . rr_1skl 1 
        9 . 1183 . 1 1 2 ARG HH11 H -4.418 -3.788  -0.816 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HH11 . . rr_1skl 1 
        9 . 1184 . 1 1 2 ARG HH12 H -5.800 -4.793  -1.195 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HH12 . . rr_1skl 1 
        9 . 1185 . 1 1 2 ARG HH21 H -6.340 -3.381  -4.374 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HH21 . . rr_1skl 1 
        9 . 1186 . 1 1 2 ARG HH22 H -6.887 -4.561  -3.207 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HH22 . . rr_1skl 1 
        9 . 1187 . 1 1 2 ARG N    N -0.551  1.208  -3.472 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG N    . . rr_1skl 1 
        9 . 1188 . 1 1 2 ARG NE   N -4.424 -2.484  -3.025 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG NE   . . rr_1skl 1 
        9 . 1189 . 1 1 2 ARG NH1  N -5.151 -4.064  -1.453 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG NH1  . . rr_1skl 1 
        9 . 1190 . 1 1 2 ARG NH2  N -6.245 -3.829  -3.474 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG NH2  . . rr_1skl 1 
        9 . 1191 . 1 1 2 ARG O    O -2.814  3.792  -3.585 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG O    . . rr_1skl 1 
        9 . 1192 . 1 1 3 NAL C1   C -4.083  2.155   0.305 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C1   . . rr_1skl 1 
        9 . 1193 . 1 1 3 NAL C10  C -2.167  4.385  -0.828 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C10  . . rr_1skl 1 
        9 . 1194 . 1 1 3 NAL C11  C -1.463  4.370   0.550 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C11  . . rr_1skl 1 
        9 . 1195 . 1 1 3 NAL C2   C -4.484  3.174  -0.582 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C2   . . rr_1skl 1 
        9 . 1196 . 1 1 3 NAL C3   C -5.598  2.957  -1.419 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C3   . . rr_1skl 1 
        9 . 1197 . 1 1 3 NAL C4   C -6.295  1.737  -1.376 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C4   . . rr_1skl 1 
        9 . 1198 . 1 1 3 NAL C4A  C -5.882  0.717  -0.499 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C4A  . . rr_1skl 1 
        9 . 1199 . 1 1 3 NAL C5   C -6.569 -0.511  -0.459 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C5   . . rr_1skl 1 
        9 . 1200 . 1 1 3 NAL C6   C -6.147 -1.524   0.419 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C6   . . rr_1skl 1 
        9 . 1201 . 1 1 3 NAL C7   C -5.030 -1.319   1.249 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C7   . . rr_1skl 1 
        9 . 1202 . 1 1 3 NAL C8   C -4.341 -0.095   1.212 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C8   . . rr_1skl 1 
        9 . 1203 . 1 1 3 NAL C8A  C -4.769  0.928   0.344 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C8A  . . rr_1skl 1 
        9 . 1204 . 1 1 3 NAL C9   C -3.708  4.487  -0.675 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C9   . . rr_1skl 1 
        9 . 1205 . 1 1 3 NAL H1   H -3.228  2.305   0.940 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H1   . . rr_1skl 1 
        9 . 1206 . 1 1 3 NAL H10  H -1.818  5.272  -1.358 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H10  . . rr_1skl 1 
        9 . 1207 . 1 1 3 NAL H3   H -5.919  3.726  -2.107 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H3   . . rr_1skl 1 
        9 . 1208 . 1 1 3 NAL H4   H -7.145  1.585  -2.025 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H4   . . rr_1skl 1 
        9 . 1209 . 1 1 3 NAL H5   H -7.423 -0.679  -1.099 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H5   . . rr_1skl 1 
        9 . 1210 . 1 1 3 NAL H6   H -6.679 -2.463   0.454 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H6   . . rr_1skl 1 
        9 . 1211 . 1 1 3 NAL H7   H -4.704 -2.102   1.918 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H7   . . rr_1skl 1 
        9 . 1212 . 1 1 3 NAL H8   H -3.486  0.058   1.855 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H8   . . rr_1skl 1 
        9 . 1213 . 1 1 3 NAL H91  H -3.961  5.097   0.192 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H91  . . rr_1skl 1 
        9 . 1214 . 1 1 3 NAL H92  H -4.080  5.033  -1.542 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H92  . . rr_1skl 1 
        9 . 1215 . 1 1 3 NAL HN1  H -1.328  2.481  -1.142 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL HN1  . . rr_1skl 1 
