NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
|
|
651482 |
6wpd   |
30745 | cing | 3-converted-DOCR | STAR | entry | full | 24 |
data_DOCR_restraints_with_modified_coordinates_PDB_code_6wpd
# This DOCR archive file contains, for PDB entry <6wpd>:
#
# - 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, minor modifications could
# have occurred to the NMR restraints information, or data could have been lost
# because of parsing or conversion errors. The PDB file remains the
# authoritative reference for the atomic coordinates and the originally deposited
# restraints files remain the primary reference for these data.
#
# This file is generated at the BioMagResBank (BMRB) in collaboration with the
# PDBe (formerly MSD) group at the European Bioinformatics Institute (EBI) and
# the CMBI/IMM group at the Radboud University of Nijmegen.
#
# Several software packages were used to produce this file:
#
# - Wattos (BMRB and CMBI/IMM).
# - FormatConverter and NMRStarExport (PDBe).
# - CCPN framework (http://www.ccpn.ac.uk/).
#
# More information about this process can be found in the references below.
# Please cite the original reference for this PDB entry.
#
# JF Doreleijers, A Nederveen, W Vranken, J Lin, AM Bonvin, R Kaptein, JL
# Markley, and EL Ulrich (2005). BioMagResBank databases DOCR and FRED
# containing converted and filtered sets of experimental NMR restraints and
# coordinates from over 500 protein PDB structures. J. Biomol. NMR 32, 1-12.
#
# WF Vranken, W Boucher, TJ Stevens, RH Fogh, A Pajon, M Llinas, EL Ulrich, JL
# Markley, J Ionides, ED Laue (2005). The CCPN data model for NMR spectroscopy:
# development of a software pipeline. Proteins 59, 687-696.
#
# JF Doreleijers, WF Vranken, C Schulte, J Lin, JR Wedell, CJ Penkett, GW Vuister,
# G Vriend, JL Markley, and EL Ulrich (2009). The NMR Restraints Grid at BMRB for
# 5,266 Protein and Nucleic Acid PDB Entries. J Biomol. NMR 45, 389?396.
save_entry_information
_Entry.Sf_category entry_information
_Entry.Sf_framecode entry_information
_Entry.ID rr_6wpd
_Entry.Title "wwPDB remediated NMR restraints for PDB entry 6wpd"
_Entry.Version_type original
_Entry.NMR_STAR_version 3.1.0.8
_Entry.Experimental_method NMR
_Entry.Experimental_method_subtype solution
_Entry.Details "Contains the remediated restraint lists and coordinates for PDB entry 6wpd"
_Entry.PDB_coordinate_file_version 3.20
loop_
_Related_entries.Database_name
_Related_entries.Database_accession_code
_Related_entries.Relationship
_Related_entries.Entry_ID
PDB 6wpd "Master copy" rr_6wpd
stop_
save_
save_assembly
_Assembly.Sf_category assembly
_Assembly.Sf_framecode assembly
_Assembly.Entry_ID rr_6wpd
_Assembly.ID 1
_Assembly.Name 6wpd
_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 1312.6144
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 "HSP1 NH2" 1 $HSP1_NH2 A . no . . . . . . rr_6wpd 1
stop_
save_
save_HSP1_NH2
_Entity.Sf_category entity
_Entity.Sf_framecode HSP1_NH2
_Entity.Entry_ID rr_6wpd
_Entity.ID 1
_Entity.Name HSP1_NH2
_Entity.Type polymer
_Entity.Polymer_type polypeptide(L)
_Entity.Polymer_strand_ID A
_Entity.Polymer_seq_one_letter_code GILDAIKAIAKAAGX
_Entity.Ambiguous_conformational_states no
_Entity.Ambiguous_chem_comp_sites no
_Entity.Nstd_monomer yes
_Entity.Nstd_chirality yes
_Entity.Nstd_linkage yes
_Entity.Number_of_monomers 15
_Entity.Paramagnetic no
_Entity.Thiol_state "not present"
_Entity.Parent_entity_ID 1
_Entity.Formula_weight 1312.6144
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 . GLY . rr_6wpd 1
2 . ILE . rr_6wpd 1
3 . LEU . rr_6wpd 1
4 . ASP . rr_6wpd 1
5 . ALA . rr_6wpd 1
6 . ILE . rr_6wpd 1
7 . LYS . rr_6wpd 1
8 . ALA . rr_6wpd 1
9 . ILE . rr_6wpd 1
10 . ALA . rr_6wpd 1
11 . LYS . rr_6wpd 1
12 . ALA . rr_6wpd 1
13 . ALA . rr_6wpd 1
14 . GLY . rr_6wpd 1
15 . NH2 . rr_6wpd 1
stop_
loop_
_Entity_poly_seq.Hetero
_Entity_poly_seq.Mon_ID
_Entity_poly_seq.Num
_Entity_poly_seq.Comp_index_ID
_Entity_poly_seq.Entry_ID
_Entity_poly_seq.Entity_ID
. GLY 1 1 rr_6wpd 1
. ILE 2 2 rr_6wpd 1
. LEU 3 3 rr_6wpd 1
. ASP 4 4 rr_6wpd 1
. ALA 5 5 rr_6wpd 1
. ILE 6 6 rr_6wpd 1
. LYS 7 7 rr_6wpd 1
. ALA 8 8 rr_6wpd 1
. ILE 9 9 rr_6wpd 1
. ALA 10 10 rr_6wpd 1
. LYS 11 11 rr_6wpd 1
. ALA 12 12 rr_6wpd 1
. ALA 13 13 rr_6wpd 1
. GLY 14 14 rr_6wpd 1
. NH2 15 15 rr_6wpd 1
stop_
save_
save_chem_comp_NH2
_Chem_comp.Sf_category chem_comp
_Chem_comp.Sf_framecode chem_comp_NH2
_Chem_comp.Entry_ID rr_6wpd
_Chem_comp.ID NH2
_Chem_comp.Name "AMINO GROUP"
_Chem_comp.Type non-polymer
_Chem_comp.PDB_code NH2
_Chem_comp.Formal_charge 0
_Chem_comp.Paramagnetic no
_Chem_comp.Aromatic no
_Chem_comp.Formula "H2 N"
_Chem_comp.Formula_weight 16.0225
save_
save_conformer_statistics
_Conformer_stat_list.Sf_category conformer_statistics
_Conformer_stat_list.Sf_framecode conformer_statistics
_Conformer_stat_list.Entry_ID rr_6wpd
_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_6wpd
_Conformer_family_coord_set.ID 1
loop_
_Conformer_family_refinement.Refine_method
_Conformer_family_refinement.Refine_details
_Conformer_family_refinement.Software_ID
_Conformer_family_refinement.Software_label
_Conformer_family_refinement.Entry_ID
_Conformer_family_refinement.Conformer_family_coord_set_ID
1 . . . rr_6wpd 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_6wpd 1
stop_
loop_
_Atom_site.Assembly_ID
_Atom_site.Model_ID
_Atom_site.Model_site_ID
_Atom_site.ID
_Atom_site.Assembly_atom_ID
_Atom_site.Label_entity_assembly_ID
_Atom_site.Label_entity_ID
_Atom_site.Label_comp_index_ID
_Atom_site.Label_comp_ID
_Atom_site.Label_atom_ID
_Atom_site.Type_symbol
_Atom_site.Cartn_x
_Atom_site.Cartn_y
_Atom_site.Cartn_z
_Atom_site.Cartn_x_esd
_Atom_site.Cartn_y_esd
_Atom_site.Cartn_z_esd
_Atom_site.Occupancy
_Atom_site.Occupancy_esd
_Atom_site.Uncertainty
_Atom_site.Ordered_flag
_Atom_site.Footnote_ID
_Atom_site.PDBX_label_asym_ID
_Atom_site.PDBX_label_seq_ID
_Atom_site.PDBX_label_comp_ID
_Atom_site.PDBX_label_atom_ID
_Atom_site.PDBX_formal_charge
_Atom_site.PDBX_label_entity_ID
_Atom_site.PDB_record_ID
_Atom_site.PDB_model_num
_Atom_site.PDB_strand_ID
_Atom_site.PDB_ins_code
_Atom_site.PDB_residue_no
_Atom_site.PDB_residue_name
_Atom_site.PDB_atom_name
_Atom_site.Auth_entity_assembly_ID
_Atom_site.Auth_asym_ID
_Atom_site.Auth_chain_ID
_Atom_site.Auth_seq_ID
_Atom_site.Auth_comp_ID
_Atom_site.Auth_atom_ID
_Atom_site.Auth_alt_ID
_Atom_site.Auth_atom_name
_Atom_site.Details
_Atom_site.Entry_ID
_Atom_site.Conformer_family_coord_set_ID
. 1 . 1 . 1 1 1 GLY C C 10.807 9.088 16.324 . . . 1.0 . . . . . . . . . . . . A . 1 GLY C . . . . . . . . . rr_6wpd 1
. 1 . 2 . 1 1 1 GLY CA C 10.466 10.545 16.605 . . . 1.0 . . . . . . . . . . . . A . 1 GLY CA . . . . . . . . . rr_6wpd 1
. 1 . 3 . 1 1 1 GLY H1 H 11.772 11.337 15.193 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H1 . . . . . . . . . rr_6wpd 1
. 1 . 4 . 1 1 1 GLY H2 H 12.463 11.116 16.730 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H2 . . . . . . . . . rr_6wpd 1
. 1 . 5 . 1 1 1 GLY H3 H 11.388 12.402 16.454 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H3 . . . . . . . . . rr_6wpd 1
. 1 . 6 . 1 1 1 GLY HA2 H 10.259 10.671 17.657 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA2 . . . . . . . . . rr_6wpd 1
. 1 . 7 . 1 1 1 GLY HA3 H 9.594 10.819 16.030 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA3 . . . . . . . . . rr_6wpd 1
. 1 . 8 . 1 1 1 GLY N N 11.608 11.415 16.215 . . . 1.0 . . . . . . . . . . . . A . 1 GLY N . . . . . . . . . rr_6wpd 1
. 1 . 9 . 1 1 1 GLY O O 11.923 8.635 16.585 . . . 1.0 . . . . . . . . . . . . A . 1 GLY O . . . . . . . . . rr_6wpd 1
. 1 . 10 . 1 1 2 ILE C C 10.746 6.847 14.134 . . . 1.0 . . . . . . . . . . . . A . 2 ILE C . . . . . . . . . rr_6wpd 1
. 1 . 11 . 1 1 2 ILE CA C 10.009 6.966 15.459 . . . 1.0 . . . . . . . . . . . . A . 2 ILE CA . . . . . . . . . rr_6wpd 1
. 1 . 12 . 1 1 2 ILE CB C 8.637 6.292 15.374 . . . 1.0 . . . . . . . . . . . . A . 2 ILE CB . . . . . . . . . rr_6wpd 1
. 1 . 13 . 1 1 2 ILE CD1 C 8.539 6.490 17.885 . . . 1.0 . . . . . . . . . . . . A . 2 ILE CD1 . . . . . . . . . rr_6wpd 1
. 1 . 14 . 1 1 2 ILE CG1 C 7.787 6.740 16.572 . . . 1.0 . . . . . . . . . . . . A . 2 ILE CG1 . . . . . . . . . rr_6wpd 1
. 1 . 15 . 1 1 2 ILE CG2 C 8.789 4.768 15.390 . . . 1.0 . . . . . . . . . . . . A . 2 ILE CG2 . . . . . . . . . rr_6wpd 1
. 1 . 16 . 1 1 2 ILE H H 8.973 8.787 15.597 . . . 1.0 . . . . . . . . . . . . A . 2 ILE H . . . . . . . . . rr_6wpd 1
. 1 . 17 . 1 1 2 ILE HA H 10.593 6.488 16.232 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HA . . . . . . . . . rr_6wpd 1
. 1 . 18 . 1 1 2 ILE HB H 8.149 6.592 14.457 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HB . . . . . . . . . rr_6wpd 1
. 1 . 19 . 1 1 2 ILE HD11 H 9.280 7.262 18.027 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HD11 . . . . . . . . . rr_6wpd 1
. 1 . 20 . 1 1 2 ILE HD12 H 9.024 5.527 17.853 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HD12 . . . . . . . . . rr_6wpd 1
. 1 . 21 . 1 1 2 ILE HD13 H 7.837 6.512 18.707 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HD13 . . . . . . . . . rr_6wpd 1
. 1 . 22 . 1 1 2 ILE HG12 H 7.572 7.794 16.480 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HG12 . . . . . . . . . rr_6wpd 1
. 1 . 23 . 1 1 2 ILE HG13 H 6.860 6.186 16.580 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HG13 . . . . . . . . . rr_6wpd 1
. 1 . 24 . 1 1 2 ILE HG21 H 7.817 4.310 15.275 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HG21 . . . . . . . . . rr_6wpd 1
. 1 . 25 . 1 1 2 ILE HG22 H 9.224 4.457 16.329 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HG22 . . . . . . . . . rr_6wpd 1
. 1 . 26 . 1 1 2 ILE HG23 H 9.428 4.460 14.577 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HG23 . . . . . . . . . rr_6wpd 1
. 1 . 27 . 1 1 2 ILE N N 9.832 8.366 15.785 . . . 1.0 . . . . . . . . . . . . A . 2 ILE N . . . . . . . . . rr_6wpd 1
. 1 . 28 . 1 1 2 ILE O O 10.444 7.561 13.174 . . . 1.0 . . . . . . . . . . . . A . 2 ILE O . . . . . . . . . rr_6wpd 1
. 1 . 29 . 1 1 3 LEU C C 11.653 5.571 11.686 . . . 1.0 . . . . . . . . . . . . A . 3 LEU C . . . . . . . . . rr_6wpd 1
. 1 . 30 . 1 1 3 LEU CA C 12.536 5.753 12.907 . . . 1.0 . . . . . . . . . . . . A . 3 LEU CA . . . . . . . . . rr_6wpd 1
. 1 . 31 . 1 1 3 LEU CB C 13.411 4.513 13.092 . . . 1.0 . . . . . . . . . . . . A . 3 LEU CB . . . . . . . . . rr_6wpd 1
. 1 . 32 . 1 1 3 LEU CD1 C 15.160 3.481 14.563 . . . 1.0 . . . . . . . . . . . . A . 3 LEU CD1 . . . . . . . . . rr_6wpd 1
. 1 . 33 . 1 1 3 LEU CD2 C 15.579 5.744 13.543 . . . 1.0 . . . . . . . . . . . . A . 3 LEU CD2 . . . . . . . . . rr_6wpd 1
. 1 . 34 . 1 1 3 LEU CG C 14.507 4.799 14.129 . . . 1.0 . . . . . . . . . . . . A . 3 LEU CG . . . . . . . . . rr_6wpd 1
. 1 . 35 . 1 1 3 LEU H H 11.926 5.438 14.907 . . . 1.0 . . . . . . . . . . . . A . 3 LEU H . . . . . . . . . rr_6wpd 1
. 1 . 36 . 1 1 3 LEU HA H 13.169 6.607 12.754 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HA . . . . . . . . . rr_6wpd 1
. 1 . 37 . 1 1 3 LEU HB2 H 12.793 3.694 13.441 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HB2 . . . . . . . . . rr_6wpd 1
. 1 . 38 . 1 1 3 LEU HB3 H 13.854 4.244 12.149 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HB3 . . . . . . . . . rr_6wpd 1
. 1 . 39 . 1 1 3 LEU HD11 H 14.464 2.916 15.164 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HD11 . . . . . . . . . rr_6wpd 1
. 1 . 40 . 1 1 3 LEU HD12 H 16.045 3.695 15.145 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HD12 . . . . . . . . . rr_6wpd 1
. 1 . 41 . 1 1 3 LEU HD13 H 15.434 2.907 13.691 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HD13 . . . . . . . . . rr_6wpd 1
. 1 . 42 . 1 1 3 LEU HD21 H 15.271 6.769 13.686 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HD21 . . . . . . . . . rr_6wpd 1
. 1 . 43 . 1 1 3 LEU HD22 H 15.708 5.553 12.488 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HD22 . . . . . . . . . rr_6wpd 1
. 1 . 44 . 1 1 3 LEU HD23 H 16.523 5.586 14.050 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HD23 . . . . . . . . . rr_6wpd 1
. 1 . 45 . 1 1 3 LEU HG H 14.055 5.266 14.991 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HG . . . . . . . . . rr_6wpd 1
. 1 . 46 . 1 1 3 LEU N N 11.728 5.958 14.102 . . . 1.0 . . . . . . . . . . . . A . 3 LEU N . . . . . . . . . rr_6wpd 1
. 1 . 47 . 1 1 3 LEU O O 12.012 5.965 10.578 . . . 1.0 . . . . . . . . . . . . A . 3 LEU O . . . . . . . . . rr_6wpd 1
. 1 . 48 . 1 1 4 ASP C C 9.063 6.023 10.217 . . . 1.0 . . . . . . . . . . . . A . 4 ASP C . . . . . . . . . rr_6wpd 1
. 1 . 49 . 1 1 4 ASP CA C 9.557 4.713 10.828 . . . 1.0 . . . . . . . . . . . . A . 4 ASP CA . . . . . . . . . rr_6wpd 1
. 1 . 50 . 1 1 4 ASP CB C 8.368 3.920 11.371 . . . 1.0 . . . . . . . . . . . . A . 4 ASP CB . . . . . . . . . rr_6wpd 1
. 1 . 51 . 1 1 4 ASP CG C 8.793 2.486 11.664 . . . 1.0 . . . . . . . . . . . . A . 4 ASP CG . . . . . . . . . rr_6wpd 1
. 1 . 52 . 1 1 4 ASP H H 10.290 4.681 12.817 . . . 1.0 . . . . . . . . . . . . A . 4 ASP H . . . . . . . . . rr_6wpd 1
. 1 . 53 . 1 1 4 ASP HA H 10.043 4.133 10.060 . . . 1.0 . . . . . . . . . . . . A . 4 ASP HA . . . . . . . . . rr_6wpd 1
. 1 . 54 . 1 1 4 ASP HB2 H 8.016 4.383 12.283 . . . 1.0 . . . . . . . . . . . . A . 4 ASP HB2 . . . . . . . . . rr_6wpd 1
. 1 . 55 . 1 1 4 ASP HB3 H 7.574 3.919 10.641 . . . 1.0 . . . . . . . . . . . . A . 4 ASP HB3 . . . . . . . . . rr_6wpd 1
. 1 . 56 . 1 1 4 ASP N N 10.504 4.966 11.907 . . . 1.0 . . . . . . . . . . . . A . 4 ASP N . . . . . . . . . rr_6wpd 1
. 1 . 57 . 1 1 4 ASP O O 8.939 6.143 8.997 . . . 1.0 . . . . . . . . . . . . A . 4 ASP O . . . . . . . . . rr_6wpd 1
. 1 . 58 . 1 1 4 ASP OD1 O 9.825 2.079 11.157 . . . 1.0 . . . . . . . . . . . . A . 4 ASP OD1 . . . . . . . . . rr_6wpd 1
. 1 . 59 . 1 1 4 ASP OD2 O 8.082 1.815 12.395 . . . 1.0 . . . . . . . . . . . . A . 4 ASP OD2 . . . . . . . . . rr_6wpd 1
. 1 . 60 . 1 1 5 ALA C C 9.345 9.033 9.823 . . . 1.0 . . . . . . . . . . . . A . 5 ALA C . . . . . . . . . rr_6wpd 1
. 1 . 61 . 1 1 5 ALA CA C 8.284 8.294 10.632 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CA . . . . . . . . . rr_6wpd 1
. 1 . 62 . 1 1 5 ALA CB C 7.897 9.140 11.848 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CB . . . . . . . . . rr_6wpd 1
. 1 . 63 . 1 1 5 ALA H H 8.895 6.824 12.035 . . . 1.0 . . . . . . . . . . . . A . 5 ALA H . . . . . . . . . rr_6wpd 1
. 1 . 64 . 1 1 5 ALA HA H 7.408 8.147 10.017 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HA . . . . . . . . . rr_6wpd 1
. 1 . 65 . 1 1 5 ALA HB1 H 7.013 8.727 12.311 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB1 . . . . . . . . . rr_6wpd 1
. 1 . 66 . 1 1 5 ALA HB2 H 7.701 10.153 11.535 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB2 . . . . . . . . . rr_6wpd 1
. 1 . 67 . 1 1 5 ALA HB3 H 8.710 9.135 12.559 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB3 . . . . . . . . . rr_6wpd 1
. 1 . 68 . 1 1 5 ALA N N 8.777 6.992 11.079 . . . 1.0 . . . . . . . . . . . . A . 5 ALA N . . . . . . . . . rr_6wpd 1
. 1 . 69 . 1 1 5 ALA O O 9.046 9.664 8.811 . . . 1.0 . . . . . . . . . . . . A . 5 ALA O . . . . . . . . . rr_6wpd 1
. 1 . 70 . 1 1 6 ILE C C 11.931 9.050 8.238 . . . 1.0 . . . . . . . . . . . . A . 6 ILE C . . . . . . . . . rr_6wpd 1
. 1 . 71 . 1 1 6 ILE CA C 11.709 9.610 9.639 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CA . . . . . . . . . rr_6wpd 1
. 1 . 72 . 1 1 6 ILE CB C 12.958 9.411 10.506 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CB . . . . . . . . . rr_6wpd 1
. 1 . 73 . 1 1 6 ILE CD1 C 13.824 9.782 12.831 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CD1 . . . . . . . . . rr_6wpd 1
. 1 . 74 . 1 1 6 ILE CG1 C 12.786 10.219 11.796 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CG1 . . . . . . . . . rr_6wpd 1
. 1 . 75 . 1 1 6 ILE CG2 C 14.217 9.885 9.768 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CG2 . . . . . . . . . rr_6wpd 1
. 1 . 76 . 1 1 6 ILE H H 10.743 8.432 11.108 . . . 1.0 . . . . . . . . . . . . A . 6 ILE H . . . . . . . . . rr_6wpd 1
. 1 . 77 . 1 1 6 ILE HA H 11.503 10.668 9.565 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HA . . . . . . . . . rr_6wpd 1
. 1 . 78 . 1 1 6 ILE HB H 13.057 8.365 10.750 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HB . . . . . . . . . rr_6wpd 1
. 1 . 79 . 1 1 6 ILE HD11 H 13.516 8.849 13.277 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HD11 . . . . . . . . . rr_6wpd 1
. 1 . 80 . 1 1 6 ILE HD12 H 13.904 10.539 13.597 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HD12 . . . . . . . . . rr_6wpd 1
. 1 . 81 . 1 1 6 ILE HD13 H 14.784 9.654 12.350 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HD13 . . . . . . . . . rr_6wpd 1
. 1 . 82 . 1 1 6 ILE HG12 H 12.915 11.268 11.579 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG12 . . . . . . . . . rr_6wpd 1
. 1 . 83 . 1 1 6 ILE HG13 H 11.796 10.055 12.195 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG13 . . . . . . . . . rr_6wpd 1
. 1 . 84 . 1 1 6 ILE HG21 H 14.414 9.233 8.929 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG21 . . . . . . . . . rr_6wpd 1
. 1 . 85 . 1 1 6 ILE HG22 H 15.058 9.856 10.445 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG22 . . . . . . . . . rr_6wpd 1
. 1 . 86 . 1 1 6 ILE HG23 H 14.073 10.894 9.415 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG23 . . . . . . . . . rr_6wpd 1
. 1 . 87 . 1 1 6 ILE N N 10.582 8.949 10.293 . . . 1.0 . . . . . . . . . . . . A . 6 ILE N . . . . . . . . . rr_6wpd 1
. 1 . 88 . 1 1 6 ILE O O 12.183 9.795 7.288 . . . 1.0 . . . . . . . . . . . . A . 6 ILE O . . . . . . . . . rr_6wpd 1
. 1 . 89 . 1 1 7 LYS C C 10.974 7.453 5.852 . . . 1.0 . . . . . . . . . . . . A . 7 LYS C . . . . . . . . . rr_6wpd 1
. 1 . 90 . 1 1 7 LYS CA C 12.044 7.052 6.861 . . . 1.0 . . . . . . . . . . . . A . 7 LYS CA . . . . . . . . . rr_6wpd 1
. 1 . 91 . 1 1 7 LYS CB C 11.984 5.547 7.108 . . . 1.0 . . . . . . . . . . . . A . 7 LYS CB . . . . . . . . . rr_6wpd 1
. 1 . 92 . 1 1 7 LYS CD C 14.409 4.889 7.103 . . . 1.0 . . . . . . . . . . . . A . 7 LYS CD . . . . . . . . . rr_6wpd 1
. 1 . 93 . 1 1 7 LYS CE C 15.589 4.454 7.967 . . . 1.0 . . . . . . . . . . . . A . 7 LYS CE . . . . . . . . . rr_6wpd 1
. 1 . 94 . 1 1 7 LYS CG C 13.175 5.104 7.977 . . . 1.0 . . . . . . . . . . . . A . 7 LYS CG . . . . . . . . . rr_6wpd 1
. 1 . 95 . 1 1 7 LYS H H 11.653 7.201 8.926 . . . 1.0 . . . . . . . . . . . . A . 7 LYS H . . . . . . . . . rr_6wpd 1
. 1 . 96 . 1 1 7 LYS HA H 13.006 7.308 6.469 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HA . . . . . . . . . rr_6wpd 1
. 1 . 97 . 1 1 7 LYS HB2 H 11.066 5.315 7.618 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HB2 . . . . . . . . . rr_6wpd 1
. 1 . 98 . 1 1 7 LYS HB3 H 12.012 5.028 6.166 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HB3 . . . . . . . . . rr_6wpd 1
. 1 . 99 . 1 1 7 LYS HD2 H 14.194 4.124 6.380 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HD2 . . . . . . . . . rr_6wpd 1
. 1 . 100 . 1 1 7 LYS HD3 H 14.663 5.802 6.595 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HD3 . . . . . . . . . rr_6wpd 1
. 1 . 101 . 1 1 7 LYS HE2 H 15.804 5.218 8.697 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HE2 . . . . . . . . . rr_6wpd 1
. 1 . 102 . 1 1 7 LYS HE3 H 15.347 3.529 8.473 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HE3 . . . . . . . . . rr_6wpd 1
. 1 . 103 . 1 1 7 LYS HG2 H 13.392 5.865 8.705 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HG2 . . . . . . . . . rr_6wpd 1
. 1 . 104 . 1 1 7 LYS HG3 H 12.929 4.182 8.482 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HG3 . . . . . . . . . rr_6wpd 1
. 1 . 105 . 1 1 7 LYS HZ1 H 17.642 4.480 7.622 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HZ1 . . . . . . . . . rr_6wpd 1
. 1 . 106 . 1 1 7 LYS HZ2 H 16.702 4.867 6.260 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HZ2 . . . . . . . . . rr_6wpd 1
. 1 . 107 . 1 1 7 LYS HZ3 H 16.816 3.257 6.787 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HZ3 . . . . . . . . . rr_6wpd 1
. 1 . 108 . 1 1 7 LYS N N 11.847 7.734 8.130 . . . 1.0 . . . . . . . . . . . . A . 7 LYS N . . . . . . . . . rr_6wpd 1
. 1 . 109 . 1 1 7 LYS NZ N 16.778 4.249 7.095 . . . 1.0 . . . . . . . . . . . . A . 7 LYS NZ . . . . . . . . . rr_6wpd 1
. 1 . 110 . 1 1 7 LYS O O 11.268 7.683 4.677 . . . 1.0 . . . . . . . . . . . . A . 7 LYS O . . . . . . . . . rr_6wpd 1
. 1 . 111 . 1 1 8 ALA C C 8.785 9.303 4.915 . . . 1.0 . . . . . . . . . . . . A . 8 ALA C . . . . . . . . . rr_6wpd 1
. 1 . 112 . 1 1 8 ALA CA C 8.615 7.887 5.459 . . . 1.0 . . . . . . . . . . . . A . 8 ALA CA . . . . . . . . . rr_6wpd 1
. 1 . 113 . 1 1 8 ALA CB C 7.311 7.803 6.254 . . . 1.0 . . . . . . . . . . . . A . 8 ALA CB . . . . . . . . . rr_6wpd 1
. 1 . 114 . 1 1 8 ALA H H 9.570 7.321 7.263 . . . 1.0 . . . . . . . . . . . . A . 8 ALA H . . . . . . . . . rr_6wpd 1
. 1 . 115 . 1 1 8 ALA HA H 8.566 7.193 4.633 . . . 1.0 . . . . . . . . . . . . A . 8 ALA HA . . . . . . . . . rr_6wpd 1
. 1 . 116 . 1 1 8 ALA HB1 H 7.089 6.769 6.479 . . . 1.0 . . . . . . . . . . . . A . 8 ALA HB1 . . . . . . . . . rr_6wpd 1
. 1 . 117 . 1 1 8 ALA HB2 H 6.506 8.227 5.673 . . . 1.0 . . . . . . . . . . . . A . 8 ALA HB2 . . . . . . . . . rr_6wpd 1
. 1 . 118 . 1 1 8 ALA HB3 H 7.419 8.355 7.176 . . . 1.0 . . . . . . . . . . . . A . 8 ALA HB3 . . . . . . . . . rr_6wpd 1
. 1 . 119 . 1 1 8 ALA N N 9.735 7.523 6.321 . . . 1.0 . . . . . . . . . . . . A . 8 ALA N . . . . . . . . . rr_6wpd 1
. 1 . 120 . 1 1 8 ALA O O 8.518 9.569 3.743 . . . 1.0 . . . . . . . . . . . . A . 8 ALA O . . . . . . . . . rr_6wpd 1
. 1 . 121 . 1 1 9 ILE C C 10.526 11.731 4.360 . . . 1.0 . . . . . . . . . . . . A . 9 ILE C . . . . . . . . . rr_6wpd 1
. 1 . 122 . 1 1 9 ILE CA C 9.435 11.603 5.420 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CA . . . . . . . . . rr_6wpd 1
. 1 . 123 . 1 1 9 ILE CB C 9.832 12.384 6.677 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CB . . . . . . . . . rr_6wpd 1
. 1 . 124 . 1 1 9 ILE CD1 C 9.093 12.826 9.034 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CD1 . . . . . . . . . rr_6wpd 1
. 1 . 125 . 1 1 9 ILE CG1 C 8.631 12.448 7.624 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CG1 . . . . . . . . . rr_6wpd 1
. 1 . 126 . 1 1 9 ILE CG2 C 10.272 13.806 6.308 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CG2 . . . . . . . . . rr_6wpd 1
. 1 . 127 . 1 1 9 ILE H H 9.416 9.921 6.705 . . . 1.0 . . . . . . . . . . . . A . 9 ILE H . . . . . . . . . rr_6wpd 1
. 1 . 128 . 1 1 9 ILE HA H 8.511 12.009 5.033 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HA . . . . . . . . . rr_6wpd 1
. 1 . 129 . 1 1 9 ILE HB H 10.644 11.876 7.167 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HB . . . . . . . . . rr_6wpd 1
. 1 . 130 . 1 1 9 ILE HD11 H 8.251 13.197 9.598 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HD11 . . . . . . . . . rr_6wpd 1
. 1 . 131 . 1 1 9 ILE HD12 H 9.854 13.592 8.975 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HD12 . . . . . . . . . rr_6wpd 1
. 1 . 132 . 1 1 9 ILE HD13 H 9.498 11.953 9.525 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HD13 . . . . . . . . . rr_6wpd 1
. 1 . 133 . 1 1 9 ILE HG12 H 7.938 13.188 7.265 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG12 . . . . . . . . . rr_6wpd 1
. 1 . 134 . 1 1 9 ILE HG13 H 8.142 11.486 7.655 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG13 . . . . . . . . . rr_6wpd 1
. 1 . 135 . 1 1 9 ILE HG21 H 9.554 14.243 5.629 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG21 . . . . . . . . . rr_6wpd 1
. 1 . 136 . 1 1 9 ILE HG22 H 11.241 13.773 5.834 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG22 . . . . . . . . . rr_6wpd 1
. 1 . 137 . 1 1 9 ILE HG23 H 10.331 14.408 7.204 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG23 . . . . . . . . . rr_6wpd 1
. 1 . 138 . 1 1 9 ILE N N 9.227 10.204 5.787 . . . 1.0 . . . . . . . . . . . . A . 9 ILE N . . . . . . . . . rr_6wpd 1
. 1 . 139 . 1 1 9 ILE O O 10.390 12.492 3.399 . . . 1.0 . . . . . . . . . . . . A . 9 ILE O . . . . . . . . . rr_6wpd 1
. 1 . 140 . 1 1 10 ALA C C 12.327 10.504 2.257 . . . 1.0 . . . . . . . . . . . . A . 10 ALA C . . . . . . . . . rr_6wpd 1
. 1 . 141 . 1 1 10 ALA CA C 12.736 11.020 3.632 . . . 1.0 . . . . . . . . . . . . A . 10 ALA CA . . . . . . . . . rr_6wpd 1
. 1 . 142 . 1 1 10 ALA CB C 13.878 10.160 4.179 . . . 1.0 . . . . . . . . . . . . A . 10 ALA CB . . . . . . . . . rr_6wpd 1
. 1 . 143 . 1 1 10 ALA H H 11.653 10.414 5.347 . . . 1.0 . . . . . . . . . . . . A . 10 ALA H . . . . . . . . . rr_6wpd 1
. 1 . 144 . 1 1 10 ALA HA H 13.080 12.035 3.536 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HA . . . . . . . . . rr_6wpd 1
. 1 . 145 . 1 1 10 ALA HB1 H 14.151 10.505 5.167 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB1 . . . . . . . . . rr_6wpd 1
. 1 . 146 . 1 1 10 ALA HB2 H 14.732 10.235 3.523 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB2 . . . . . . . . . rr_6wpd 1
. 1 . 147 . 1 1 10 ALA HB3 H 13.556 9.131 4.234 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB3 . . . . . . . . . rr_6wpd 1
. 1 . 148 . 1 1 10 ALA N N 11.608 10.989 4.557 . . . 1.0 . . . . . . . . . . . . A . 10 ALA N . . . . . . . . . rr_6wpd 1
. 1 . 149 . 1 1 10 ALA O O 12.746 11.033 1.227 . . . 1.0 . . . . . . . . . . . . A . 10 ALA O . . . . . . . . . rr_6wpd 1
. 1 . 150 . 1 1 11 LYS C C 10.217 9.821 0.201 . . . 1.0 . . . . . . . . . . . . A . 11 LYS C . . . . . . . . . rr_6wpd 1
. 1 . 151 . 1 1 11 LYS CA C 11.048 8.847 1.024 . . . 1.0 . . . . . . . . . . . . A . 11 LYS CA . . . . . . . . . rr_6wpd 1
. 1 . 152 . 1 1 11 LYS CB C 10.206 7.630 1.372 . . . 1.0 . . . . . . . . . . . . A . 11 LYS CB . . . . . . . . . rr_6wpd 1
. 1 . 153 . 1 1 11 LYS CD C 11.587 5.648 0.668 . . . 1.0 . . . . . . . . . . . . A . 11 LYS CD . . . . . . . . . rr_6wpd 1
. 1 . 154 . 1 1 11 LYS CE C 12.670 4.682 1.141 . . . 1.0 . . . . . . . . . . . . A . 11 LYS CE . . . . . . . . . rr_6wpd 1
. 1 . 155 . 1 1 11 LYS CG C 11.111 6.485 1.854 . . . 1.0 . . . . . . . . . . . . A . 11 LYS CG . . . . . . . . . rr_6wpd 1
. 1 . 156 . 1 1 11 LYS H H 11.228 9.083 3.114 . . . 1.0 . . . . . . . . . . . . A . 11 LYS H . . . . . . . . . rr_6wpd 1
. 1 . 157 . 1 1 11 LYS HA H 11.891 8.525 0.453 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HA . . . . . . . . . rr_6wpd 1
. 1 . 158 . 1 1 11 LYS HB2 H 9.527 7.904 2.160 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HB2 . . . . . . . . . rr_6wpd 1
. 1 . 159 . 1 1 11 LYS HB3 H 9.645 7.314 0.509 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HB3 . . . . . . . . . rr_6wpd 1
. 1 . 160 . 1 1 11 LYS HD2 H 10.753 5.091 0.263 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HD2 . . . . . . . . . rr_6wpd 1
. 1 . 161 . 1 1 11 LYS HD3 H 11.989 6.293 -0.089 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HD3 . . . . . . . . . rr_6wpd 1
. 1 . 162 . 1 1 11 LYS HE2 H 13.064 4.139 0.295 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HE2 . . . . . . . . . rr_6wpd 1
. 1 . 163 . 1 1 11 LYS HE3 H 13.465 5.242 1.611 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HE3 . . . . . . . . . rr_6wpd 1
. 1 . 164 . 1 1 11 LYS HG2 H 11.973 6.890 2.370 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HG2 . . . . . . . . . rr_6wpd 1
. 1 . 165 . 1 1 11 LYS HG3 H 10.563 5.859 2.525 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HG3 . . . . . . . . . rr_6wpd 1