        9 . 1216 . 1 1 3 NAL N    N -1.820  3.208  -1.634 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL N    . . rr_1skl 1 
        9 . 1217 . 1 1 3 NAL O2   O -1.735  5.236   1.381 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL O2   . . rr_1skl 1 
        9 . 1218 . 1 1 4 NAL C1   C -0.501  0.533   4.761 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C1   . . rr_1skl 1 
        9 . 1219 . 1 1 4 NAL C10  C  0.053  3.123   2.100 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C10  . . rr_1skl 1 
        9 . 1220 . 1 1 4 NAL C11  C  1.470  2.573   1.847 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C11  . . rr_1skl 1 
        9 . 1221 . 1 1 4 NAL C2   C -0.467  1.868   4.319 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C2   . . rr_1skl 1 
        9 . 1222 . 1 1 4 NAL C3   C -0.045  2.884   5.200 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C3   . . rr_1skl 1 
        9 . 1223 . 1 1 4 NAL C4   C  0.362  2.562   6.506 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C4   . . rr_1skl 1 
        9 . 1224 . 1 1 4 NAL C4A  C  0.332  1.226   6.946 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C4A  . . rr_1skl 1 
        9 . 1225 . 1 1 4 NAL C5   C  0.737  0.899   8.254 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C5   . . rr_1skl 1 
        9 . 1226 . 1 1 4 NAL C6   C  0.688 -0.436   8.693 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C6   . . rr_1skl 1 
        9 . 1227 . 1 1 4 NAL C7   C  0.233 -1.446   7.829 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C7   . . rr_1skl 1 
        9 . 1228 . 1 1 4 NAL C8   C -0.166 -1.125   6.519 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C8   . . rr_1skl 1 
        9 . 1229 . 1 1 4 NAL C8A  C -0.112  0.208   6.073 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C8A  . . rr_1skl 1 
        9 . 1230 . 1 1 4 NAL C9   C -0.883  2.192   2.895 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C9   . . rr_1skl 1 
        9 . 1231 . 1 1 4 NAL H1   H -0.830 -0.240   4.085 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H1   . . rr_1skl 1 
        9 . 1232 . 1 1 4 NAL H10  H  0.167  4.062   2.648 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H10  . . rr_1skl 1 
        9 . 1233 . 1 1 4 NAL H3   H -0.026  3.915   4.879 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H3   . . rr_1skl 1 
        9 . 1234 . 1 1 4 NAL H4   H  0.692  3.347   7.171 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H4   . . rr_1skl 1 
        9 . 1235 . 1 1 4 NAL H5   H  1.083  1.670   8.926 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H5   . . rr_1skl 1 
        9 . 1236 . 1 1 4 NAL H6   H  0.996 -0.685   9.698 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H6   . . rr_1skl 1 
        9 . 1237 . 1 1 4 NAL H7   H  0.189 -2.469   8.172 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H7   . . rr_1skl 1 
        9 . 1238 . 1 1 4 NAL H8   H -0.514 -1.907   5.859 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H8   . . rr_1skl 1 
        9 . 1239 . 1 1 4 NAL H91  H -1.868  2.656   2.948 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H91  . . rr_1skl 1 
        9 . 1240 . 1 1 4 NAL H92  H -0.994  1.262   2.333 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H92  . . rr_1skl 1 
        9 . 1241 . 1 1 4 NAL HN1  H -0.373  2.732   0.067 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL HN1  . . rr_1skl 1 
        9 . 1242 . 1 1 4 NAL N    N -0.579  3.390   0.805 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL N    . . rr_1skl 1 
        9 . 1243 . 1 1 4 NAL O2   O  2.139  3.096   0.953 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL O2   . . rr_1skl 1 
        9 . 1244 . 1 1 5 ARG C    C  3.369  0.314   0.959 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG C    . . rr_1skl 1 
        9 . 1245 . 1 1 5 ARG CA   C  3.298  0.999   2.341 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG CA   . . rr_1skl 1 
        9 . 1246 . 1 1 5 ARG CB   C  3.885  0.119   3.483 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG CB   . . rr_1skl 1 
        9 . 1247 . 1 1 5 ARG CD   C  2.449 -2.022   3.143 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG CD   . . rr_1skl 1 
        9 . 1248 . 1 1 5 ARG CG   C  3.845 -1.409   3.287 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG CG   . . rr_1skl 1 
        9 . 1249 . 1 1 5 ARG CZ   C  2.044 -3.794   4.867 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG CZ   . . rr_1skl 1 
        9 . 1250 . 1 1 5 ARG H    H  1.385  1.205   3.360 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG H    . . rr_1skl 1 
        9 . 1251 . 1 1 5 ARG HA   H  3.956  1.863   2.288 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HA   . . rr_1skl 1 
        9 . 1252 . 1 1 5 ARG HB2  H  4.951  0.366   3.567 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HB2  . . rr_1skl 1 
        9 . 1253 . 1 1 5 ARG HB3  H  3.448  0.378   4.447 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HB3  . . rr_1skl 1 
        9 . 1254 . 1 1 5 ARG HD2  H  1.754 -1.287   2.744 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HD2  . . rr_1skl 1 
        9 . 1255 . 1 1 5 ARG HD3  H  2.516 -2.842   2.429 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HD3  . . rr_1skl 1 
        9 . 1256 . 1 1 5 ARG HE   H  1.446 -1.862   5.007 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HE   . . rr_1skl 1 
        9 . 1257 . 1 1 5 ARG HG2  H  4.417 -1.659   2.393 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HG2  . . rr_1skl 1 
        9 . 1258 . 1 1 5 ARG HG3  H  4.362 -1.883   4.123 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HG3  . . rr_1skl 1 
        9 . 1259 . 1 1 5 ARG HH11 H  3.088 -4.511   3.266 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HH11 . . rr_1skl 1 
        9 . 1260 . 1 1 5 ARG HH12 H  2.749 -5.680   4.522 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HH12 . . rr_1skl 1 
        9 . 1261 . 1 1 5 ARG HH21 H  1.031 -3.425   6.597 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HH21 . . rr_1skl 1 
        9 . 1262 . 1 1 5 ARG HH22 H  1.590 -5.070   6.390 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HH22 . . rr_1skl 1 
        9 . 1263 . 1 1 5 ARG N    N  1.965  1.576   2.614 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG N    . . rr_1skl 1 
        9 . 1264 . 1 1 5 ARG NE   N  1.929 -2.528   4.422 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG NE   . . rr_1skl 1 
        9 . 1265 . 1 1 5 ARG NH1  N  2.680 -4.739   4.161 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG NH1  . . rr_1skl 1 
        9 . 1266 . 1 1 5 ARG NH2  N  1.510 -4.123   6.047 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG NH2  . . rr_1skl 1 
        9 . 1267 . 1 1 5 ARG O    O  4.460  0.196   0.400 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG O    . . rr_1skl 1 
        9 . 1268 . 1 1 6 PHE C    C  2.061  0.499  -1.977 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE C    . . rr_1skl 1 
        9 . 1269 . 1 1 6 PHE CA   C  2.089 -0.641  -0.945 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CA   . . rr_1skl 1 
        9 . 1270 . 1 1 6 PHE CB   C  0.793 -1.468  -1.055 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CB   . . rr_1skl 1 
        9 . 1271 . 1 1 6 PHE CD1  C  1.218 -3.702   0.063 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CD1  . . rr_1skl 1 
        9 . 1272 . 1 1 6 PHE CD2  C -0.460 -2.218   1.021 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CD2  . . rr_1skl 1 
        9 . 1273 . 1 1 6 PHE CE1  C  0.927 -4.664   1.046 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CE1  . . rr_1skl 1 
        9 . 1274 . 1 1 6 PHE CE2  C -0.748 -3.179   2.005 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CE2  . . rr_1skl 1 
        9 . 1275 . 1 1 6 PHE CG   C  0.525 -2.477   0.046 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CG   . . rr_1skl 1 
        9 . 1276 . 1 1 6 PHE CZ   C -0.057 -4.403   2.016 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CZ   . . rr_1skl 1 
        9 . 1277 . 1 1 6 PHE H    H  1.357  0.030   0.904 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE H    . . rr_1skl 1 
        9 . 1278 . 1 1 6 PHE HA   H  2.936 -1.297  -1.154 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HA   . . rr_1skl 1 
        9 . 1279 . 1 1 6 PHE HB2  H -0.049 -0.775  -1.093 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HB2  . . rr_1skl 1 
        9 . 1280 . 1 1 6 PHE HB3  H  0.820 -2.024  -1.997 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HB3  . . rr_1skl 1 
        9 . 1281 . 1 1 6 PHE HD1  H  1.969 -3.912  -0.686 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HD1  . . rr_1skl 1 
        9 . 1282 . 1 1 6 PHE HD2  H -1.005 -1.285   1.011 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HD2  . . rr_1skl 1 