. 1 . 166 . 1 1 11 LYS HZ1 H 12.514 2.784 1.986 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HZ1 . . . . . . . . . rr_6wpd 1
. 1 . 167 . 1 1 11 LYS HZ2 H 11.060 3.664 1.982 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HZ2 . . . . . . . . . rr_6wpd 1
. 1 . 168 . 1 1 11 LYS HZ3 H 12.289 4.052 3.089 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HZ3 . . . . . . . . . rr_6wpd 1
. 1 . 169 . 1 1 11 LYS N N 11.515 9.458 2.259 . . . 1.0 . . . . . . . . . . . . A . 11 LYS N . . . . . . . . . rr_6wpd 1
. 1 . 170 . 1 1 11 LYS NZ N 12.089 3.723 2.125 . . . 1.0 . . . . . . . . . . . . A . 11 LYS NZ . . . . . . . . . rr_6wpd 1
. 1 . 171 . 1 1 11 LYS O O 10.356 9.898 -1.021 . . . 1.0 . . . . . . . . . . . . A . 11 LYS O . . . . . . . . . rr_6wpd 1
. 1 . 172 . 1 1 12 ALA C C 9.318 12.643 -0.385 . . . 1.0 . . . . . . . . . . . . A . 12 ALA C . . . . . . . . . rr_6wpd 1
. 1 . 173 . 1 1 12 ALA CA C 8.486 11.521 0.228 . . . 1.0 . . . . . . . . . . . . A . 12 ALA CA . . . . . . . . . rr_6wpd 1
. 1 . 174 . 1 1 12 ALA CB C 7.507 12.112 1.244 . . . 1.0 . . . . . . . . . . . . A . 12 ALA CB . . . . . . . . . rr_6wpd 1
. 1 . 175 . 1 1 12 ALA H H 9.287 10.435 1.855 . . . 1.0 . . . . . . . . . . . . A . 12 ALA H . . . . . . . . . rr_6wpd 1
. 1 . 176 . 1 1 12 ALA HA H 7.926 11.026 -0.552 . . . 1.0 . . . . . . . . . . . . A . 12 ALA HA . . . . . . . . . rr_6wpd 1
. 1 . 177 . 1 1 12 ALA HB1 H 6.834 12.793 0.745 . . . 1.0 . . . . . . . . . . . . A . 12 ALA HB1 . . . . . . . . . rr_6wpd 1
. 1 . 178 . 1 1 12 ALA HB2 H 8.060 12.646 2.003 . . . 1.0 . . . . . . . . . . . . A . 12 ALA HB2 . . . . . . . . . rr_6wpd 1
. 1 . 179 . 1 1 12 ALA HB3 H 6.939 11.316 1.706 . . . 1.0 . . . . . . . . . . . . A . 12 ALA HB3 . . . . . . . . . rr_6wpd 1
. 1 . 180 . 1 1 12 ALA N N 9.350 10.553 0.886 . . . 1.0 . . . . . . . . . . . . A . 12 ALA N . . . . . . . . . rr_6wpd 1
. 1 . 181 . 1 1 12 ALA O O 9.013 13.140 -1.470 . . . 1.0 . . . . . . . . . . . . A . 12 ALA O . . . . . . . . . rr_6wpd 1
. 1 . 182 . 1 1 13 ALA C C 11.951 13.755 -1.412 . . . 1.0 . . . . . . . . . . . . A . 13 ALA C . . . . . . . . . rr_6wpd 1
. 1 . 183 . 1 1 13 ALA CA C 11.242 14.117 -0.111 . . . 1.0 . . . . . . . . . . . . A . 13 ALA CA . . . . . . . . . rr_6wpd 1
. 1 . 184 . 1 1 13 ALA CB C 12.287 14.419 0.967 . . . 1.0 . . . . . . . . . . . . A . 13 ALA CB . . . . . . . . . rr_6wpd 1
. 1 . 185 . 1 1 13 ALA H H 10.537 12.608 1.197 . . . 1.0 . . . . . . . . . . . . A . 13 ALA H . . . . . . . . . rr_6wpd 1
. 1 . 186 . 1 1 13 ALA HA H 10.649 15.002 -0.275 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HA . . . . . . . . . rr_6wpd 1
. 1 . 187 . 1 1 13 ALA HB1 H 11.796 14.537 1.922 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB1 . . . . . . . . . rr_6wpd 1
. 1 . 188 . 1 1 13 ALA HB2 H 12.812 15.327 0.715 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB2 . . . . . . . . . rr_6wpd 1
. 1 . 189 . 1 1 13 ALA HB3 H 12.990 13.600 1.023 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB3 . . . . . . . . . rr_6wpd 1
. 1 . 190 . 1 1 13 ALA N N 10.363 13.041 0.336 . . . 1.0 . . . . . . . . . . . . A . 13 ALA N . . . . . . . . . rr_6wpd 1
. 1 . 191 . 1 1 13 ALA O O 12.135 14.602 -2.286 . . . 1.0 . . . . . . . . . . . . A . 13 ALA O . . . . . . . . . rr_6wpd 1
. 1 . 192 . 1 1 14 GLY C C 14.343 12.799 -2.934 . . . 1.0 . . . . . . . . . . . . A . 14 GLY C . . . . . . . . . rr_6wpd 1
. 1 . 193 . 1 1 14 GLY CA C 13.041 12.033 -2.726 . . . 1.0 . . . . . . . . . . . . A . 14 GLY CA . . . . . . . . . rr_6wpd 1
. 1 . 194 . 1 1 14 GLY H H 12.173 11.873 -0.799 . . . 1.0 . . . . . . . . . . . . A . 14 GLY H . . . . . . . . . rr_6wpd 1
. 1 . 195 . 1 1 14 GLY HA2 H 13.262 10.981 -2.622 . . . 1.0 . . . . . . . . . . . . A . 14 GLY HA2 . . . . . . . . . rr_6wpd 1
. 1 . 196 . 1 1 14 GLY HA3 H 12.405 12.180 -3.585 . . . 1.0 . . . . . . . . . . . . A . 14 GLY HA3 . . . . . . . . . rr_6wpd 1
. 1 . 197 . 1 1 14 GLY N N 12.348 12.497 -1.530 . . . 1.0 . . . . . . . . . . . . A . 14 GLY N . . . . . . . . . rr_6wpd 1
. 1 . 198 . 1 1 14 GLY O O 14.326 13.996 -3.224 . . . 1.0 . . . . . . . . . . . . A . 14 GLY O . . . . . . . . . rr_6wpd 1
. 1 . 199 . 1 1 15 NH2 HN1 H 15.497 11.225 -2.573 . . . 1.0 . . . . . . . . . . . . A . 15 NH2 HN1 . . . . . . . . . rr_6wpd 1
. 1 . 200 . 1 1 15 NH2 HN2 H 16.325 12.663 -2.930 . . . 1.0 . . . . . . . . . . . . A . 15 NH2 HN2 . . . . . . . . . rr_6wpd 1
. 1 . 201 . 1 1 15 NH2 N N 15.483 12.177 -2.802 . . . 1.0 . . . . . . . . . . . . A . 15 NH2 N . . . . . . . . . rr_6wpd 1
. 2 . 202 . 1 1 1 GLY C C 11.056 9.118 16.347 . . . 1.0 . . . . . . . . . . . . A . 1 GLY C . . . . . . . . . rr_6wpd 1
. 2 . 203 . 1 1 1 GLY CA C 10.764 10.583 16.646 . . . 1.0 . . . . . . . . . . . . A . 1 GLY CA . . . . . . . . . rr_6wpd 1
. 2 . 204 . 1 1 1 GLY H1 H 11.869 12.258 17.190 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H1 . . . . . . . . . rr_6wpd 1
. 2 . 205 . 1 1 1 GLY H2 H 12.812 10.948 16.661 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H2 . . . . . . . . . rr_6wpd 1
. 2 . 206 . 1 1 1 GLY H3 H 12.101 10.918 18.203 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H3 . . . . . . . . . rr_6wpd 1
. 2 . 207 . 1 1 1 GLY HA2 H 9.951 10.652 17.355 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA2 . . . . . . . . . rr_6wpd 1
. 2 . 208 . 1 1 1 GLY HA3 H 10.486 11.086 15.731 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA3 . . . . . . . . . rr_6wpd 1
. 2 . 209 . 1 1 1 GLY N N 11.979 11.226 17.218 . . . 1.0 . . . . . . . . . . . . A . 1 GLY N . . . . . . . . . rr_6wpd 1
. 2 . 210 . 1 1 1 GLY O O 12.164 8.636 16.569 . . . 1.0 . . . . . . . . . . . . A . 1 GLY O . . . . . . . . . rr_6wpd 1
. 2 . 211 . 1 1 2 ILE C C 10.874 6.894 14.132 . . . 1.0 . . . . . . . . . . . . A . 2 ILE C . . . . . . . . . rr_6wpd 1
. 2 . 212 . 1 1 2 ILE CA C 10.187 7.016 15.488 . . . 1.0 . . . . . . . . . . . . A . 2 ILE CA . . . . . . . . . rr_6wpd 1
. 2 . 213 . 1 1 2 ILE CB C 8.797 6.378 15.456 . . . 1.0 . . . . . . . . . . . . A . 2 ILE CB . . . . . . . . . rr_6wpd 1
. 2 . 214 . 1 1 2 ILE CD1 C 6.653 6.197 16.733 . . . 1.0 . . . . . . . . . . . . A . 2 ILE CD1 . . . . . . . . . rr_6wpd 1
. 2 . 215 . 1 1 2 ILE CG1 C 8.146 6.519 16.837 . . . 1.0 . . . . . . . . . . . . A . 2 ILE CG1 . . . . . . . . . rr_6wpd 1
. 2 . 216 . 1 1 2 ILE CG2 C 8.908 4.895 15.105 . . . 1.0 . . . . . . . . . . . . A . 2 ILE CG2 . . . . . . . . . rr_6wpd 1
. 2 . 217 . 1 1 2 ILE H H 9.198 8.862 15.668 . . . 1.0 . . . . . . . . . . . . A . 2 ILE H . . . . . . . . . rr_6wpd 1
. 2 . 218 . 1 1 2 ILE HA H 10.788 6.517 16.235 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HA . . . . . . . . . rr_6wpd 1
. 2 . 219 . 1 1 2 ILE HB H 8.193 6.880 14.718 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HB . . . . . . . . . rr_6wpd 1
. 2 . 220 . 1 1 2 ILE HD11 H 6.167 6.434 17.668 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HD11 . . . . . . . . . rr_6wpd 1
. 2 . 221 . 1 1 2 ILE HD12 H 6.526 5.147 16.517 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HD12 . . . . . . . . . rr_6wpd 1
. 2 . 222 . 1 1 2 ILE HD13 H 6.212 6.784 15.941 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HD13 . . . . . . . . . rr_6wpd 1
. 2 . 223 . 1 1 2 ILE HG12 H 8.615 5.834 17.529 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HG12 . . . . . . . . . rr_6wpd 1
. 2 . 224 . 1 1 2 ILE HG13 H 8.270 7.531 17.194 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HG13 . . . . . . . . . rr_6wpd 1
. 2 . 225 . 1 1 2 ILE HG21 H 7.975 4.399 15.334 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HG21 . . . . . . . . . rr_6wpd 1
. 2 . 226 . 1 1 2 ILE HG22 H 9.704 4.446 15.681 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HG22 . . . . . . . . . rr_6wpd 1
. 2 . 227 . 1 1 2 ILE HG23 H 9.120 4.790 14.057 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HG23 . . . . . . . . . rr_6wpd 1
. 2 . 228 . 1 1 2 ILE N N 10.052 8.420 15.833 . . . 1.0 . . . . . . . . . . . . A . 2 ILE N . . . . . . . . . rr_6wpd 1
. 2 . 229 . 1 1 2 ILE O O 10.577 7.645 13.205 . . . 1.0 . . . . . . . . . . . . A . 2 ILE O . . . . . . . . . rr_6wpd 1
. 2 . 230 . 1 1 3 LEU C C 11.613 5.551 11.609 . . . 1.0 . . . . . . . . . . . . A . 3 LEU C . . . . . . . . . rr_6wpd 1
. 2 . 231 . 1 1 3 LEU CA C 12.555 5.760 12.793 . . . 1.0 . . . . . . . . . . . . A . 3 LEU CA . . . . . . . . . rr_6wpd 1
. 2 . 232 . 1 1 3 LEU CB C 13.469 4.532 12.948 . . . 1.0 . . . . . . . . . . . . A . 3 LEU CB . . . . . . . . . rr_6wpd 1
. 2 . 233 . 1 1 3 LEU CD1 C 14.443 5.540 15.015 . . . 1.0 . . . . . . . . . . . . A . 3 LEU CD1 . . . . . . . . . rr_6wpd 1
. 2 . 234 . 1 1 3 LEU CD2 C 15.657 3.703 13.835 . . . 1.0 . . . . . . . . . . . . A . 3 LEU CD2 . . . . . . . . . rr_6wpd 1
. 2 . 235 . 1 1 3 LEU CG C 14.769 4.936 13.649 . . . 1.0 . . . . . . . . . . . . A . 3 LEU CG . . . . . . . . . rr_6wpd 1
. 2 . 236 . 1 1 3 LEU H H 12.012 5.405 14.814 . . . 1.0 . . . . . . . . . . . . A . 3 LEU H . . . . . . . . . rr_6wpd 1
. 2 . 237 . 1 1 3 LEU HA H 13.163 6.631 12.604 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HA . . . . . . . . . rr_6wpd 1
. 2 . 238 . 1 1 3 LEU HB2 H 12.963 3.783 13.539 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HB2 . . . . . . . . . rr_6wpd 1
. 2 . 239 . 1 1 3 LEU HB3 H 13.697 4.124 11.976 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HB3 . . . . . . . . . rr_6wpd 1
. 2 . 240 . 1 1 3 LEU HD11 H 15.343 5.593 15.610 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HD11 . . . . . . . . . rr_6wpd 1
. 2 . 241 . 1 1 3 LEU HD12 H 13.715 4.922 15.519 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HD12 . . . . . . . . . rr_6wpd 1
. 2 . 242 . 1 1 3 LEU HD13 H 14.041 6.534 14.882 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HD13 . . . . . . . . . rr_6wpd 1
. 2 . 243 . 1 1 3 LEU HD21 H 16.545 3.979 14.385 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HD21 . . . . . . . . . rr_6wpd 1
. 2 . 244 . 1 1 3 LEU HD22 H 15.939 3.313 12.868 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HD22 . . . . . . . . . rr_6wpd 1
. 2 . 245 . 1 1 3 LEU HD23 H 15.114 2.947 14.384 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HD23 . . . . . . . . . rr_6wpd 1
. 2 . 246 . 1 1 3 LEU HG H 15.286 5.667 13.047 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HG . . . . . . . . . rr_6wpd 1
. 2 . 247 . 1 1 3 LEU N N 11.807 5.962 14.033 . . . 1.0 . . . . . . . . . . . . A . 3 LEU N . . . . . . . . . rr_6wpd 1
. 2 . 248 . 1 1 3 LEU O O 11.928 5.925 10.482 . . . 1.0 . . . . . . . . . . . . A . 3 LEU O . . . . . . . . . rr_6wpd 1
. 2 . 249 . 1 1 4 ASP C C 8.968 5.967 10.198 . . . 1.0 . . . . . . . . . . . . A . 4 ASP C . . . . . . . . . rr_6wpd 1
. 2 . 250 . 1 1 4 ASP CA C 9.487 4.674 10.826 . . . 1.0 . . . . . . . . . . . . A . 4 ASP CA . . . . . . . . . rr_6wpd 1
. 2 . 251 . 1 1 4 ASP CB C 8.319 3.885 11.432 . . . 1.0 . . . . . . . . . . . . A . 4 ASP CB . . . . . . . . . rr_6wpd 1
. 2 . 252 . 1 1 4 ASP CG C 7.347 3.433 10.345 . . . 1.0 . . . . . . . . . . . . A . 4 ASP CG . . . . . . . . . rr_6wpd 1
. 2 . 253 . 1 1 4 ASP H H 10.285 4.681 12.798 . . . 1.0 . . . . . . . . . . . . A . 4 ASP H . . . . . . . . . rr_6wpd 1
. 2 . 254 . 1 1 4 ASP HA H 9.950 4.073 10.058 . . . 1.0 . . . . . . . . . . . . A . 4 ASP HA . . . . . . . . . rr_6wpd 1
. 2 . 255 . 1 1 4 ASP HB2 H 8.703 3.017 11.947 . . . 1.0 . . . . . . . . . . . . A . 4 ASP HB2 . . . . . . . . . rr_6wpd 1
. 2 . 256 . 1 1 4 ASP HB3 H 7.796 4.514 12.137 . . . 1.0 . . . . . . . . . . . . A . 4 ASP HB3 . . . . . . . . . rr_6wpd 1
. 2 . 257 . 1 1 4 ASP N N 10.472 4.948 11.875 . . . 1.0 . . . . . . . . . . . . A . 4 ASP N . . . . . . . . . rr_6wpd 1
. 2 . 258 . 1 1 4 ASP O O 8.865 6.083 8.977 . . . 1.0 . . . . . . . . . . . . A . 4 ASP O . . . . . . . . . rr_6wpd 1
. 2 . 259 . 1 1 4 ASP OD1 O 7.516 3.851 9.212 . . . 1.0 . . . . . . . . . . . . A . 4 ASP OD1 . . . . . . . . . rr_6wpd 1
. 2 . 260 . 1 1 4 ASP OD2 O 6.444 2.672 10.663 . . . 1.0 . . . . . . . . . . . . A . 4 ASP OD2 . . . . . . . . . rr_6wpd 1
. 2 . 261 . 1 1 5 ALA C C 9.196 8.990 9.795 . . . 1.0 . . . . . . . . . . . . A . 5 ALA C . . . . . . . . . rr_6wpd 1
. 2 . 262 . 1 1 5 ALA CA C 8.131 8.223 10.578 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CA . . . . . . . . . rr_6wpd 1
. 2 . 263 . 1 1 5 ALA CB C 7.693 9.058 11.786 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CB . . . . . . . . . rr_6wpd 1
. 2 . 264 . 1 1 5 ALA H H 8.751 6.782 12.007 . . . 1.0 . . . . . . . . . . . . A . 5 ALA H . . . . . . . . . rr_6wpd 1
. 2 . 265 . 1 1 5 ALA HA H 7.277 8.055 9.942 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HA . . . . . . . . . rr_6wpd 1
. 2 . 266 . 1 1 5 ALA HB1 H 6.787 8.642 12.206 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB1 . . . . . . . . . rr_6wpd 1
. 2 . 267 . 1 1 5 ALA HB2 H 7.512 10.077 11.479 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB2 . . . . . . . . . rr_6wpd 1
. 2 . 268 . 1 1 5 ALA HB3 H 8.473 9.041 12.533 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB3 . . . . . . . . . rr_6wpd 1
. 2 . 269 . 1 1 5 ALA N N 8.644 6.934 11.045 . . . 1.0 . . . . . . . . . . . . A . 5 ALA N . . . . . . . . . rr_6wpd 1
. 2 . 270 . 1 1 5 ALA O O 8.905 9.619 8.779 . . . 1.0 . . . . . . . . . . . . A . 5 ALA O . . . . . . . . . rr_6wpd 1
. 2 . 271 . 1 1 6 ILE C C 11.803 9.066 8.241 . . . 1.0 . . . . . . . . . . . . A . 6 ILE C . . . . . . . . . rr_6wpd 1
. 2 . 272 . 1 1 6 ILE CA C 11.546 9.616 9.644 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CA . . . . . . . . . rr_6wpd 1
. 2 . 273 . 1 1 6 ILE CB C 12.782 9.432 10.528 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CB . . . . . . . . . rr_6wpd 1