        9 . 1283 . 1 1 6 PHE HE1  H  1.458 -5.605   1.055 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HE1  . . rr_1skl 1 
        9 . 1284 . 1 1 6 PHE HE2  H -1.505 -2.980   2.749 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HE2  . . rr_1skl 1 
        9 . 1285 . 1 1 6 PHE HZ   H -0.281 -5.144   2.770 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HZ   . . rr_1skl 1 
        9 . 1286 . 1 1 6 PHE N    N  2.219 -0.105   0.401 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE N    . . rr_1skl 1 
        9 . 1287 . 1 1 6 PHE O    O  2.052  1.683  -1.636 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE O    . . rr_1skl 1 
       10 . 1288 . 1 1 1 ARG C    C  0.271  1.206  -4.617 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG C    . . rr_1skl 1 
       10 . 1289 . 1 1 1 ARG CA   C  1.728  0.872  -4.259 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG CA   . . rr_1skl 1 
       10 . 1290 . 1 1 1 ARG CB   C  2.570  0.265  -5.401 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG CB   . . rr_1skl 1 
       10 . 1291 . 1 1 1 ARG CD   C  2.492  2.101  -7.276 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG CD   . . rr_1skl 1 
       10 . 1292 . 1 1 1 ARG CG   C  3.318  1.301  -6.255 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG CG   . . rr_1skl 1 
       10 . 1293 . 1 1 1 ARG CZ   C  1.607  4.460  -7.168 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG CZ   . . rr_1skl 1 
       10 . 1294 . 1 1 1 ARG HA   H  2.204  1.824  -4.000 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HA   . . rr_1skl 1 
       10 . 1295 . 1 1 1 ARG HB2  H  3.336 -0.368  -4.954 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HB2  . . rr_1skl 1 
       10 . 1296 . 1 1 1 ARG HB3  H  1.962 -0.372  -6.041 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HB3  . . rr_1skl 1 
       10 . 1297 . 1 1 1 ARG HD2  H  3.181  2.497  -8.022 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HD2  . . rr_1skl 1 
       10 . 1298 . 1 1 1 ARG HD3  H  1.796  1.432  -7.786 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HD3  . . rr_1skl 1 
       10 . 1299 . 1 1 1 ARG HE   H  1.236  2.998  -5.822 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HE   . . rr_1skl 1 
       10 . 1300 . 1 1 1 ARG HG2  H  3.846  1.988  -5.593 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HG2  . . rr_1skl 1 
       10 . 1301 . 1 1 1 ARG HG3  H  4.063  0.744  -6.816 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HG3  . . rr_1skl 1 
       10 . 1302 . 1 1 1 ARG HH11 H  2.827  4.210  -8.787 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HH11 . . rr_1skl 1 
       10 . 1303 . 1 1 1 ARG HH12 H  2.109  5.795  -8.629 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HH12 . . rr_1skl 1 
       10 . 1304 . 1 1 1 ARG HH21 H  0.335  5.060  -5.689 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HH21 . . rr_1skl 1 
       10 . 1305 . 1 1 1 ARG HH22 H  0.715  6.271  -6.890 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG HH22 . . rr_1skl 1 
       10 . 1306 . 1 1 1 ARG N    N  1.745 -0.013  -3.090 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG N    . . rr_1skl 1 
       10 . 1307 . 1 1 1 ARG NE   N  1.739  3.216  -6.671 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG NE   . . rr_1skl 1 
       10 . 1308 . 1 1 1 ARG NH1  N  2.231  4.854  -8.289 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG NH1  . . rr_1skl 1 
       10 . 1309 . 1 1 1 ARG NH2  N  0.825  5.336  -6.527 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG NH2  . . rr_1skl 1 
       10 . 1310 . 1 1 1 ARG O    O -0.152  1.031  -5.767 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 1 ARG O    . . rr_1skl 1 
       10 . 1311 . 1 1 2 ARG C    C -2.220  3.294  -2.960 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG C    . . rr_1skl 1 
       10 . 1312 . 1 1 2 ARG CA   C -1.904  2.015  -3.752 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG CA   . . rr_1skl 1 
       10 . 1313 . 1 1 2 ARG CB   C -2.821  0.857  -3.298 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG CB   . . rr_1skl 1 
       10 . 1314 . 1 1 2 ARG CD   C -1.659 -1.427  -3.172 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG CD   . . rr_1skl 1 
       10 . 1315 . 1 1 2 ARG CG   C -2.607 -0.512  -3.954 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG CG   . . rr_1skl 1 