. 2 . 274 . 1 1 6 ILE CD1 C 13.613 9.784 12.868 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CD1 . . . . . . . . . rr_6wpd 1
. 2 . 275 . 1 1 6 ILE CG1 C 12.573 10.209 11.830 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CG1 . . . . . . . . . rr_6wpd 1
. 2 . 276 . 1 1 6 ILE CG2 C 14.036 9.951 9.818 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CG2 . . . . . . . . . rr_6wpd 1
. 2 . 277 . 1 1 6 ILE H H 10.583 8.408 11.098 . . . 1.0 . . . . . . . . . . . . A . 6 ILE H . . . . . . . . . rr_6wpd 1
. 2 . 278 . 1 1 6 ILE HA H 11.320 10.668 9.572 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HA . . . . . . . . . rr_6wpd 1
. 2 . 279 . 1 1 6 ILE HB H 12.906 8.383 10.752 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HB . . . . . . . . . rr_6wpd 1
. 2 . 280 . 1 1 6 ILE HD11 H 14.578 9.680 12.394 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HD11 . . . . . . . . . rr_6wpd 1
. 2 . 281 . 1 1 6 ILE HD12 H 13.321 8.842 13.302 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HD12 . . . . . . . . . rr_6wpd 1
. 2 . 282 . 1 1 6 ILE HD13 H 13.671 10.533 13.643 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HD13 . . . . . . . . . rr_6wpd 1
. 2 . 283 . 1 1 6 ILE HG12 H 12.673 11.265 11.634 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG12 . . . . . . . . . rr_6wpd 1
. 2 . 284 . 1 1 6 ILE HG13 H 11.583 10.007 12.213 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG13 . . . . . . . . . rr_6wpd 1
. 2 . 285 . 1 1 6 ILE HG21 H 14.855 9.995 10.524 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG21 . . . . . . . . . rr_6wpd 1
. 2 . 286 . 1 1 6 ILE HG22 H 13.847 10.938 9.427 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG22 . . . . . . . . . rr_6wpd 1
. 2 . 287 . 1 1 6 ILE HG23 H 14.297 9.285 9.008 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG23 . . . . . . . . . rr_6wpd 1
. 2 . 288 . 1 1 6 ILE N N 10.423 8.929 10.282 . . . 1.0 . . . . . . . . . . . . A . 6 ILE N . . . . . . . . . rr_6wpd 1
. 2 . 289 . 1 1 6 ILE O O 12.036 9.818 7.297 . . . 1.0 . . . . . . . . . . . . A . 6 ILE O . . . . . . . . . rr_6wpd 1
. 2 . 290 . 1 1 7 LYS C C 10.906 7.469 5.825 . . . 1.0 . . . . . . . . . . . . A . 7 LYS C . . . . . . . . . rr_6wpd 1
. 2 . 291 . 1 1 7 LYS CA C 11.974 7.084 6.846 . . . 1.0 . . . . . . . . . . . . A . 7 LYS CA . . . . . . . . . rr_6wpd 1
. 2 . 292 . 1 1 7 LYS CB C 11.947 5.575 7.088 . . . 1.0 . . . . . . . . . . . . A . 7 LYS CB . . . . . . . . . rr_6wpd 1
. 2 . 293 . 1 1 7 LYS CD C 14.374 4.939 7.058 . . . 1.0 . . . . . . . . . . . . A . 7 LYS CD . . . . . . . . . rr_6wpd 1
. 2 . 294 . 1 1 7 LYS CE C 15.570 4.511 7.904 . . . 1.0 . . . . . . . . . . . . A . 7 LYS CE . . . . . . . . . rr_6wpd 1
. 2 . 295 . 1 1 7 LYS CG C 13.153 5.157 7.948 . . . 1.0 . . . . . . . . . . . . A . 7 LYS CG . . . . . . . . . rr_6wpd 1
. 2 . 296 . 1 1 7 LYS H H 11.559 7.207 8.911 . . . 1.0 . . . . . . . . . . . . A . 7 LYS H . . . . . . . . . rr_6wpd 1
. 2 . 297 . 1 1 7 LYS HA H 12.934 7.360 6.467 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HA . . . . . . . . . rr_6wpd 1
. 2 . 298 . 1 1 7 LYS HB2 H 11.039 5.323 7.601 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HB2 . . . . . . . . . rr_6wpd 1
. 2 . 299 . 1 1 7 LYS HB3 H 11.977 5.055 6.144 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HB3 . . . . . . . . . rr_6wpd 1
. 2 . 300 . 1 1 7 LYS HD2 H 14.149 4.173 6.342 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HD2 . . . . . . . . . rr_6wpd 1
. 2 . 301 . 1 1 7 LYS HD3 H 14.618 5.851 6.540 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HD3 . . . . . . . . . rr_6wpd 1
. 2 . 302 . 1 1 7 LYS HE2 H 15.786 5.275 8.640 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HE2 . . . . . . . . . rr_6wpd 1
. 2 . 303 . 1 1 7 LYS HE3 H 15.349 3.579 8.402 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HE3 . . . . . . . . . rr_6wpd 1
. 2 . 304 . 1 1 7 LYS HG2 H 13.373 5.934 8.659 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HG2 . . . . . . . . . rr_6wpd 1
. 2 . 305 . 1 1 7 LYS HG3 H 12.923 4.244 8.475 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HG3 . . . . . . . . . rr_6wpd 1
. 2 . 306 . 1 1 7 LYS HZ1 H 16.481 4.621 6.041 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HZ1 . . . . . . . . . rr_6wpd 1
. 2 . 307 . 1 1 7 LYS HZ2 H 17.030 3.333 7.004 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HZ2 . . . . . . . . . rr_6wpd 1
. 2 . 308 . 1 1 7 LYS HZ3 H 17.531 4.922 7.338 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HZ3 . . . . . . . . . rr_6wpd 1
. 2 . 309 . 1 1 7 LYS N N 11.754 7.750 8.122 . . . 1.0 . . . . . . . . . . . . A . 7 LYS N . . . . . . . . . rr_6wpd 1
. 2 . 310 . 1 1 7 LYS NZ N 16.743 4.333 7.005 . . . 1.0 . . . . . . . . . . . . A . 7 LYS NZ . . . . . . . . . rr_6wpd 1
. 2 . 311 . 1 1 7 LYS O O 11.203 7.717 4.657 . . . 1.0 . . . . . . . . . . . . A . 7 LYS O . . . . . . . . . rr_6wpd 1
. 2 . 312 . 1 1 8 ALA C C 8.693 9.287 4.872 . . . 1.0 . . . . . . . . . . . . A . 8 ALA C . . . . . . . . . rr_6wpd 1
. 2 . 313 . 1 1 8 ALA CA C 8.545 7.864 5.410 . . . 1.0 . . . . . . . . . . . . A . 8 ALA CA . . . . . . . . . rr_6wpd 1
. 2 . 314 . 1 1 8 ALA CB C 7.242 7.755 6.206 . . . 1.0 . . . . . . . . . . . . A . 8 ALA CB . . . . . . . . . rr_6wpd 1
. 2 . 315 . 1 1 8 ALA H H 9.493 7.305 7.224 . . . 1.0 . . . . . . . . . . . . A . 8 ALA H . . . . . . . . . rr_6wpd 1
. 2 . 316 . 1 1 8 ALA HA H 8.508 7.174 4.582 . . . 1.0 . . . . . . . . . . . . A . 8 ALA HA . . . . . . . . . rr_6wpd 1
. 2 . 317 . 1 1 8 ALA HB1 H 7.181 6.781 6.669 . . . 1.0 . . . . . . . . . . . . A . 8 ALA HB1 . . . . . . . . . rr_6wpd 1
. 2 . 318 . 1 1 8 ALA HB2 H 6.398 7.894 5.546 . . . 1.0 . . . . . . . . . . . . A . 8 ALA HB2 . . . . . . . . . rr_6wpd 1
. 2 . 319 . 1 1 8 ALA HB3 H 7.229 8.517 6.972 . . . 1.0 . . . . . . . . . . . . A . 8 ALA HB3 . . . . . . . . . rr_6wpd 1
. 2 . 320 . 1 1 8 ALA N N 9.664 7.513 6.280 . . . 1.0 . . . . . . . . . . . . A . 8 ALA N . . . . . . . . . rr_6wpd 1
. 2 . 321 . 1 1 8 ALA O O 8.460 9.546 3.692 . . . 1.0 . . . . . . . . . . . . A . 8 ALA O . . . . . . . . . rr_6wpd 1
. 2 . 322 . 1 1 9 ILE C C 10.386 11.758 4.350 . . . 1.0 . . . . . . . . . . . . A . 9 ILE C . . . . . . . . . rr_6wpd 1
. 2 . 323 . 1 1 9 ILE CA C 9.272 11.599 5.383 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CA . . . . . . . . . rr_6wpd 1
. 2 . 324 . 1 1 9 ILE CB C 9.618 12.386 6.650 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CB . . . . . . . . . rr_6wpd 1
. 2 . 325 . 1 1 9 ILE CD1 C 8.798 12.896 8.960 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CD1 . . . . . . . . . rr_6wpd 1
. 2 . 326 . 1 1 9 ILE CG1 C 8.396 12.419 7.563 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CG1 . . . . . . . . . rr_6wpd 1
. 2 . 327 . 1 1 9 ILE CG2 C 10.035 13.818 6.303 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CG2 . . . . . . . . . rr_6wpd 1
. 2 . 328 . 1 1 9 ILE H H 9.259 9.918 6.676 . . . 1.0 . . . . . . . . . . . . A . 9 ILE H . . . . . . . . . rr_6wpd 1
. 2 . 329 . 1 1 9 ILE HA H 8.352 11.984 4.974 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HA . . . . . . . . . rr_6wpd 1
. 2 . 330 . 1 1 9 ILE HB H 10.425 11.895 7.161 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HB . . . . . . . . . rr_6wpd 1
. 2 . 331 . 1 1 9 ILE HD11 H 7.917 13.209 9.499 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HD11 . . . . . . . . . rr_6wpd 1
. 2 . 332 . 1 1 9 ILE HD12 H 9.484 13.727 8.876 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HD12 . . . . . . . . . rr_6wpd 1
. 2 . 333 . 1 1 9 ILE HD13 H 9.276 12.087 9.491 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HD13 . . . . . . . . . rr_6wpd 1
. 2 . 334 . 1 1 9 ILE HG12 H 7.671 13.093 7.149 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG12 . . . . . . . . . rr_6wpd 1
. 2 . 335 . 1 1 9 ILE HG13 H 7.970 11.430 7.632 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG13 . . . . . . . . . rr_6wpd 1
. 2 . 336 . 1 1 9 ILE HG21 H 11.013 13.810 5.843 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG21 . . . . . . . . . rr_6wpd 1
. 2 . 337 . 1 1 9 ILE HG22 H 10.068 14.412 7.206 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG22 . . . . . . . . . rr_6wpd 1
. 2 . 338 . 1 1 9 ILE HG23 H 9.318 14.245 5.619 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG23 . . . . . . . . . rr_6wpd 1
. 2 . 339 . 1 1 9 ILE N N 9.086 10.196 5.751 . . . 1.0 . . . . . . . . . . . . A . 9 ILE N . . . . . . . . . rr_6wpd 1
. 2 . 340 . 1 1 9 ILE O O 10.251 12.504 3.380 . . . 1.0 . . . . . . . . . . . . A . 9 ILE O . . . . . . . . . rr_6wpd 1
. 2 . 341 . 1 1 10 ALA C C 12.275 10.555 2.292 . . . 1.0 . . . . . . . . . . . . A . 10 ALA C . . . . . . . . . rr_6wpd 1
. 2 . 342 . 1 1 10 ALA CA C 12.629 11.109 3.670 . . . 1.0 . . . . . . . . . . . . A . 10 ALA CA . . . . . . . . . rr_6wpd 1
. 2 . 343 . 1 1 10 ALA CB C 13.781 10.292 4.263 . . . 1.0 . . . . . . . . . . . . A . 10 ALA CB . . . . . . . . . rr_6wpd 1
. 2 . 344 . 1 1 10 ALA H H 11.526 10.477 5.365 . . . 1.0 . . . . . . . . . . . . A . 10 ALA H . . . . . . . . . rr_6wpd 1
. 2 . 345 . 1 1 10 ALA HA H 12.943 12.131 3.567 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HA . . . . . . . . . rr_6wpd 1
. 2 . 346 . 1 1 10 ALA HB1 H 14.555 10.160 3.521 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB1 . . . . . . . . . rr_6wpd 1
. 2 . 347 . 1 1 10 ALA HB2 H 13.410 9.325 4.570 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB2 . . . . . . . . . rr_6wpd 1
. 2 . 348 . 1 1 10 ALA HB3 H 14.188 10.807 5.121 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB3 . . . . . . . . . rr_6wpd 1
. 2 . 349 . 1 1 10 ALA N N 11.482 11.051 4.572 . . . 1.0 . . . . . . . . . . . . A . 10 ALA N . . . . . . . . . rr_6wpd 1
. 2 . 350 . 1 1 10 ALA O O 12.691 11.088 1.265 . . . 1.0 . . . . . . . . . . . . A . 10 ALA O . . . . . . . . . rr_6wpd 1
. 2 . 351 . 1 1 11 LYS C C 10.282 9.789 0.180 . . . 1.0 . . . . . . . . . . . . A . 11 LYS C . . . . . . . . . rr_6wpd 1
. 2 . 352 . 1 1 11 LYS CA C 11.090 8.832 1.053 . . . 1.0 . . . . . . . . . . . . A . 11 LYS CA . . . . . . . . . rr_6wpd 1
. 2 . 353 . 1 1 11 LYS CB C 10.230 7.612 1.412 . . . 1.0 . . . . . . . . . . . . A . 11 LYS CB . . . . . . . . . rr_6wpd 1
. 2 . 354 . 1 1 11 LYS CD C 11.072 5.850 -0.160 . . . 1.0 . . . . . . . . . . . . A . 11 LYS CD . . . . . . . . . rr_6wpd 1
. 2 . 355 . 1 1 11 LYS CE C 10.702 4.923 -1.314 . . . 1.0 . . . . . . . . . . . . A . 11 LYS CE . . . . . . . . . rr_6wpd 1
. 2 . 356 . 1 1 11 LYS CG C 9.902 6.777 0.163 . . . 1.0 . . . . . . . . . . . . A . 11 LYS CG . . . . . . . . . rr_6wpd 1
. 2 . 357 . 1 1 11 LYS H H 11.217 9.109 3.148 . . . 1.0 . . . . . . . . . . . . A . 11 LYS H . . . . . . . . . rr_6wpd 1
. 2 . 358 . 1 1 11 LYS HA H 11.962 8.508 0.513 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HA . . . . . . . . . rr_6wpd 1
. 2 . 359 . 1 1 11 LYS HB2 H 10.760 7.001 2.127 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HB2 . . . . . . . . . rr_6wpd 1
. 2 . 360 . 1 1 11 LYS HB3 H 9.308 7.952 1.861 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HB3 . . . . . . . . . rr_6wpd 1
. 2 . 361 . 1 1 11 LYS HD2 H 11.933 6.435 -0.438 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HD2 . . . . . . . . . rr_6wpd 1
. 2 . 362 . 1 1 11 LYS HD3 H 11.304 5.261 0.705 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HD3 . . . . . . . . . rr_6wpd 1
. 2 . 363 . 1 1 11 LYS HE2 H 9.834 4.339 -1.046 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HE2 . . . . . . . . . rr_6wpd 1
. 2 . 364 . 1 1 11 LYS HE3 H 10.490 5.508 -2.197 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HE3 . . . . . . . . . rr_6wpd 1
. 2 . 365 . 1 1 11 LYS HG2 H 9.015 6.186 0.351 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HG2 . . . . . . . . . rr_6wpd 1
. 2 . 366 . 1 1 11 LYS HG3 H 9.723 7.423 -0.673 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HG3 . . . . . . . . . rr_6wpd 1
. 2 . 367 . 1 1 11 LYS HZ1 H 12.589 4.539 -2.101 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HZ1 . . . . . . . . . rr_6wpd 1
. 2 . 368 . 1 1 11 LYS HZ2 H 11.538 3.204 -2.140 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HZ2 . . . . . . . . . rr_6wpd 1
. 2 . 369 . 1 1 11 LYS HZ3 H 12.247 3.690 -0.674 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HZ3 . . . . . . . . . rr_6wpd 1
. 2 . 370 . 1 1 11 LYS N N 11.508 9.481 2.291 . . . 1.0 . . . . . . . . . . . . A . 11 LYS N . . . . . . . . . rr_6wpd 1
. 2 . 371 . 1 1 11 LYS NZ N 11.855 4.020 -1.580 . . . 1.0 . . . . . . . . . . . . A . 11 LYS NZ . . . . . . . . . rr_6wpd 1
. 2 . 372 . 1 1 11 LYS O O 10.485 9.869 -1.032 . . . 1.0 . . . . . . . . . . . . A . 11 LYS O . . . . . . . . . rr_6wpd 1
. 2 . 373 . 1 1 12 ALA C C 9.342 12.590 -0.496 . . . 1.0 . . . . . . . . . . . . A . 12 ALA C . . . . . . . . . rr_6wpd 1
. 2 . 374 . 1 1 12 ALA CA C 8.514 11.451 0.094 . . . 1.0 . . . . . . . . . . . . A . 12 ALA CA . . . . . . . . . rr_6wpd 1
. 2 . 375 . 1 1 12 ALA CB C 7.477 12.024 1.065 . . . 1.0 . . . . . . . . . . . . A . 12 ALA CB . . . . . . . . . rr_6wpd 1
. 2 . 376 . 1 1 12 ALA H H 9.248 10.390 1.776 . . . 1.0 . . . . . . . . . . . . A . 12 ALA H . . . . . . . . . rr_6wpd 1
. 2 . 377 . 1 1 12 ALA HA H 8.000 10.937 -0.702 . . . 1.0 . . . . . . . . . . . . A . 12 ALA HA . . . . . . . . . rr_6wpd 1
. 2 . 378 . 1 1 12 ALA HB1 H 6.699 12.531 0.513 . . . 1.0 . . . . . . . . . . . . A . 12 ALA HB1 . . . . . . . . . rr_6wpd 1
. 2 . 379 . 1 1 12 ALA HB2 H 7.960 12.724 1.732 . . . 1.0 . . . . . . . . . . . . A . 12 ALA HB2 . . . . . . . . . rr_6wpd 1
. 2 . 380 . 1 1 12 ALA HB3 H 7.043 11.222 1.644 . . . 1.0 . . . . . . . . . . . . A . 12 ALA HB3 . . . . . . . . . rr_6wpd 1
. 2 . 381 . 1 1 12 ALA N N 9.363 10.504 0.808 . . . 1.0 . . . . . . . . . . . . A . 12 ALA N . . . . . . . . . rr_6wpd 1
. 2 . 382 . 1 1 12 ALA O O 9.107 13.027 -1.623 . . . 1.0 . . . . . . . . . . . . A . 12 ALA O . . . . . . . . . rr_6wpd 1
. 2 . 383 . 1 1 13 ALA C C 12.034 13.745 -1.350 . . . 1.0 . . . . . . . . . . . . A . 13 ALA C . . . . . . . . . rr_6wpd 1
. 2 . 384 . 1 1 13 ALA CA C 11.175 14.156 -0.154 . . . 1.0 . . . . . . . . . . . . A . 13 ALA CA . . . . . . . . . rr_6wpd 1
. 2 . 385 . 1 1 13 ALA CB C 12.076 14.578 1.009 . . . 1.0 . . . . . . . . . . . . A . 13 ALA CB . . . . . . . . . rr_6wpd 1
. 2 . 386 . 1 1 13 ALA H H 10.440 12.671 1.167 . . . 1.0 . . . . . . . . . . . . A . 13 ALA H . . . . . . . . . rr_6wpd 1
. 2 . 387 . 1 1 13 ALA HA H 10.564 14.993 -0.438 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HA . . . . . . . . . rr_6wpd 1
. 2 . 388 . 1 1 13 ALA HB1 H 12.687 15.419 0.712 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB1 . . . . . . . . . rr_6wpd 1
. 2 . 389 . 1 1 13 ALA HB2 H 12.713 13.751 1.285 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB2 . . . . . . . . . rr_6wpd 1
. 2 . 390 . 1 1 13 ALA HB3 H 11.466 14.858 1.856 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB3 . . . . . . . . . rr_6wpd 1
. 2 . 391 . 1 1 13 ALA N N 10.308 13.064 0.279 . . . 1.0 . . . . . . . . . . . . A . 13 ALA N . . . . . . . . . rr_6wpd 1
. 2 . 392 . 1 1 13 ALA O O 12.265 14.537 -2.264 . . . 1.0 . . . . . . . . . . . . A . 13 ALA O . . . . . . . . . rr_6wpd 1
. 2 . 393 . 1 1 14 GLY C C 13.298 10.468 -2.461 . . . 1.0 . . . . . . . . . . . . A . 14 GLY C . . . . . . . . . rr_6wpd 1
. 2 . 394 . 1 1 14 GLY CA C 13.338 11.993 -2.420 . . . 1.0 . . . . . . . . . . . . A . 14 GLY CA . . . . . . . . . rr_6wpd 1
. 2 . 395 . 1 1 14 GLY H H 12.283 11.927 -0.575 . . . 1.0 . . . . . . . . . . . . A . 14 GLY H . . . . . . . . . rr_6wpd 1
. 2 . 396 . 1 1 14 GLY HA2 H 12.979 12.383 -3.363 . . . 1.0 . . . . . . . . . . . . A . 14 GLY HA2 . . . . . . . . . rr_6wpd 1
. 2 . 397 . 1 1 14 GLY HA3 H 14.359 12.313 -2.269 . . . 1.0 . . . . . . . . . . . . A . 14 GLY HA3 . . . . . . . . . rr_6wpd 1
. 2 . 398 . 1 1 14 GLY N N 12.503 12.507 -1.333 . . . 1.0 . . . . . . . . . . . . A . 14 GLY N . . . . . . . . . rr_6wpd 1
. 2 . 399 . 1 1 14 GLY O O 13.007 9.822 -1.452 . . . 1.0 . . . . . . . . . . . . A . 14 GLY O . . . . . . . . . rr_6wpd 1
. 2 . 400 . 1 1 15 NH2 HN1 H 13.805 10.358 -4.377 . . . 1.0 . . . . . . . . . . . . A . 15 NH2 HN1 . . . . . . . . . rr_6wpd 1
. 2 . 401 . 1 1 15 NH2 HN2 H 13.547 8.867 -3.610 . . . 1.0 . . . . . . . . . . . . A . 15 NH2 HN2 . . . . . . . . . rr_6wpd 1
. 2 . 402 . 1 1 15 NH2 N N 13.574 9.847 -3.575 . . . 1.0 . . . . . . . . . . . . A . 15 NH2 N . . . . . . . . . rr_6wpd 1
. 3 . 403 . 1 1 1 GLY C C 10.857 9.133 16.243 . . . 1.0 . . . . . . . . . . . . A . 1 GLY C . . . . . . . . . rr_6wpd 1
. 3 . 404 . 1 1 1 GLY CA C 10.585 10.620 16.472 . . . 1.0 . . . . . . . . . . . . A . 1 GLY CA . . . . . . . . . rr_6wpd 1
. 3 . 405 . 1 1 1 GLY H1 H 9.301 10.419 14.843 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H1 . . . . . . . . . rr_6wpd 1
. 3 . 406 . 1 1 1 GLY H2 H 9.518 12.023 15.357 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H2 . . . . . . . . . rr_6wpd 1
. 3 . 407 . 1 1 1 GLY H3 H 8.541 10.965 16.258 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H3 . . . . . . . . . rr_6wpd 1
. 3 . 408 . 1 1 1 GLY HA2 H 11.447 11.197 16.163 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA2 . . . . . . . . . rr_6wpd 1
. 3 . 409 . 1 1 1 GLY HA3 H 10.393 10.793 17.520 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA3 . . . . . . . . . rr_6wpd 1
. 3 . 410 . 1 1 1 GLY N N 9.397 11.039 15.672 . . . 1.0 . . . . . . . . . . . . A . 1 GLY N . . . . . . . . . rr_6wpd 1
. 3 . 411 . 1 1 1 GLY O O 11.930 8.630 16.571 . . . 1.0 . . . . . . . . . . . . A . 1 GLY O . . . . . . . . . rr_6wpd 1
. 3 . 412 . 1 1 2 ILE C C 10.802 6.869 14.088 . . . 1.0 . . . . . . . . . . . . A . 2 ILE C . . . . . . . . . rr_6wpd 1
. 3 . 413 . 1 1 2 ILE CA C 10.007 7.030 15.374 . . . 1.0 . . . . . . . . . . . . A . 2 ILE CA . . . . . . . . . rr_6wpd 1
. 3 . 414 . 1 1 2 ILE CB C 8.611 6.418 15.216 . . . 1.0 . . . . . . . . . . . . A . 2 ILE CB . . . . . . . . . rr_6wpd 1
. 3 . 415 . 1 1 2 ILE CD1 C 8.358 6.662 17.713 . . . 1.0 . . . . . . . . . . . . A . 2 ILE CD1 . . . . . . . . . rr_6wpd 1
. 3 . 416 . 1 1 2 ILE CG1 C 7.709 6.927 16.349 . . . 1.0 . . . . . . . . . . . . A . 2 ILE CG1 . . . . . . . . . rr_6wpd 1
. 3 . 417 . 1 1 2 ILE CG2 C 8.690 4.887 15.269 . . . 1.0 . . . . . . . . . . . . A . 2 ILE CG2 . . . . . . . . . rr_6wpd 1
. 3 . 418 . 1 1 2 ILE H H 9.055 8.905 15.413 . . . 1.0 . . . . . . . . . . . . A . 2 ILE H . . . . . . . . . rr_6wpd 1
. 3 . 419 . 1 1 2 ILE HA H 10.527 6.534 16.181 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HA . . . . . . . . . rr_6wpd 1
. 3 . 420 . 1 1 2 ILE HB H 8.198 6.718 14.268 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HB . . . . . . . . . rr_6wpd 1
. 3 . 421 . 1 1 2 ILE HD11 H 7.608 6.739 18.487 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HD11 . . . . . . . . . rr_6wpd 1
. 3 . 422 . 1 1 2 ILE HD12 H 9.133 7.393 17.892 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HD12 . . . . . . . . . rr_6wpd 1
. 3 . 423 . 1 1 2 ILE HD13 H 8.788 5.672 17.728 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HD13 . . . . . . . . . rr_6wpd 1
. 3 . 424 . 1 1 2 ILE HG12 H 7.556 7.989 16.231 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HG12 . . . . . . . . . rr_6wpd 1
. 3 . 425 . 1 1 2 ILE HG13 H 6.756 6.421 16.305 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HG13 . . . . . . . . . rr_6wpd 1
. 3 . 426 . 1 1 2 ILE HG21 H 7.720 4.470 15.041 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HG21 . . . . . . . . . rr_6wpd 1
. 3 . 427 . 1 1 2 ILE HG22 H 8.990 4.574 16.259 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HG22 . . . . . . . . . rr_6wpd 1
. 3 . 428 . 1 1 2 ILE HG23 H 9.411 4.539 14.546 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HG23 . . . . . . . . . rr_6wpd 1
. 3 . 429 . 1 1 2 ILE N N 9.878 8.446 15.664 . . . 1.0 . . . . . . . . . . . . A . 2 ILE N . . . . . . . . . rr_6wpd 1
. 3 . 430 . 1 1 2 ILE O O 10.584 7.603 13.125 . . . 1.0 . . . . . . . . . . . . A . 2 ILE O . . . . . . . . . rr_6wpd 1
. 3 . 431 . 1 1 3 LEU C C 11.682 5.539 11.679 . . . 1.0 . . . . . . . . . . . . A . 3 LEU C . . . . . . . . . rr_6wpd 1
. 3 . 432 . 1 1 3 LEU CA C 12.563 5.710 12.899 . . . 1.0 . . . . . . . . . . . . A . 3 LEU CA . . . . . . . . . rr_6wpd 1
. 3 . 433 . 1 1 3 LEU CB C 13.409 4.451 13.087 . . . 1.0 . . . . . . . . . . . . A . 3 LEU CB . . . . . . . . . rr_6wpd 1
. 3 . 434 . 1 1 3 LEU CD1 C 15.103 3.350 14.567 . . . 1.0 . . . . . . . . . . . . A . 3 LEU CD1 . . . . . . . . . rr_6wpd 1
. 3 . 435 . 1 1 3 LEU CD2 C 15.577 5.635 13.639 . . . 1.0 . . . . . . . . . . . . A . 3 LEU CD2 . . . . . . . . . rr_6wpd 1
. 3 . 436 . 1 1 3 LEU CG C 14.477 4.690 14.164 . . . 1.0 . . . . . . . . . . . . A . 3 LEU CG . . . . . . . . . rr_6wpd 1
. 3 . 437 . 1 1 3 LEU H H 11.878 5.383 14.884 . . . 1.0 . . . . . . . . . . . . A . 3 LEU H . . . . . . . . . rr_6wpd 1
. 3 . 438 . 1 1 3 LEU HA H 13.208 6.558 12.754 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HA . . . . . . . . . rr_6wpd 1
. 3 . 439 . 1 1 3 LEU HB2 H 12.769 3.638 13.397 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HB2 . . . . . . . . . rr_6wpd 1
. 3 . 440 . 1 1 3 LEU HB3 H 13.879 4.195 12.154 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HB3 . . . . . . . . . rr_6wpd 1
. 3 . 441 . 1 1 3 LEU HD11 H 15.779 3.506 15.394 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HD11 . . . . . . . . . rr_6wpd 1
. 3 . 442 . 1 1 3 LEU HD12 H 15.647 2.937 13.730 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HD12 . . . . . . . . . rr_6wpd 1
. 3 . 443 . 1 1 3 LEU HD13 H 14.323 2.664 14.863 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HD13 . . . . . . . . . rr_6wpd 1
. 3 . 444 . 1 1 3 LEU HD21 H 16.489 5.477 14.198 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HD21 . . . . . . . . . rr_6wpd 1
. 3 . 445 . 1 1 3 LEU HD22 H 15.263 6.659 13.764 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HD22 . . . . . . . . . rr_6wpd 1
. 3 . 446 . 1 1 3 LEU HD23 H 15.762 5.442 12.592 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HD23 . . . . . . . . . rr_6wpd 1
. 3 . 447 . 1 1 3 LEU HG H 14.008 5.133 15.030 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HG . . . . . . . . . rr_6wpd 1
. 3 . 448 . 1 1 3 LEU N N 11.735 5.930 14.080 . . . 1.0 . . . . . . . . . . . . A . 3 LEU N . . . . . . . . . rr_6wpd 1
. 3 . 449 . 1 1 3 LEU O O 12.035 5.945 10.570 . . . 1.0 . . . . . . . . . . . . A . 3 LEU O . . . . . . . . . rr_6wpd 1
. 3 . 450 . 1 1 4 ASP C C 9.061 5.991 10.240 . . . 1.0 . . . . . . . . . . . . A . 4 ASP C . . . . . . . . . rr_6wpd 1
. 3 . 451 . 1 1 4 ASP CA C 9.573 4.683 10.837 . . . 1.0 . . . . . . . . . . . . A . 4 ASP CA . . . . . . . . . rr_6wpd 1
. 3 . 452 . 1 1 4 ASP CB C 8.401 3.883 11.404 . . . 1.0 . . . . . . . . . . . . A . 4 ASP CB . . . . . . . . . rr_6wpd 1
. 3 . 453 . 1 1 4 ASP CG C 8.847 2.455 11.699 . . . 1.0 . . . . . . . . . . . . A . 4 ASP CG . . . . . . . . . rr_6wpd 1
. 3 . 454 . 1 1 4 ASP H H 10.332 4.647 12.818 . . . 1.0 . . . . . . . . . . . . A . 4 ASP H . . . . . . . . . rr_6wpd 1
. 3 . 455 . 1 1 4 ASP HA H 10.049 4.103 10.060 . . . 1.0 . . . . . . . . . . . . A . 4 ASP HA . . . . . . . . . rr_6wpd 1
. 3 . 456 . 1 1 4 ASP HB2 H 8.063 4.348 12.319 . . . 1.0 . . . . . . . . . . . . A . 4 ASP HB2 . . . . . . . . . rr_6wpd 1
. 3 . 457 . 1 1 4 ASP HB3 H 7.594 3.865 10.688 . . . 1.0 . . . . . . . . . . . . A . 4 ASP HB3 . . . . . . . . . rr_6wpd 1
. 3 . 458 . 1 1 4 ASP N N 10.536 4.933 11.903 . . . 1.0 . . . . . . . . . . . . A . 4 ASP N . . . . . . . . . rr_6wpd 1
. 3 . 459 . 1 1 4 ASP O O 8.930 6.121 9.021 . . . 1.0 . . . . . . . . . . . . A . 4 ASP O . . . . . . . . . rr_6wpd 1
. 3 . 460 . 1 1 4 ASP OD1 O 8.142 1.770 12.425 . . . 1.0 . . . . . . . . . . . . A . 4 ASP OD1 . . . . . . . . . rr_6wpd 1
. 3 . 461 . 1 1 4 ASP OD2 O 9.888 2.065 11.197 . . . 1.0 . . . . . . . . . . . . A . 4 ASP OD2 . . . . . . . . . rr_6wpd 1
. 3 . 462 . 1 1 5 ALA C C 9.306 9.001 9.851 . . . 1.0 . . . . . . . . . . . . A . 5 ALA C . . . . . . . . . rr_6wpd 1
. 3 . 463 . 1 1 5 ALA CA C 8.260 8.249 10.671 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CA . . . . . . . . . rr_6wpd 1
. 3 . 464 . 1 1 5 ALA CB C 7.882 9.085 11.897 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CB . . . . . . . . . rr_6wpd 1
. 3 . 465 . 1 1 5 ALA H H 8.896 6.778 12.063 . . . 1.0 . . . . . . . . . . . . A . 5 ALA H . . . . . . . . . rr_6wpd 1
. 3 . 466 . 1 1 5 ALA HA H 7.378 8.096 10.066 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HA . . . . . . . . . rr_6wpd 1
. 3 . 467 . 1 1 5 ALA HB1 H 8.736 9.159 12.552 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB1 . . . . . . . . . rr_6wpd 1
. 3 . 468 . 1 1 5 ALA HB2 H 7.065 8.609 12.423 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB2 . . . . . . . . . rr_6wpd 1
. 3 . 469 . 1 1 5 ALA HB3 H 7.581 10.073 11.583 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB3 . . . . . . . . . rr_6wpd 1
. 3 . 470 . 1 1 5 ALA N N 8.770 6.949 11.108 . . . 1.0 . . . . . . . . . . . . A . 5 ALA N . . . . . . . . . rr_6wpd 1
. 3 . 471 . 1 1 5 ALA O O 8.993 9.624 8.836 . . . 1.0 . . . . . . . . . . . . A . 5 ALA O . . . . . . . . . rr_6wpd 1
. 3 . 472 . 1 1 6 ILE C C 11.875 9.042 8.236 . . . 1.0 . . . . . . . . . . . . A . 6 ILE C . . . . . . . . . rr_6wpd 1
. 3 . 473 . 1 1 6 ILE CA C 11.657 9.609 9.637 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CA . . . . . . . . . rr_6wpd 1
. 3 . 474 . 1 1 6 ILE CB C 12.913 9.436 10.496 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CB . . . . . . . . . rr_6wpd 1
. 3 . 475 . 1 1 6 ILE CD1 C 13.817 9.876 12.785 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CD1 . . . . . . . . . rr_6wpd 1
. 3 . 476 . 1 1 6 ILE CG1 C 12.728 10.242 11.781 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CG1 . . . . . . . . . rr_6wpd 1
. 3 . 477 . 1 1 6 ILE CG2 C 14.164 9.933 9.759 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CG2 . . . . . . . . . rr_6wpd 1
. 3 . 478 . 1 1 6 ILE H H 10.722 8.420 11.124 . . . 1.0 . . . . . . . . . . . . A . 6 ILE H . . . . . . . . . rr_6wpd 1
. 3 . 479 . 1 1 6 ILE HA H 11.432 10.661 9.555 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HA . . . . . . . . . rr_6wpd 1
. 3 . 480 . 1 1 6 ILE HB H 13.033 8.394 10.744 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HB . . . . . . . . . rr_6wpd 1
. 3 . 481 . 1 1 6 ILE HD11 H 13.835 8.806 12.926 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HD11 . . . . . . . . . rr_6wpd 1
. 3 . 482 . 1 1 6 ILE HD12 H 13.611 10.359 13.730 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HD12 . . . . . . . . . rr_6wpd 1
. 3 . 483 . 1 1 6 ILE HD13 H 14.777 10.207 12.415 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HD13 . . . . . . . . . rr_6wpd 1
. 3 . 484 . 1 1 6 ILE HG12 H 12.790 11.296 11.552 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG12 . . . . . . . . . rr_6wpd 1
. 3 . 485 . 1 1 6 ILE HG13 H 11.761 10.022 12.206 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG13 . . . . . . . . . rr_6wpd 1
. 3 . 486 . 1 1 6 ILE HG21 H 14.023 10.958 9.456 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG21 . . . . . . . . . rr_6wpd 1
. 3 . 487 . 1 1 6 ILE HG22 H 14.346 9.319 8.889 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG22 . . . . . . . . . rr_6wpd 1
. 3 . 488 . 1 1 6 ILE HG23 H 15.016 9.870 10.422 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG23 . . . . . . . . . rr_6wpd 1