       10 . 1316 . 1 1 2 ARG CZ   C -0.680 -3.147  -4.717 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG CZ   . . rr_1skl 1 
       10 . 1317 . 1 1 2 ARG H    H -0.102  1.737  -2.694 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG H    . . rr_1skl 1 
       10 . 1318 . 1 1 2 ARG HA   H -2.131  2.216  -4.793 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HA   . . rr_1skl 1 
       10 . 1319 . 1 1 2 ARG HB2  H -2.767  0.741  -2.220 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HB2  . . rr_1skl 1 
       10 . 1320 . 1 1 2 ARG HB3  H -3.827  1.139  -3.573 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HB3  . . rr_1skl 1 
       10 . 1321 . 1 1 2 ARG HD2  H -0.668 -0.988  -3.112 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HD2  . . rr_1skl 1 
       10 . 1322 . 1 1 2 ARG HD3  H -2.018 -1.558  -2.147 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HD3  . . rr_1skl 1 
       10 . 1323 . 1 1 2 ARG HE   H -2.391 -3.336  -3.645 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HE   . . rr_1skl 1 
       10 . 1324 . 1 1 2 ARG HG2  H -3.581 -1.011  -4.000 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HG2  . . rr_1skl 1 
       10 . 1325 . 1 1 2 ARG HG3  H -2.258 -0.387  -4.981 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HG3  . . rr_1skl 1 
       10 . 1326 . 1 1 2 ARG HH11 H  0.439 -1.441  -4.704 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HH11 . . rr_1skl 1 
       10 . 1327 . 1 1 2 ARG HH12 H  1.016 -2.706  -5.763 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HH12 . . rr_1skl 1 
       10 . 1328 . 1 1 2 ARG HH21 H -1.563 -4.964  -5.012 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HH21 . . rr_1skl 1 
       10 . 1329 . 1 1 2 ARG HH22 H -0.111 -4.675  -5.944 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG HH22 . . rr_1skl 1 
       10 . 1330 . 1 1 2 ARG N    N -0.502  1.651  -3.618 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG N    . . rr_1skl 1 
       10 . 1331 . 1 1 2 ARG NE   N -1.601 -2.737  -3.825 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG NE   . . rr_1skl 1 
       10 . 1332 . 1 1 2 ARG NH1  N  0.347 -2.371  -5.085 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG NH1  . . rr_1skl 1 
       10 . 1333 . 1 1 2 ARG NH2  N -0.793 -4.362  -5.267 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG NH2  . . rr_1skl 1 
       10 . 1334 . 1 1 2 ARG O    O -2.700  4.264  -3.558 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 2 ARG O    . . rr_1skl 1 
       10 . 1335 . 1 1 3 NAL C1   C -4.464  2.009  -0.295 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C1   . . rr_1skl 1 
       10 . 1336 . 1 1 3 NAL C10  C -2.347  4.364  -0.693 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C10  . . rr_1skl 1 
       10 . 1337 . 1 1 3 NAL C11  C -1.686  4.173   0.693 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C11  . . rr_1skl 1 
       10 . 1338 . 1 1 3 NAL C2   C -4.695  3.226  -0.967 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C2   . . rr_1skl 1 
       10 . 1339 . 1 1 3 NAL C3   C -5.632  3.271  -2.019 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C3   . . rr_1skl 1 
       10 . 1340 . 1 1 3 NAL C4   C -6.311  2.108  -2.418 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C4   . . rr_1skl 1 
       10 . 1341 . 1 1 3 NAL C4A  C -6.053  0.886  -1.774 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C4A  . . rr_1skl 1 
       10 . 1342 . 1 1 3 NAL C5   C -6.686 -0.296  -2.210 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C5   . . rr_1skl 1 
       10 . 1343 . 1 1 3 NAL C6   C -6.398 -1.520  -1.584 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C6   . . rr_1skl 1 
       10 . 1344 . 1 1 3 NAL C7   C -5.487 -1.568  -0.517 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C7   . . rr_1skl 1 
       10 . 1345 . 1 1 3 NAL C8   C -4.858 -0.389  -0.074 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C8   . . rr_1skl 1 
       10 . 1346 . 1 1 3 NAL C8A  C -5.132  0.840  -0.702 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C8A  . . rr_1skl 1 
       10 . 1347 . 1 1 3 NAL C9   C -3.894  4.474  -0.613 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL C9   . . rr_1skl 1 
       10 . 1348 . 1 1 3 NAL H1   H -3.731  1.970   0.497 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H1   . . rr_1skl 1 