. 3 . 489 . 1 1 6 ILE N N 10.546 8.934 10.308 . . . 1.0 . . . . . . . . . . . . A . 6 ILE N . . . . . . . . . rr_6wpd 1
. 3 . 490 . 1 1 6 ILE O O 12.107 9.782 7.278 . . . 1.0 . . . . . . . . . . . . A . 6 ILE O . . . . . . . . . rr_6wpd 1
. 3 . 491 . 1 1 7 LYS C C 10.930 7.440 5.857 . . . 1.0 . . . . . . . . . . . . A . 7 LYS C . . . . . . . . . rr_6wpd 1
. 3 . 492 . 1 1 7 LYS CA C 12.002 7.042 6.863 . . . 1.0 . . . . . . . . . . . . A . 7 LYS CA . . . . . . . . . rr_6wpd 1
. 3 . 493 . 1 1 7 LYS CB C 11.942 5.539 7.110 . . . 1.0 . . . . . . . . . . . . A . 7 LYS CB . . . . . . . . . rr_6wpd 1
. 3 . 494 . 1 1 7 LYS CD C 14.352 4.836 7.068 . . . 1.0 . . . . . . . . . . . . A . 7 LYS CD . . . . . . . . . rr_6wpd 1
. 3 . 495 . 1 1 7 LYS CE C 15.500 4.324 7.936 . . . 1.0 . . . . . . . . . . . . A . 7 LYS CE . . . . . . . . . rr_6wpd 1
. 3 . 496 . 1 1 7 LYS CG C 13.140 5.093 7.957 . . . 1.0 . . . . . . . . . . . . A . 7 LYS CG . . . . . . . . . rr_6wpd 1
. 3 . 497 . 1 1 7 LYS H H 11.630 7.194 8.935 . . . 1.0 . . . . . . . . . . . . A . 7 LYS H . . . . . . . . . rr_6wpd 1
. 3 . 498 . 1 1 7 LYS HA H 12.966 7.294 6.470 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HA . . . . . . . . . rr_6wpd 1
. 3 . 499 . 1 1 7 LYS HB2 H 11.033 5.314 7.636 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HB2 . . . . . . . . . rr_6wpd 1
. 3 . 500 . 1 1 7 LYS HB3 H 11.951 5.017 6.168 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HB3 . . . . . . . . . rr_6wpd 1
. 3 . 501 . 1 1 7 LYS HD2 H 14.099 4.099 6.326 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HD2 . . . . . . . . . rr_6wpd 1
. 3 . 502 . 1 1 7 LYS HD3 H 14.652 5.749 6.581 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HD3 . . . . . . . . . rr_6wpd 1
. 3 . 503 . 1 1 7 LYS HE2 H 16.388 4.208 7.331 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HE2 . . . . . . . . . rr_6wpd 1
. 3 . 504 . 1 1 7 LYS HE3 H 15.691 5.032 8.727 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HE3 . . . . . . . . . rr_6wpd 1
. 3 . 505 . 1 1 7 LYS HG2 H 13.389 5.865 8.665 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HG2 . . . . . . . . . rr_6wpd 1
. 3 . 506 . 1 1 7 LYS HG3 H 12.891 4.187 8.492 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HG3 . . . . . . . . . rr_6wpd 1
. 3 . 507 . 1 1 7 LYS HZ1 H 14.406 2.552 7.922 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HZ1 . . . . . . . . . rr_6wpd 1
. 3 . 508 . 1 1 7 LYS HZ2 H 14.724 3.159 9.477 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HZ2 . . . . . . . . . rr_6wpd 1
. 3 . 509 . 1 1 7 LYS HZ3 H 15.957 2.398 8.590 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HZ3 . . . . . . . . . rr_6wpd 1
. 3 . 510 . 1 1 7 LYS N N 11.808 7.725 8.134 . . . 1.0 . . . . . . . . . . . . A . 7 LYS N . . . . . . . . . rr_6wpd 1
. 3 . 511 . 1 1 7 LYS NZ N 15.119 3.008 8.525 . . . 1.0 . . . . . . . . . . . . A . 7 LYS NZ . . . . . . . . . rr_6wpd 1
. 3 . 512 . 1 1 7 LYS O O 11.218 7.664 4.678 . . . 1.0 . . . . . . . . . . . . A . 7 LYS O . . . . . . . . . rr_6wpd 1
. 3 . 513 . 1 1 8 ALA C C 8.744 9.298 4.922 . . . 1.0 . . . . . . . . . . . . A . 8 ALA C . . . . . . . . . rr_6wpd 1
. 3 . 514 . 1 1 8 ALA CA C 8.573 7.881 5.468 . . . 1.0 . . . . . . . . . . . . A . 8 ALA CA . . . . . . . . . rr_6wpd 1
. 3 . 515 . 1 1 8 ALA CB C 7.274 7.803 6.273 . . . 1.0 . . . . . . . . . . . . A . 8 ALA CB . . . . . . . . . rr_6wpd 1
. 3 . 516 . 1 1 8 ALA H H 9.534 7.322 7.275 . . . 1.0 . . . . . . . . . . . . A . 8 ALA H . . . . . . . . . rr_6wpd 1
. 3 . 517 . 1 1 8 ALA HA H 8.519 7.185 4.644 . . . 1.0 . . . . . . . . . . . . A . 8 ALA HA . . . . . . . . . rr_6wpd 1
. 3 . 518 . 1 1 8 ALA HB1 H 7.248 6.876 6.830 . . . 1.0 . . . . . . . . . . . . A . 8 ALA HB1 . . . . . . . . . rr_6wpd 1
. 3 . 519 . 1 1 8 ALA HB2 H 6.428 7.845 5.603 . . . 1.0 . . . . . . . . . . . . A . 8 ALA HB2 . . . . . . . . . rr_6wpd 1
. 3 . 520 . 1 1 8 ALA HB3 H 7.233 8.636 6.957 . . . 1.0 . . . . . . . . . . . . A . 8 ALA HB3 . . . . . . . . . rr_6wpd 1
. 3 . 521 . 1 1 8 ALA N N 9.696 7.518 6.329 . . . 1.0 . . . . . . . . . . . . A . 8 ALA N . . . . . . . . . rr_6wpd 1
. 3 . 522 . 1 1 8 ALA O O 8.479 9.559 3.747 . . . 1.0 . . . . . . . . . . . . A . 8 ALA O . . . . . . . . . rr_6wpd 1
. 3 . 523 . 1 1 9 ILE C C 10.484 11.723 4.350 . . . 1.0 . . . . . . . . . . . . A . 9 ILE C . . . . . . . . . rr_6wpd 1
. 3 . 524 . 1 1 9 ILE CA C 9.394 11.597 5.410 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CA . . . . . . . . . rr_6wpd 1
. 3 . 525 . 1 1 9 ILE CB C 9.787 12.387 6.661 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CB . . . . . . . . . rr_6wpd 1
. 3 . 526 . 1 1 9 ILE CD1 C 9.034 12.933 8.979 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CD1 . . . . . . . . . rr_6wpd 1
. 3 . 527 . 1 1 9 ILE CG1 C 8.587 12.455 7.598 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CG1 . . . . . . . . . rr_6wpd 1
. 3 . 528 . 1 1 9 ILE CG2 C 10.231 13.808 6.288 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CG2 . . . . . . . . . rr_6wpd 1
. 3 . 529 . 1 1 9 ILE H H 9.373 9.919 6.708 . . . 1.0 . . . . . . . . . . . . A . 9 ILE H . . . . . . . . . rr_6wpd 1
. 3 . 530 . 1 1 9 ILE HA H 8.472 12.001 5.019 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HA . . . . . . . . . rr_6wpd 1
. 3 . 531 . 1 1 9 ILE HB H 10.593 11.883 7.158 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HB . . . . . . . . . rr_6wpd 1
. 3 . 532 . 1 1 9 ILE HD11 H 9.690 13.785 8.873 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HD11 . . . . . . . . . rr_6wpd 1
. 3 . 533 . 1 1 9 ILE HD12 H 9.559 12.135 9.483 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HD12 . . . . . . . . . rr_6wpd 1
. 3 . 534 . 1 1 9 ILE HD13 H 8.168 13.216 9.559 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HD13 . . . . . . . . . rr_6wpd 1
. 3 . 535 . 1 1 9 ILE HG12 H 7.869 13.146 7.196 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG12 . . . . . . . . . rr_6wpd 1
. 3 . 536 . 1 1 9 ILE HG13 H 8.139 11.478 7.686 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG13 . . . . . . . . . rr_6wpd 1
. 3 . 537 . 1 1 9 ILE HG21 H 9.546 14.222 5.565 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG21 . . . . . . . . . rr_6wpd 1
. 3 . 538 . 1 1 9 ILE HG22 H 11.226 13.777 5.868 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG22 . . . . . . . . . rr_6wpd 1
. 3 . 539 . 1 1 9 ILE HG23 H 10.236 14.428 7.174 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG23 . . . . . . . . . rr_6wpd 1
. 3 . 540 . 1 1 9 ILE N N 9.185 10.199 5.788 . . . 1.0 . . . . . . . . . . . . A . 9 ILE N . . . . . . . . . rr_6wpd 1
. 3 . 541 . 1 1 9 ILE O O 10.349 12.477 3.385 . . . 1.0 . . . . . . . . . . . . A . 9 ILE O . . . . . . . . . rr_6wpd 1
. 3 . 542 . 1 1 10 ALA C C 12.293 10.489 2.248 . . . 1.0 . . . . . . . . . . . . A . 10 ALA C . . . . . . . . . rr_6wpd 1
. 3 . 543 . 1 1 10 ALA CA C 12.696 11.011 3.622 . . . 1.0 . . . . . . . . . . . . A . 10 ALA CA . . . . . . . . . rr_6wpd 1
. 3 . 544 . 1 1 10 ALA CB C 13.830 10.144 4.176 . . . 1.0 . . . . . . . . . . . . A . 10 ALA CB . . . . . . . . . rr_6wpd 1
. 3 . 545 . 1 1 10 ALA H H 11.610 10.413 5.343 . . . 1.0 . . . . . . . . . . . . A . 10 ALA H . . . . . . . . . rr_6wpd 1
. 3 . 546 . 1 1 10 ALA HA H 13.046 12.024 3.526 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HA . . . . . . . . . rr_6wpd 1
. 3 . 547 . 1 1 10 ALA HB1 H 13.465 9.141 4.329 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB1 . . . . . . . . . rr_6wpd 1
. 3 . 548 . 1 1 10 ALA HB2 H 14.172 10.550 5.117 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB2 . . . . . . . . . rr_6wpd 1
. 3 . 549 . 1 1 10 ALA HB3 H 14.648 10.126 3.471 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB3 . . . . . . . . . rr_6wpd 1
. 3 . 550 . 1 1 10 ALA N N 11.566 10.984 4.550 . . . 1.0 . . . . . . . . . . . . A . 10 ALA N . . . . . . . . . rr_6wpd 1
. 3 . 551 . 1 1 10 ALA O O 12.699 11.027 1.217 . . . 1.0 . . . . . . . . . . . . A . 10 ALA O . . . . . . . . . rr_6wpd 1
. 3 . 552 . 1 1 11 LYS C C 10.237 9.816 0.184 . . . 1.0 . . . . . . . . . . . . A . 11 LYS C . . . . . . . . . rr_6wpd 1
. 3 . 553 . 1 1 11 LYS CA C 11.041 8.811 1.016 . . . 1.0 . . . . . . . . . . . . A . 11 LYS CA . . . . . . . . . rr_6wpd 1
. 3 . 554 . 1 1 11 LYS CB C 10.163 7.608 1.386 . . . 1.0 . . . . . . . . . . . . A . 11 LYS CB . . . . . . . . . rr_6wpd 1
. 3 . 555 . 1 1 11 LYS CD C 9.475 7.140 -0.980 . . . 1.0 . . . . . . . . . . . . A . 11 LYS CD . . . . . . . . . rr_6wpd 1
. 3 . 556 . 1 1 11 LYS CE C 9.097 5.998 -1.922 . . . 1.0 . . . . . . . . . . . . A . 11 LYS CE . . . . . . . . . rr_6wpd 1
. 3 . 557 . 1 1 11 LYS CG C 10.149 6.569 0.264 . . . 1.0 . . . . . . . . . . . . A . 11 LYS CG . . . . . . . . . rr_6wpd 1
. 3 . 558 . 1 1 11 LYS H H 11.226 9.054 3.110 . . . 1.0 . . . . . . . . . . . . A . 11 LYS H . . . . . . . . . rr_6wpd 1
. 3 . 559 . 1 1 11 LYS HA H 11.889 8.467 0.445 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HA . . . . . . . . . rr_6wpd 1
. 3 . 560 . 1 1 11 LYS HB2 H 10.552 7.150 2.284 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HB2 . . . . . . . . . rr_6wpd 1
. 3 . 561 . 1 1 11 LYS HB3 H 9.152 7.943 1.572 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HB3 . . . . . . . . . rr_6wpd 1
. 3 . 562 . 1 1 11 LYS HD2 H 8.589 7.693 -0.699 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HD2 . . . . . . . . . rr_6wpd 1
. 3 . 563 . 1 1 11 LYS HD3 H 10.162 7.788 -1.482 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HD3 . . . . . . . . . rr_6wpd 1
. 3 . 564 . 1 1 11 LYS HE2 H 8.446 5.308 -1.407 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HE2 . . . . . . . . . rr_6wpd 1
. 3 . 565 . 1 1 11 LYS HE3 H 8.588 6.397 -2.788 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HE3 . . . . . . . . . rr_6wpd 1
. 3 . 566 . 1 1 11 LYS HG2 H 11.161 6.284 0.023 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HG2 . . . . . . . . . rr_6wpd 1
. 3 . 567 . 1 1 11 LYS HG3 H 9.608 5.706 0.594 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HG3 . . . . . . . . . rr_6wpd 1
. 3 . 568 . 1 1 11 LYS HZ1 H 10.832 4.925 -1.516 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HZ1 . . . . . . . . . rr_6wpd 1
. 3 . 569 . 1 1 11 LYS HZ2 H 10.956 5.959 -2.857 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HZ2 . . . . . . . . . rr_6wpd 1
. 3 . 570 . 1 1 11 LYS HZ3 H 10.089 4.504 -2.981 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HZ3 . . . . . . . . . rr_6wpd 1
. 3 . 571 . 1 1 11 LYS N N 11.502 9.432 2.253 . . . 1.0 . . . . . . . . . . . . A . 11 LYS N . . . . . . . . . rr_6wpd 1
. 3 . 572 . 1 1 11 LYS NZ N 10.337 5.292 -2.352 . . . 1.0 . . . . . . . . . . . . A . 11 LYS NZ . . . . . . . . . rr_6wpd 1
. 3 . 573 . 1 1 11 LYS O O 10.446 9.964 -1.021 . . . 1.0 . . . . . . . . . . . . A . 11 LYS O . . . . . . . . . rr_6wpd 1
. 3 . 574 . 1 1 12 ALA C C 9.332 12.641 -0.400 . . . 1.0 . . . . . . . . . . . . A . 12 ALA C . . . . . . . . . rr_6wpd 1
. 3 . 575 . 1 1 12 ALA CA C 8.486 11.505 0.172 . . . 1.0 . . . . . . . . . . . . A . 12 ALA CA . . . . . . . . . rr_6wpd 1
. 3 . 576 . 1 1 12 ALA CB C 7.473 12.072 1.172 . . . 1.0 . . . . . . . . . . . . A . 12 ALA CB . . . . . . . . . rr_6wpd 1
. 3 . 577 . 1 1 12 ALA H H 9.211 10.359 1.806 . . . 1.0 . . . . . . . . . . . . A . 12 ALA H . . . . . . . . . rr_6wpd 1
. 3 . 578 . 1 1 12 ALA HA H 7.948 11.023 -0.632 . . . 1.0 . . . . . . . . . . . . A . 12 ALA HA . . . . . . . . . rr_6wpd 1
. 3 . 579 . 1 1 12 ALA HB1 H 7.964 12.236 2.119 . . . 1.0 . . . . . . . . . . . . A . 12 ALA HB1 . . . . . . . . . rr_6wpd 1
. 3 . 580 . 1 1 12 ALA HB2 H 6.662 11.371 1.304 . . . 1.0 . . . . . . . . . . . . A . 12 ALA HB2 . . . . . . . . . rr_6wpd 1
. 3 . 581 . 1 1 12 ALA HB3 H 7.079 13.010 0.803 . . . 1.0 . . . . . . . . . . . . A . 12 ALA HB3 . . . . . . . . . rr_6wpd 1
. 3 . 582 . 1 1 12 ALA N N 9.324 10.513 0.845 . . . 1.0 . . . . . . . . . . . . A . 12 ALA N . . . . . . . . . rr_6wpd 1
. 3 . 583 . 1 1 12 ALA O O 9.078 13.125 -1.505 . . . 1.0 . . . . . . . . . . . . A . 12 ALA O . . . . . . . . . rr_6wpd 1
. 3 . 584 . 1 1 13 ALA C C 11.986 13.785 -1.305 . . . 1.0 . . . . . . . . . . . . A . 13 ALA C . . . . . . . . . rr_6wpd 1
. 3 . 585 . 1 1 13 ALA CA C 11.204 14.154 -0.047 . . . 1.0 . . . . . . . . . . . . A . 13 ALA CA . . . . . . . . . rr_6wpd 1
. 3 . 586 . 1 1 13 ALA CB C 12.178 14.485 1.086 . . . 1.0 . . . . . . . . . . . . A . 13 ALA CB . . . . . . . . . rr_6wpd 1
. 3 . 587 . 1 1 13 ALA H H 10.465 12.641 1.239 . . . 1.0 . . . . . . . . . . . . A . 13 ALA H . . . . . . . . . rr_6wpd 1
. 3 . 588 . 1 1 13 ALA HA H 10.606 15.025 -0.255 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HA . . . . . . . . . rr_6wpd 1
. 3 . 589 . 1 1 13 ALA HB1 H 12.748 13.603 1.335 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB1 . . . . . . . . . rr_6wpd 1
. 3 . 590 . 1 1 13 ALA HB2 H 11.625 14.813 1.954 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB2 . . . . . . . . . rr_6wpd 1
. 3 . 591 . 1 1 13 ALA HB3 H 12.849 15.271 0.770 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB3 . . . . . . . . . rr_6wpd 1
. 3 . 592 . 1 1 13 ALA N N 10.325 13.063 0.369 . . . 1.0 . . . . . . . . . . . . A . 13 ALA N . . . . . . . . . rr_6wpd 1
. 3 . 593 . 1 1 13 ALA O O 12.207 14.623 -2.181 . . . 1.0 . . . . . . . . . . . . A . 13 ALA O . . . . . . . . . rr_6wpd 1
. 3 . 594 . 1 1 14 GLY C C 13.334 10.545 -2.495 . . . 1.0 . . . . . . . . . . . . A . 14 GLY C . . . . . . . . . rr_6wpd 1
. 3 . 595 . 1 1 14 GLY CA C 13.166 12.059 -2.538 . . . 1.0 . . . . . . . . . . . . A . 14 GLY CA . . . . . . . . . rr_6wpd 1
. 3 . 596 . 1 1 14 GLY H H 12.197 11.916 -0.654 . . . 1.0 . . . . . . . . . . . . A . 14 GLY H . . . . . . . . . rr_6wpd 1
. 3 . 597 . 1 1 14 GLY HA2 H 12.646 12.334 -3.448 . . . 1.0 . . . . . . . . . . . . A . 14 GLY HA2 . . . . . . . . . rr_6wpd 1
. 3 . 598 . 1 1 14 GLY HA3 H 14.143 12.522 -2.537 . . . 1.0 . . . . . . . . . . . . A . 14 GLY HA3 . . . . . . . . . rr_6wpd 1
. 3 . 599 . 1 1 14 GLY N N 12.404 12.532 -1.384 . . . 1.0 . . . . . . . . . . . . A . 14 GLY N . . . . . . . . . rr_6wpd 1
. 3 . 600 . 1 1 14 GLY O O 12.394 9.802 -2.788 . . . 1.0 . . . . . . . . . . . . A . 14 GLY O . . . . . . . . . rr_6wpd 1
. 3 . 601 . 1 1 15 NH2 HN1 H 15.228 10.622 -1.906 . . . 1.0 . . . . . . . . . . . . A . 15 NH2 HN1 . . . . . . . . . rr_6wpd 1
. 3 . 602 . 1 1 15 NH2 HN2 H 14.598 9.060 -2.111 . . . 1.0 . . . . . . . . . . . . A . 15 NH2 HN2 . . . . . . . . . rr_6wpd 1
. 3 . 603 . 1 1 15 NH2 N N 14.483 10.034 -2.142 . . . 1.0 . . . . . . . . . . . . A . 15 NH2 N . . . . . . . . . rr_6wpd 1
. 4 . 604 . 1 1 1 GLY C C 11.206 9.066 16.403 . . . 1.0 . . . . . . . . . . . . A . 1 GLY C . . . . . . . . . rr_6wpd 1
. 4 . 605 . 1 1 1 GLY CA C 11.009 10.544 16.729 . . . 1.0 . . . . . . . . . . . . A . 1 GLY CA . . . . . . . . . rr_6wpd 1
. 4 . 606 . 1 1 1 GLY H1 H 10.112 11.304 18.450 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H1 . . . . . . . . . rr_6wpd 1
. 4 . 607 . 1 1 1 GLY H2 H 9.530 9.779 17.980 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H2 . . . . . . . . . rr_6wpd 1
. 4 . 608 . 1 1 1 GLY H3 H 9.060 11.170 17.125 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H3 . . . . . . . . . rr_6wpd 1
. 4 . 609 . 1 1 1 GLY HA2 H 10.830 11.092 15.814 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA2 . . . . . . . . . rr_6wpd 1
. 4 . 610 . 1 1 1 GLY HA3 H 11.897 10.927 17.208 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA3 . . . . . . . . . rr_6wpd 1
. 4 . 611 . 1 1 1 GLY N N 9.840 10.711 17.640 . . . 1.0 . . . . . . . . . . . . A . 1 GLY N . . . . . . . . . rr_6wpd 1
. 4 . 612 . 1 1 1 GLY O O 12.280 8.507 16.624 . . . 1.0 . . . . . . . . . . . . A . 1 GLY O . . . . . . . . . rr_6wpd 1
. 4 . 613 . 1 1 2 ILE C C 10.879 6.900 14.138 . . . 1.0 . . . . . . . . . . . . A . 2 ILE C . . . . . . . . . rr_6wpd 1
. 4 . 614 . 1 1 2 ILE CA C 10.201 7.043 15.496 . . . 1.0 . . . . . . . . . . . . A . 2 ILE CA . . . . . . . . . rr_6wpd 1
. 4 . 615 . 1 1 2 ILE CB C 8.774 6.491 15.454 . . . 1.0 . . . . . . . . . . . . A . 2 ILE CB . . . . . . . . . rr_6wpd 1
. 4 . 616 . 1 1 2 ILE CD1 C 8.805 6.617 17.973 . . . 1.0 . . . . . . . . . . . . A . 2 ILE CD1 . . . . . . . . . rr_6wpd 1
. 4 . 617 . 1 1 2 ILE CG1 C 8.019 6.970 16.703 . . . 1.0 . . . . . . . . . . . . A . 2 ILE CG1 . . . . . . . . . rr_6wpd 1
. 4 . 618 . 1 1 2 ILE CG2 C 8.794 4.959 15.423 . . . 1.0 . . . . . . . . . . . . A . 2 ILE CG2 . . . . . . . . . rr_6wpd 1
. 4 . 619 . 1 1 2 ILE H H 9.336 8.945 15.707 . . . 1.0 . . . . . . . . . . . . A . 2 ILE H . . . . . . . . . rr_6wpd 1
. 4 . 620 . 1 1 2 ILE HA H 10.771 6.496 16.235 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HA . . . . . . . . . rr_6wpd 1
. 4 . 621 . 1 1 2 ILE HB H 8.273 6.859 14.571 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HB . . . . . . . . . rr_6wpd 1
. 4 . 622 . 1 1 2 ILE HD11 H 9.216 5.623 17.886 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HD11 . . . . . . . . . rr_6wpd 1
. 4 . 623 . 1 1 2 ILE HD12 H 8.143 6.659 18.827 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HD12 . . . . . . . . . rr_6wpd 1
. 4 . 624 . 1 1 2 ILE HD13 H 9.607 7.328 18.110 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HD13 . . . . . . . . . rr_6wpd 1
. 4 . 625 . 1 1 2 ILE HG12 H 7.891 8.041 16.651 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HG12 . . . . . . . . . rr_6wpd 1
. 4 . 626 . 1 1 2 ILE HG13 H 7.050 6.496 16.741 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HG13 . . . . . . . . . rr_6wpd 1
. 4 . 627 . 1 1 2 ILE HG21 H 9.419 4.622 14.610 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HG21 . . . . . . . . . rr_6wpd 1
. 4 . 628 . 1 1 2 ILE HG22 H 7.788 4.590 15.279 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HG22 . . . . . . . . . rr_6wpd 1
. 4 . 629 . 1 1 2 ILE HG23 H 9.184 4.582 16.358 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HG23 . . . . . . . . . rr_6wpd 1
. 4 . 630 . 1 1 2 ILE N N 10.158 8.444 15.868 . . . 1.0 . . . . . . . . . . . . A . 2 ILE N . . . . . . . . . rr_6wpd 1
. 4 . 631 . 1 1 2 ILE O O 10.633 7.689 13.223 . . . 1.0 . . . . . . . . . . . . A . 2 ILE O . . . . . . . . . rr_6wpd 1
. 4 . 632 . 1 1 3 LEU C C 11.524 5.474 11.622 . . . 1.0 . . . . . . . . . . . . A . 3 LEU C . . . . . . . . . rr_6wpd 1
. 4 . 633 . 1 1 3 LEU CA C 12.488 5.683 12.784 . . . 1.0 . . . . . . . . . . . . A . 3 LEU CA . . . . . . . . . rr_6wpd 1
. 4 . 634 . 1 1 3 LEU CB C 13.384 4.442 12.944 . . . 1.0 . . . . . . . . . . . . A . 3 LEU CB . . . . . . . . . rr_6wpd 1
. 4 . 635 . 1 1 3 LEU CD1 C 14.387 5.437 15.004 . . . 1.0 . . . . . . . . . . . . A . 3 LEU CD1 . . . . . . . . . rr_6wpd 1
. 4 . 636 . 1 1 3 LEU CD2 C 15.572 3.588 13.812 . . . 1.0 . . . . . . . . . . . . A . 3 LEU CD2 . . . . . . . . . rr_6wpd 1
. 4 . 637 . 1 1 3 LEU CG C 14.695 4.831 13.635 . . . 1.0 . . . . . . . . . . . . A . 3 LEU CG . . . . . . . . . rr_6wpd 1
. 4 . 638 . 1 1 3 LEU H H 11.920 5.330 14.795 . . . 1.0 . . . . . . . . . . . . A . 3 LEU H . . . . . . . . . rr_6wpd 1
. 4 . 639 . 1 1 3 LEU HA H 13.106 6.542 12.577 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HA . . . . . . . . . rr_6wpd 1
. 4 . 640 . 1 1 3 LEU HB2 H 12.869 3.705 13.544 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HB2 . . . . . . . . . rr_6wpd 1
. 4 . 641 . 1 1 3 LEU HB3 H 13.601 4.024 11.974 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HB3 . . . . . . . . . rr_6wpd 1
. 4 . 642 . 1 1 3 LEU HD11 H 14.003 6.438 14.875 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HD11 . . . . . . . . . rr_6wpd 1
. 4 . 643 . 1 1 3 LEU HD12 H 15.291 5.471 15.594 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HD12 . . . . . . . . . rr_6wpd 1
. 4 . 644 . 1 1 3 LEU HD13 H 13.649 4.832 15.510 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HD13 . . . . . . . . . rr_6wpd 1
. 4 . 645 . 1 1 3 LEU HD21 H 15.592 3.025 12.890 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HD21 . . . . . . . . . rr_6wpd 1
. 4 . 646 . 1 1 3 LEU HD22 H 15.169 2.971 14.601 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HD22 . . . . . . . . . rr_6wpd 1
. 4 . 647 . 1 1 3 LEU HD23 H 16.576 3.892 14.070 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HD23 . . . . . . . . . rr_6wpd 1
. 4 . 648 . 1 1 3 LEU HG H 15.217 5.558 13.028 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HG . . . . . . . . . rr_6wpd 1
. 4 . 649 . 1 1 3 LEU N N 11.752 5.911 14.024 . . . 1.0 . . . . . . . . . . . . A . 3 LEU N . . . . . . . . . rr_6wpd 1
. 4 . 650 . 1 1 3 LEU O O 11.844 5.781 10.473 . . . 1.0 . . . . . . . . . . . . A . 3 LEU O . . . . . . . . . rr_6wpd 1
. 4 . 651 . 1 1 4 ASP C C 8.878 5.951 10.238 . . . 1.0 . . . . . . . . . . . . A . 4 ASP C . . . . . . . . . rr_6wpd 1
. 4 . 652 . 1 1 4 ASP CA C 9.337 4.662 10.932 . . . 1.0 . . . . . . . . . . . . A . 4 ASP CA . . . . . . . . . rr_6wpd 1
. 4 . 653 . 1 1 4 ASP CB C 8.139 3.989 11.616 . . . 1.0 . . . . . . . . . . . . A . 4 ASP CB . . . . . . . . . rr_6wpd 1
. 4 . 654 . 1 1 4 ASP CG C 6.977 3.817 10.642 . . . 1.0 . . . . . . . . . . . . A . 4 ASP CG . . . . . . . . . rr_6wpd 1
. 4 . 655 . 1 1 4 ASP H H 10.185 4.716 12.879 . . . 1.0 . . . . . . . . . . . . A . 4 ASP H . . . . . . . . . rr_6wpd 1
. 4 . 656 . 1 1 4 ASP HA H 9.741 3.986 10.193 . . . 1.0 . . . . . . . . . . . . A . 4 ASP HA . . . . . . . . . rr_6wpd 1
. 4 . 657 . 1 1 4 ASP HB2 H 8.441 3.019 11.986 . . . 1.0 . . . . . . . . . . . . A . 4 ASP HB2 . . . . . . . . . rr_6wpd 1
. 4 . 658 . 1 1 4 ASP HB3 H 7.818 4.599 12.447 . . . 1.0 . . . . . . . . . . . . A . 4 ASP HB3 . . . . . . . . . rr_6wpd 1
. 4 . 659 . 1 1 4 ASP N N 10.360 4.939 11.941 . . . 1.0 . . . . . . . . . . . . A . 4 ASP N . . . . . . . . . rr_6wpd 1
. 4 . 660 . 1 1 4 ASP O O 8.825 6.029 9.004 . . . 1.0 . . . . . . . . . . . . A . 4 ASP O . . . . . . . . . rr_6wpd 1
. 4 . 661 . 1 1 4 ASP OD1 O 7.189 3.994 9.454 . . . 1.0 . . . . . . . . . . . . A . 4 ASP OD1 . . . . . . . . . rr_6wpd 1
. 4 . 662 . 1 1 4 ASP OD2 O 5.889 3.508 11.102 . . . 1.0 . . . . . . . . . . . . A . 4 ASP OD2 . . . . . . . . . rr_6wpd 1
. 4 . 663 . 1 1 5 ALA C C 9.134 8.985 9.768 . . . 1.0 . . . . . . . . . . . . A . 5 ALA C . . . . . . . . . rr_6wpd 1
. 4 . 664 . 1 1 5 ALA CA C 8.051 8.226 10.534 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CA . . . . . . . . . rr_6wpd 1
. 4 . 665 . 1 1 5 ALA CB C 7.560 9.083 11.703 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CB . . . . . . . . . rr_6wpd 1
. 4 . 666 . 1 1 5 ALA H H 8.587 6.808 12.014 . . . 1.0 . . . . . . . . . . . . A . 5 ALA H . . . . . . . . . rr_6wpd 1
. 4 . 667 . 1 1 5 ALA HA H 7.217 8.044 9.870 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HA . . . . . . . . . rr_6wpd 1
. 4 . 668 . 1 1 5 ALA HB1 H 8.378 9.254 12.387 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB1 . . . . . . . . . rr_6wpd 1
. 4 . 669 . 1 1 5 ALA HB2 H 6.761 8.568 12.217 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB2 . . . . . . . . . rr_6wpd 1
. 4 . 670 . 1 1 5 ALA HB3 H 7.198 10.029 11.330 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB3 . . . . . . . . . rr_6wpd 1
. 4 . 671 . 1 1 5 ALA N N 8.534 6.944 11.046 . . . 1.0 . . . . . . . . . . . . A . 5 ALA N . . . . . . . . . rr_6wpd 1
. 4 . 672 . 1 1 5 ALA O O 8.854 9.623 8.751 . . . 1.0 . . . . . . . . . . . . A . 5 ALA O . . . . . . . . . rr_6wpd 1
. 4 . 673 . 1 1 6 ILE C C 11.753 9.110 8.246 . . . 1.0 . . . . . . . . . . . . A . 6 ILE C . . . . . . . . . rr_6wpd 1
. 4 . 674 . 1 1 6 ILE CA C 11.478 9.641 9.649 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CA . . . . . . . . . rr_6wpd 1
. 4 . 675 . 1 1 6 ILE CB C 12.727 9.476 10.520 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CB . . . . . . . . . rr_6wpd 1
. 4 . 676 . 1 1 6 ILE CD1 C 13.609 9.837 12.829 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CD1 . . . . . . . . . rr_6wpd 1
. 4 . 677 . 1 1 6 ILE CG1 C 12.530 10.247 11.826 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CG1 . . . . . . . . . rr_6wpd 1
. 4 . 678 . 1 1 6 ILE CG2 C 13.965 10.018 9.794 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CG2 . . . . . . . . . rr_6wpd 1
. 4 . 679 . 1 1 6 ILE H H 10.513 8.423 11.097 . . . 1.0 . . . . . . . . . . . . A . 6 ILE H . . . . . . . . . rr_6wpd 1
. 4 . 680 . 1 1 6 ILE HA H 11.238 10.693 9.585 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HA . . . . . . . . . rr_6wpd 1
. 4 . 681 . 1 1 6 ILE HB H 12.873 8.429 10.741 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HB . . . . . . . . . rr_6wpd 1
. 4 . 682 . 1 1 6 ILE HD11 H 13.600 10.522 13.665 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HD11 . . . . . . . . . rr_6wpd 1
. 4 . 683 . 1 1 6 ILE HD12 H 14.577 9.865 12.350 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HD12 . . . . . . . . . rr_6wpd 1
. 4 . 684 . 1 1 6 ILE HD13 H 13.410 8.836 13.182 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HD13 . . . . . . . . . rr_6wpd 1
. 4 . 685 . 1 1 6 ILE HG12 H 12.604 11.307 11.630 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG12 . . . . . . . . . rr_6wpd 1
. 4 . 686 . 1 1 6 ILE HG13 H 11.557 10.021 12.234 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG13 . . . . . . . . . rr_6wpd 1
. 4 . 687 . 1 1 6 ILE HG21 H 14.782 10.108 10.494 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG21 . . . . . . . . . rr_6wpd 1
. 4 . 688 . 1 1 6 ILE HG22 H 13.742 10.988 9.374 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG22 . . . . . . . . . rr_6wpd 1
. 4 . 689 . 1 1 6 ILE HG23 H 14.243 9.338 9.002 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG23 . . . . . . . . . rr_6wpd 1
. 4 . 690 . 1 1 6 ILE N N 10.359 8.934 10.274 . . . 1.0 . . . . . . . . . . . . A . 6 ILE N . . . . . . . . . rr_6wpd 1
. 4 . 691 . 1 1 6 ILE O O 11.989 9.879 7.312 . . . 1.0 . . . . . . . . . . . . A . 6 ILE O . . . . . . . . . rr_6wpd 1
. 4 . 692 . 1 1 7 LYS C C 10.938 7.516 5.813 . . . 1.0 . . . . . . . . . . . . A . 7 LYS C . . . . . . . . . rr_6wpd 1
. 4 . 693 . 1 1 7 LYS CA C 11.999 7.149 6.840 . . . 1.0 . . . . . . . . . . . . A . 7 LYS CA . . . . . . . . . rr_6wpd 1
. 4 . 694 . 1 1 7 LYS CB C 12.018 5.639 7.058 . . . 1.0 . . . . . . . . . . . . A . 7 LYS CB . . . . . . . . . rr_6wpd 1
. 4 . 695 . 1 1 7 LYS CD C 14.474 5.118 7.049 . . . 1.0 . . . . . . . . . . . . A . 7 LYS CD . . . . . . . . . rr_6wpd 1
. 4 . 696 . 1 1 7 LYS CE C 15.675 4.707 7.895 . . . 1.0 . . . . . . . . . . . . A . 7 LYS CE . . . . . . . . . rr_6wpd 1
. 4 . 697 . 1 1 7 LYS CG C 13.227 5.242 7.924 . . . 1.0 . . . . . . . . . . . . A . 7 LYS CG . . . . . . . . . rr_6wpd 1
. 4 . 698 . 1 1 7 LYS H H 11.554 7.235 8.899 . . . 1.0 . . . . . . . . . . . . A . 7 LYS H . . . . . . . . . rr_6wpd 1
. 4 . 699 . 1 1 7 LYS HA H 12.956 7.463 6.478 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HA . . . . . . . . . rr_6wpd 1
. 4 . 700 . 1 1 7 LYS HB2 H 11.111 5.348 7.558 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HB2 . . . . . . . . . rr_6wpd 1
. 4 . 701 . 1 1 7 LYS HB3 H 12.077 5.140 6.106 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HB3 . . . . . . . . . rr_6wpd 1
. 4 . 702 . 1 1 7 LYS HD2 H 14.298 4.371 6.298 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HD2 . . . . . . . . . rr_6wpd 1
. 4 . 703 . 1 1 7 LYS HD3 H 14.685 6.060 6.575 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HD3 . . . . . . . . . rr_6wpd 1