       10 . 1349 . 1 1 3 NAL H10  H -1.966  5.309  -1.092 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H10  . . rr_1skl 1 
       10 . 1350 . 1 1 3 NAL H3   H -5.818  4.197  -2.547 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H3   . . rr_1skl 1 
       10 . 1351 . 1 1 3 NAL H4   H -7.014  2.153  -3.240 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H4   . . rr_1skl 1 
       10 . 1352 . 1 1 3 NAL H5   H -7.386 -0.266  -3.033 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H5   . . rr_1skl 1 
       10 . 1353 . 1 1 3 NAL H6   H -6.879 -2.425  -1.924 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H6   . . rr_1skl 1 
       10 . 1354 . 1 1 3 NAL H7   H -5.266 -2.509  -0.035 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H7   . . rr_1skl 1 
       10 . 1355 . 1 1 3 NAL H8   H -4.159 -0.432   0.747 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H8   . . rr_1skl 1 
       10 . 1356 . 1 1 3 NAL H91  H -4.199  4.808   0.376 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H91  . . rr_1skl 1 
       10 . 1357 . 1 1 3 NAL H92  H -4.189  5.265  -1.300 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL H92  . . rr_1skl 1 
       10 . 1358 . 1 1 3 NAL HN1  H -1.574  2.477  -1.222 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL HN1  . . rr_1skl 1 
       10 . 1359 . 1 1 3 NAL N    N -1.959  3.309  -1.647 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL N    . . rr_1skl 1 
       10 . 1360 . 1 1 3 NAL O2   O -2.045  4.875   1.639 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 3 NAL O2   . . rr_1skl 1 
       10 . 1361 . 1 1 4 NAL C1   C  0.304  0.150   4.345 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C1   . . rr_1skl 1 
       10 . 1362 . 1 1 4 NAL C10  C  0.004  2.914   2.061 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C10  . . rr_1skl 1 
       10 . 1363 . 1 1 4 NAL C11  C  1.444  2.497   1.701 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C11  . . rr_1skl 1 
       10 . 1364 . 1 1 4 NAL C2   C -0.294  1.414   4.177 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C2   . . rr_1skl 1 
       10 . 1365 . 1 1 4 NAL C3   C -0.353  2.298   5.273 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C3   . . rr_1skl 1 
       10 . 1366 . 1 1 4 NAL C4   C  0.214  1.929   6.508 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C4   . . rr_1skl 1 
       10 . 1367 . 1 1 4 NAL C4A  C  0.871  0.690   6.645 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C4A  . . rr_1skl 1 
       10 . 1368 . 1 1 4 NAL C5   C  1.522  0.350   7.843 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C5   . . rr_1skl 1 
       10 . 1369 . 1 1 4 NAL C6   C  2.220 -0.868   7.947 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C6   . . rr_1skl 1 
       10 . 1370 . 1 1 4 NAL C7   C  2.275 -1.748   6.851 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C7   . . rr_1skl 1 
       10 . 1371 . 1 1 4 NAL C8   C  1.624 -1.418   5.652 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C8   . . rr_1skl 1 
       10 . 1372 . 1 1 4 NAL C8A  C  0.919 -0.203   5.555 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C8A  . . rr_1skl 1 
       10 . 1373 . 1 1 4 NAL C9   C -0.811  1.830   2.806 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL C9   . . rr_1skl 1 
       10 . 1374 . 1 1 4 NAL H1   H  0.340 -0.542   3.527 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H1   . . rr_1skl 1 
       10 . 1375 . 1 1 4 NAL H10  H  0.057  3.796   2.698 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H10  . . rr_1skl 1 
       10 . 1376 . 1 1 4 NAL H3   H -0.819  3.268   5.165 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H3   . . rr_1skl 1 
       10 . 1377 . 1 1 4 NAL H4   H  0.177  2.620   7.336 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H4   . . rr_1skl 1 
       10 . 1378 . 1 1 4 NAL H5   H  1.508  1.029   8.682 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H5   . . rr_1skl 1 
       10 . 1379 . 1 1 4 NAL H6   H  2.729 -1.122   8.868 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H6   . . rr_1skl 1 
       10 . 1380 . 1 1 4 NAL H7   H  2.828 -2.673   6.929 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H7   . . rr_1skl 1 
       10 . 1381 . 1 1 4 NAL H8   H  1.705 -2.079   4.797 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H8   . . rr_1skl 1 
       10 . 1382 . 1 1 4 NAL H91  H -1.832  2.189   2.936 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H91  . . rr_1skl 1 
       10 . 1383 . 1 1 4 NAL H92  H -0.861  0.952   2.166 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL H92  . . rr_1skl 1 
       10 . 1384 . 1 1 4 NAL HN1  H -0.458  2.719   0.005 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL HN1  . . rr_1skl 1 
       10 . 1385 . 1 1 4 NAL N    N -0.720  3.244   0.828 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL N    . . rr_1skl 1 
       10 . 1386 . 1 1 4 NAL O2   O  1.921  2.855   0.607 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 4 NAL O2   . . rr_1skl 1 
       10 . 1387 . 1 1 5 ARG C    C  3.502  0.285   1.030 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG C    . . rr_1skl 1 
       10 . 1388 . 1 1 5 ARG CA   C  3.519  1.176   2.280 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG CA   . . rr_1skl 1 
       10 . 1389 . 1 1 5 ARG CB   C  4.083  0.370   3.477 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG CB   . . rr_1skl 1 
       10 . 1390 . 1 1 5 ARG CD   C  3.646  2.338   5.071 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG CD   . . rr_1skl 1 
       10 . 1391 . 1 1 5 ARG CG   C  4.557  1.162   4.712 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG CG   . . rr_1skl 1 
       10 . 1392 . 1 1 5 ARG CZ   C  3.567  4.248   6.657 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG CZ   . . rr_1skl 1 
       10 . 1393 . 1 1 5 ARG H    H  1.780  1.607   3.497 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG H    . . rr_1skl 1 
       10 . 1394 . 1 1 5 ARG HA   H  4.195  2.009   2.087 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HA   . . rr_1skl 1 
       10 . 1395 . 1 1 5 ARG HB2  H  3.351 -0.379   3.791 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HB2  . . rr_1skl 1 
       10 . 1396 . 1 1 5 ARG HB3  H  4.952 -0.204   3.138 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HB3  . . rr_1skl 1 
       10 . 1397 . 1 1 5 ARG HD2  H  3.634  3.034   4.234 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HD2  . . rr_1skl 1 
       10 . 1398 . 1 1 5 ARG HD3  H  2.640  1.960   5.232 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HD3  . . rr_1skl 1 
       10 . 1399 . 1 1 5 ARG HE   H  4.842  2.672   6.799 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HE   . . rr_1skl 1 
       10 . 1400 . 1 1 5 ARG HG2  H  4.619  0.475   5.559 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HG2  . . rr_1skl 1 
       10 . 1401 . 1 1 5 ARG HG3  H  5.560  1.540   4.516 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HG3  . . rr_1skl 1 
       10 . 1402 . 1 1 5 ARG HH11 H  2.183  4.394   5.160 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HH11 . . rr_1skl 1 
       10 . 1403 . 1 1 5 ARG HH12 H  2.198  5.724   6.295 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HH12 . . rr_1skl 1 
       10 . 1404 . 1 1 5 ARG HH21 H  4.819  4.435   8.256 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HH21 . . rr_1skl 1 
       10 . 1405 . 1 1 5 ARG HH22 H  3.680  5.745   8.037 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG HH22 . . rr_1skl 1 
       10 . 1406 . 1 1 5 ARG N    N  2.175  1.765   2.570 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG N    . . rr_1skl 1 
       10 . 1407 . 1 1 5 ARG NE   N  4.085  3.072   6.263 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG NE   . . rr_1skl 1 
       10 . 1408 . 1 1 5 ARG NH1  N  2.563  4.836   5.984 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG NH1  . . rr_1skl 1 
       10 . 1409 . 1 1 5 ARG NH2  N  4.060  4.858   7.740 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG NH2  . . rr_1skl 1 
       10 . 1410 . 1 1 5 ARG O    O  4.599 -0.040   0.512 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 5 ARG O    . . rr_1skl 1 
       10 . 1411 . 1 1 6 PHE C    C  2.346  0.218  -1.926 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE C    . . rr_1skl 1 
       10 . 1412 . 1 1 6 PHE CA   C  2.101 -0.764  -0.748 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CA   . . rr_1skl 1 
       10 . 1413 . 1 1 6 PHE CB   C  0.641 -1.291  -0.747 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CB   . . rr_1skl 1 
       10 . 1414 . 1 1 6 PHE CD1  C  0.696 -2.699   1.417 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CD1  . . rr_1skl 1 
       10 . 1415 . 1 1 6 PHE CD2  C -1.270 -1.368   0.907 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CD2  . . rr_1skl 1 
       10 . 1416 . 1 1 6 PHE CE1  C  0.094 -3.102   2.630 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CE1  . . rr_1skl 1 
       10 . 1417 . 1 1 6 PHE CE2  C -1.865 -1.763   2.122 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CE2  . . rr_1skl 1 
       10 . 1418 . 1 1 6 PHE CG   C  0.018 -1.803   0.557 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CG   . . rr_1skl 1 
       10 . 1419 . 1 1 6 PHE CZ   C -1.179 -2.617   3.000 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE CZ   . . rr_1skl 1 
       10 . 1420 . 1 1 6 PHE H    H  1.507  0.216   1.015 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE H    . . rr_1skl 1 
       10 . 1421 . 1 1 6 PHE HA   H  2.776 -1.608  -0.834 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HA   . . rr_1skl 1 
       10 . 1422 . 1 1 6 PHE HB2  H  0.010 -0.477  -1.091 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HB2  . . rr_1skl 1 
       10 . 1423 . 1 1 6 PHE HB3  H  0.593 -2.107  -1.474 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HB3  . . rr_1skl 1 
       10 . 1424 . 1 1 6 PHE HD1  H  1.677 -3.057   1.160 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HD1  . . rr_1skl 1 
       10 . 1425 . 1 1 6 PHE HD2  H -1.811 -0.693   0.257 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HD2  . . rr_1skl 1 
       10 . 1426 . 1 1 6 PHE HE1  H  0.628 -3.767   3.293 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HE1  . . rr_1skl 1 
       10 . 1427 . 1 1 6 PHE HE2  H -2.840 -1.391   2.394 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HE2  . . rr_1skl 1 
       10 . 1428 . 1 1 6 PHE HZ   H -1.626 -2.865   3.968 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE HZ   . . rr_1skl 1 
       10 . 1429 . 1 1 6 PHE N    N  2.344 -0.090   0.527 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE N    . . rr_1skl 1 
       10 . 1430 . 1 1 6 PHE O    O  3.071  1.223  -1.770 . . . 1.0 . . . . . . . . . . . . . . . . . A . . 6 PHE O    . . rr_1skl 1 
    stop_

save_


save_global_Org_file_characteristics
    _Constraint_stat_list.Sf_framecode  global_Org_file_characteristics
    _Constraint_stat_list.Sf_category   constraint_statistics
    _Constraint_stat_list.Entry_ID      rr_1skl
    _Constraint_stat_list.ID            1

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

       1 1skl.mr . $. "MR format" 1  comment               "Not applicable" "Not applicable" 0 rr_1skl 1 
       1 1skl.mr . $.  AMBER      2  distance               NOE              simple          0 rr_1skl 1 
       1 1skl.mr . $.  AMBER      3 "dihedral angle"       "Not applicable" "Not applicable" 0 rr_1skl 1 
       1 1skl.mr . $.  AMBER      4  stereochemistry        chirality       "Not applicable" 0 rr_1skl 1 
       1 1skl.mr . $. "MR format" 5 "nomenclature mapping" "Not applicable" "Not applicable" 0 rr_1skl 1 
    stop_

save_


save_MR_file_comment_1
    _Org_constr_file_comment.Sf_framecode        MR_file_comment_1
    _Org_constr_file_comment.Sf_category         org_constr_file_comment
    _Org_constr_file_comment.Entry_ID            rr_1skl
    _Org_constr_file_comment.ID                  1
    _Org_constr_file_comment.Constraint_file_ID  1
    _Org_constr_file_comment.Block_ID            1
    _Org_constr_file_comment.Details             "Generated by Wattos"
    _Org_constr_file_comment.Comment             "*HEADER ANTIMICROBIAL PROTEIN 05-MAR-04 1SKL *TITLE 2 BOUND TO DPC MICELLES *COMPND MOL_ID: 1; *COMPND 2 MOLECULE: CYCLIC HEXAPEPTIDE RR(NAL)(NAL)RF; *COMPND 3 CHAIN: A; *COMPND 4 ENGINEERED: YES; *COMPND 5 OTHER_DETAILS: NAL = L-2-NAPHTYLALANINE *SOURCE MOL_ID: 1; *SOURCE 2 SYNTHETIC: YES; *SOURCE 3 OTHER_DETAILS: SYNTHESIS OF THE LINEAR PEPTIDE BY THE *SOURCE 4 SOLID-PHASE METHOD USING STANDARD FMOC CHEMISTRY IN *SOURCE 5 CONTINUOUS FLOW MODE (MILLIGEN 9050 PEPTIDE SYNTHESIZER; *SOURCE 6 MILLIPORE, USA). CYCLIZATION MANUALLY BY APPLYING HAPYU- *SOURCE 7 CHEMISTRY. PURIFICATION BY RP-HPLC (SHIMADZU LC-10AD *SOURCE 8 SYSTEM), CHARACTERIZATION BY MATRIX-ASSISTED LASER *SOURCE 9 DESORPTION MASS SPECTROMETRY (MALDI II, KRATOS, MANCHESTER, *SOURCE 10 UK). *KEYWDS CYCLIC PEPTIDE; ANTIMICROBIAL PEPTIDE *EXPDTA NMR, 10 STRUCTURES *AUTHOR C.APPELT, J.A.SODERHALL, M.BIENERT, M.DATHE, P.SCHMIEDER *REVDAT 1 15-MAR-05 1SKL 0 "

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