. 4 . 704 . 1 1 7 LYS HE2 H 15.858 5.455 8.652 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HE2 . . . . . . . . . rr_6wpd 1
. 4 . 705 . 1 1 7 LYS HE3 H 15.479 3.755 8.367 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HE3 . . . . . . . . . rr_6wpd 1
. 4 . 706 . 1 1 7 LYS HG2 H 13.396 5.996 8.674 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HG2 . . . . . . . . . rr_6wpd 1
. 4 . 707 . 1 1 7 LYS HG3 H 13.031 4.295 8.405 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HG3 . . . . . . . . . rr_6wpd 1
. 4 . 708 . 1 1 7 LYS HZ1 H 17.078 5.517 6.590 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HZ1 . . . . . . . . . rr_6wpd 1
. 4 . 709 . 1 1 7 LYS HZ2 H 16.664 3.905 6.251 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HZ2 . . . . . . . . . rr_6wpd 1
. 4 . 710 . 1 1 7 LYS HZ3 H 17.684 4.266 7.561 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HZ3 . . . . . . . . . rr_6wpd 1
. 4 . 711 . 1 1 7 LYS N N 11.737 7.793 8.115 . . . 1.0 . . . . . . . . . . . . A . 7 LYS N . . . . . . . . . rr_6wpd 1
. 4 . 712 . 1 1 7 LYS NZ N 16.865 4.590 7.009 . . . 1.0 . . . . . . . . . . . . A . 7 LYS NZ . . . . . . . . . rr_6wpd 1
. 4 . 713 . 1 1 7 LYS O O 11.250 7.788 4.653 . . . 1.0 . . . . . . . . . . . . A . 7 LYS O . . . . . . . . . rr_6wpd 1
. 4 . 714 . 1 1 8 ALA C C 8.706 9.262 4.819 . . . 1.0 . . . . . . . . . . . . A . 8 ALA C . . . . . . . . . rr_6wpd 1
. 4 . 715 . 1 1 8 ALA CA C 8.577 7.838 5.362 . . . 1.0 . . . . . . . . . . . . A . 8 ALA CA . . . . . . . . . rr_6wpd 1
. 4 . 716 . 1 1 8 ALA CB C 7.265 7.700 6.135 . . . 1.0 . . . . . . . . . . . . A . 8 ALA CB . . . . . . . . . rr_6wpd 1
. 4 . 717 . 1 1 8 ALA H H 9.507 7.276 7.187 . . . 1.0 . . . . . . . . . . . . A . 8 ALA H . . . . . . . . . rr_6wpd 1
. 4 . 718 . 1 1 8 ALA HA H 8.569 7.143 4.536 . . . 1.0 . . . . . . . . . . . . A . 8 ALA HA . . . . . . . . . rr_6wpd 1
. 4 . 719 . 1 1 8 ALA HB1 H 6.454 8.092 5.542 . . . 1.0 . . . . . . . . . . . . A . 8 ALA HB1 . . . . . . . . . rr_6wpd 1
. 4 . 720 . 1 1 8 ALA HB2 H 7.337 8.254 7.060 . . . 1.0 . . . . . . . . . . . . A . 8 ALA HB2 . . . . . . . . . rr_6wpd 1
. 4 . 721 . 1 1 8 ALA HB3 H 7.082 6.658 6.353 . . . 1.0 . . . . . . . . . . . . A . 8 ALA HB3 . . . . . . . . . rr_6wpd 1
. 4 . 722 . 1 1 8 ALA N N 9.689 7.511 6.249 . . . 1.0 . . . . . . . . . . . . A . 8 ALA N . . . . . . . . . rr_6wpd 1
. 4 . 723 . 1 1 8 ALA O O 8.485 9.509 3.633 . . . 1.0 . . . . . . . . . . . . A . 8 ALA O . . . . . . . . . rr_6wpd 1
. 4 . 724 . 1 1 9 ILE C C 10.334 11.784 4.325 . . . 1.0 . . . . . . . . . . . . A . 9 ILE C . . . . . . . . . rr_6wpd 1
. 4 . 725 . 1 1 9 ILE CA C 9.203 11.595 5.334 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CA . . . . . . . . . rr_6wpd 1
. 4 . 726 . 1 1 9 ILE CB C 9.489 12.402 6.603 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CB . . . . . . . . . rr_6wpd 1
. 4 . 727 . 1 1 9 ILE CD1 C 8.591 12.885 8.883 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CD1 . . . . . . . . . rr_6wpd 1
. 4 . 728 . 1 1 9 ILE CG1 C 8.240 12.395 7.479 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CG1 . . . . . . . . . rr_6wpd 1
. 4 . 729 . 1 1 9 ILE CG2 C 9.863 13.846 6.254 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CG2 . . . . . . . . . rr_6wpd 1
. 4 . 730 . 1 1 9 ILE H H 9.206 9.923 6.635 . . . 1.0 . . . . . . . . . . . . A . 9 ILE H . . . . . . . . . rr_6wpd 1
. 4 . 731 . 1 1 9 ILE HA H 8.280 11.948 4.899 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HA . . . . . . . . . rr_6wpd 1
. 4 . 732 . 1 1 9 ILE HB H 10.299 11.944 7.141 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HB . . . . . . . . . rr_6wpd 1
. 4 . 733 . 1 1 9 ILE HD11 H 7.682 13.032 9.449 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HD11 . . . . . . . . . rr_6wpd 1
. 4 . 734 . 1 1 9 ILE HD12 H 9.128 13.820 8.815 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HD12 . . . . . . . . . rr_6wpd 1
. 4 . 735 . 1 1 9 ILE HD13 H 9.208 12.150 9.378 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HD13 . . . . . . . . . rr_6wpd 1
. 4 . 736 . 1 1 9 ILE HG12 H 7.502 13.046 7.046 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG12 . . . . . . . . . rr_6wpd 1
. 4 . 737 . 1 1 9 ILE HG13 H 7.845 11.391 7.541 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG13 . . . . . . . . . rr_6wpd 1
. 4 . 738 . 1 1 9 ILE HG21 H 9.163 14.237 5.530 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG21 . . . . . . . . . rr_6wpd 1
. 4 . 739 . 1 1 9 ILE HG22 H 10.861 13.870 5.841 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG22 . . . . . . . . . rr_6wpd 1
. 4 . 740 . 1 1 9 ILE HG23 H 9.830 14.451 7.149 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG23 . . . . . . . . . rr_6wpd 1
. 4 . 741 . 1 1 9 ILE N N 9.054 10.188 5.704 . . . 1.0 . . . . . . . . . . . . A . 9 ILE N . . . . . . . . . rr_6wpd 1
. 4 . 742 . 1 1 9 ILE O O 10.197 12.524 3.349 . . . 1.0 . . . . . . . . . . . . A . 9 ILE O . . . . . . . . . rr_6wpd 1
. 4 . 743 . 1 1 10 ALA C C 12.309 10.623 2.327 . . . 1.0 . . . . . . . . . . . . A . 10 ALA C . . . . . . . . . rr_6wpd 1
. 4 . 744 . 1 1 10 ALA CA C 12.615 11.205 3.702 . . . 1.0 . . . . . . . . . . . . A . 10 ALA CA . . . . . . . . . rr_6wpd 1
. 4 . 745 . 1 1 10 ALA CB C 13.785 10.442 4.328 . . . 1.0 . . . . . . . . . . . . A . 10 ALA CB . . . . . . . . . rr_6wpd 1
. 4 . 746 . 1 1 10 ALA H H 11.496 10.547 5.375 . . . 1.0 . . . . . . . . . . . . A . 10 ALA H . . . . . . . . . rr_6wpd 1
. 4 . 747 . 1 1 10 ALA HA H 12.893 12.240 3.593 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HA . . . . . . . . . rr_6wpd 1
. 4 . 748 . 1 1 10 ALA HB1 H 13.607 9.381 4.242 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB1 . . . . . . . . . rr_6wpd 1
. 4 . 749 . 1 1 10 ALA HB2 H 13.873 10.708 5.372 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB2 . . . . . . . . . rr_6wpd 1
. 4 . 750 . 1 1 10 ALA HB3 H 14.699 10.695 3.812 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB3 . . . . . . . . . rr_6wpd 1
. 4 . 751 . 1 1 10 ALA N N 11.450 11.112 4.577 . . . 1.0 . . . . . . . . . . . . A . 10 ALA N . . . . . . . . . rr_6wpd 1
. 4 . 752 . 1 1 10 ALA O O 12.743 11.151 1.301 . . . 1.0 . . . . . . . . . . . . A . 10 ALA O . . . . . . . . . rr_6wpd 1
. 4 . 753 . 1 1 11 LYS C C 10.401 9.736 0.184 . . . 1.0 . . . . . . . . . . . . A . 11 LYS C . . . . . . . . . rr_6wpd 1
. 4 . 754 . 1 1 11 LYS CA C 11.222 8.828 1.096 . . . 1.0 . . . . . . . . . . . . A . 11 LYS CA . . . . . . . . . rr_6wpd 1
. 4 . 755 . 1 1 11 LYS CB C 10.403 7.581 1.457 . . . 1.0 . . . . . . . . . . . . A . 11 LYS CB . . . . . . . . . rr_6wpd 1
. 4 . 756 . 1 1 11 LYS CD C 11.373 6.044 -0.279 . . . 1.0 . . . . . . . . . . . . A . 11 LYS CD . . . . . . . . . rr_6wpd 1
. 4 . 757 . 1 1 11 LYS CE C 11.020 4.901 -1.225 . . . 1.0 . . . . . . . . . . . . A . 11 LYS CE . . . . . . . . . rr_6wpd 1
. 4 . 758 . 1 1 11 LYS CG C 10.096 6.732 0.211 . . . 1.0 . . . . . . . . . . . . A . 11 LYS CG . . . . . . . . . rr_6wpd 1
. 4 . 759 . 1 1 11 LYS H H 11.289 9.149 3.185 . . . 1.0 . . . . . . . . . . . . A . 11 LYS H . . . . . . . . . rr_6wpd 1
. 4 . 760 . 1 1 11 LYS HA H 12.123 8.529 0.587 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HA . . . . . . . . . rr_6wpd 1
. 4 . 761 . 1 1 11 LYS HB2 H 10.955 6.988 2.170 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HB2 . . . . . . . . . rr_6wpd 1
. 4 . 762 . 1 1 11 LYS HB3 H 9.472 7.893 1.906 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HB3 . . . . . . . . . rr_6wpd 1
. 4 . 763 . 1 1 11 LYS HD2 H 11.988 6.756 -0.806 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HD2 . . . . . . . . . rr_6wpd 1
. 4 . 764 . 1 1 11 LYS HD3 H 11.914 5.651 0.561 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HD3 . . . . . . . . . rr_6wpd 1
. 4 . 765 . 1 1 11 LYS HE2 H 10.385 4.190 -0.716 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HE2 . . . . . . . . . rr_6wpd 1
. 4 . 766 . 1 1 11 LYS HE3 H 10.505 5.292 -2.089 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HE3 . . . . . . . . . rr_6wpd 1
. 4 . 767 . 1 1 11 LYS HG2 H 9.360 5.982 0.464 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HG2 . . . . . . . . . rr_6wpd 1
. 4 . 768 . 1 1 11 LYS HG3 H 9.712 7.360 -0.572 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HG3 . . . . . . . . . rr_6wpd 1
. 4 . 769 . 1 1 11 LYS HZ1 H 12.930 4.938 -2.046 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HZ1 . . . . . . . . . rr_6wpd 1
. 4 . 770 . 1 1 11 LYS HZ2 H 12.061 3.517 -2.380 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HZ2 . . . . . . . . . rr_6wpd 1
. 4 . 771 . 1 1 11 LYS HZ3 H 12.721 3.769 -0.836 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HZ3 . . . . . . . . . rr_6wpd 1
. 4 . 772 . 1 1 11 LYS N N 11.580 9.520 2.328 . . . 1.0 . . . . . . . . . . . . A . 11 LYS N . . . . . . . . . rr_6wpd 1
. 4 . 773 . 1 1 11 LYS NZ N 12.277 4.230 -1.655 . . . 1.0 . . . . . . . . . . . . A . 11 LYS NZ . . . . . . . . . rr_6wpd 1
. 4 . 774 . 1 1 11 LYS O O 10.632 9.798 -1.026 . . . 1.0 . . . . . . . . . . . . A . 11 LYS O . . . . . . . . . rr_6wpd 1
. 4 . 775 . 1 1 12 ALA C C 9.347 12.485 -0.560 . . . 1.0 . . . . . . . . . . . . A . 12 ALA C . . . . . . . . . rr_6wpd 1
. 4 . 776 . 1 1 12 ALA CA C 8.558 11.317 0.028 . . . 1.0 . . . . . . . . . . . . A . 12 ALA CA . . . . . . . . . rr_6wpd 1
. 4 . 777 . 1 1 12 ALA CB C 7.469 11.855 0.958 . . . 1.0 . . . . . . . . . . . . A . 12 ALA CB . . . . . . . . . rr_6wpd 1
. 4 . 778 . 1 1 12 ALA H H 9.296 10.317 1.741 . . . 1.0 . . . . . . . . . . . . A . 12 ALA H . . . . . . . . . rr_6wpd 1
. 4 . 779 . 1 1 12 ALA HA H 8.090 10.766 -0.775 . . . 1.0 . . . . . . . . . . . . A . 12 ALA HA . . . . . . . . . rr_6wpd 1
. 4 . 780 . 1 1 12 ALA HB1 H 7.929 12.381 1.780 . . . 1.0 . . . . . . . . . . . . A . 12 ALA HB1 . . . . . . . . . rr_6wpd 1
. 4 . 781 . 1 1 12 ALA HB2 H 6.883 11.031 1.342 . . . 1.0 . . . . . . . . . . . . A . 12 ALA HB2 . . . . . . . . . rr_6wpd 1
. 4 . 782 . 1 1 12 ALA HB3 H 6.826 12.529 0.413 . . . 1.0 . . . . . . . . . . . . A . 12 ALA HB3 . . . . . . . . . rr_6wpd 1
. 4 . 783 . 1 1 12 ALA N N 9.433 10.422 0.777 . . . 1.0 . . . . . . . . . . . . A . 12 ALA N . . . . . . . . . rr_6wpd 1
. 4 . 784 . 1 1 12 ALA O O 9.107 12.904 -1.693 . . . 1.0 . . . . . . . . . . . . A . 12 ALA O . . . . . . . . . rr_6wpd 1
. 4 . 785 . 1 1 13 ALA C C 11.986 13.771 -1.375 . . . 1.0 . . . . . . . . . . . . A . 13 ALA C . . . . . . . . . rr_6wpd 1
. 4 . 786 . 1 1 13 ALA CA C 11.095 14.140 -0.193 . . . 1.0 . . . . . . . . . . . . A . 13 ALA CA . . . . . . . . . rr_6wpd 1
. 4 . 787 . 1 1 13 ALA CB C 11.963 14.610 0.976 . . . 1.0 . . . . . . . . . . . . A . 13 ALA CB . . . . . . . . . rr_6wpd 1
. 4 . 788 . 1 1 13 ALA H H 10.405 12.633 1.126 . . . 1.0 . . . . . . . . . . . . A . 13 ALA H . . . . . . . . . rr_6wpd 1
. 4 . 789 . 1 1 13 ALA HA H 10.445 14.946 -0.487 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HA . . . . . . . . . rr_6wpd 1
. 4 . 790 . 1 1 13 ALA HB1 H 11.350 14.714 1.859 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB1 . . . . . . . . . rr_6wpd 1
. 4 . 791 . 1 1 13 ALA HB2 H 12.410 15.561 0.733 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB2 . . . . . . . . . rr_6wpd 1
. 4 . 792 . 1 1 13 ALA HB3 H 12.742 13.883 1.160 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB3 . . . . . . . . . rr_6wpd 1
. 4 . 793 . 1 1 13 ALA N N 10.275 13.009 0.231 . . . 1.0 . . . . . . . . . . . . A . 13 ALA N . . . . . . . . . rr_6wpd 1
. 4 . 794 . 1 1 13 ALA O O 12.204 14.583 -2.275 . . . 1.0 . . . . . . . . . . . . A . 13 ALA O . . . . . . . . . rr_6wpd 1
. 4 . 795 . 1 1 14 GLY C C 14.580 13.011 -2.588 . . . 1.0 . . . . . . . . . . . . A . 14 GLY C . . . . . . . . . rr_6wpd 1
. 4 . 796 . 1 1 14 GLY CA C 13.374 12.089 -2.436 . . . 1.0 . . . . . . . . . . . . A . 14 GLY CA . . . . . . . . . rr_6wpd 1
. 4 . 797 . 1 1 14 GLY H H 12.294 11.953 -0.617 . . . 1.0 . . . . . . . . . . . . A . 14 GLY H . . . . . . . . . rr_6wpd 1
. 4 . 798 . 1 1 14 GLY HA2 H 13.716 11.090 -2.212 . . . 1.0 . . . . . . . . . . . . A . 14 GLY HA2 . . . . . . . . . rr_6wpd 1
. 4 . 799 . 1 1 14 GLY HA3 H 12.821 12.077 -3.364 . . . 1.0 . . . . . . . . . . . . A . 14 GLY HA3 . . . . . . . . . rr_6wpd 1
. 4 . 800 . 1 1 14 GLY N N 12.501 12.550 -1.361 . . . 1.0 . . . . . . . . . . . . A . 14 GLY N . . . . . . . . . rr_6wpd 1
. 4 . 801 . 1 1 14 GLY O O 14.616 13.852 -3.488 . . . 1.0 . . . . . . . . . . . . A . 14 GLY O . . . . . . . . . rr_6wpd 1
. 4 . 802 . 1 1 15 NH2 HN1 H 15.545 12.240 -1.035 . . . 1.0 . . . . . . . . . . . . A . 15 NH2 HN1 . . . . . . . . . rr_6wpd 1
. 4 . 803 . 1 1 15 NH2 HN2 H 16.351 13.502 -1.835 . . . 1.0 . . . . . . . . . . . . A . 15 NH2 HN2 . . . . . . . . . rr_6wpd 1
. 4 . 804 . 1 1 15 NH2 N N 15.575 12.908 -1.751 . . . 1.0 . . . . . . . . . . . . A . 15 NH2 N . . . . . . . . . rr_6wpd 1
. 5 . 805 . 1 1 1 GLY C C 10.836 9.129 16.234 . . . 1.0 . . . . . . . . . . . . A . 1 GLY C . . . . . . . . . rr_6wpd 1
. 5 . 806 . 1 1 1 GLY CA C 10.526 10.601 16.475 . . . 1.0 . . . . . . . . . . . . A . 1 GLY CA . . . . . . . . . rr_6wpd 1
. 5 . 807 . 1 1 1 GLY H1 H 11.036 11.346 14.599 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H1 . . . . . . . . . rr_6wpd 1
. 5 . 808 . 1 1 1 GLY H2 H 12.360 11.127 15.641 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H2 . . . . . . . . . rr_6wpd 1
. 5 . 809 . 1 1 1 GLY H3 H 11.303 12.437 15.870 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H3 . . . . . . . . . rr_6wpd 1
. 5 . 810 . 1 1 1 GLY HA2 H 10.737 10.853 17.505 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA2 . . . . . . . . . rr_6wpd 1
. 5 . 811 . 1 1 1 GLY HA3 H 9.484 10.784 16.265 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA3 . . . . . . . . . rr_6wpd 1
. 5 . 812 . 1 1 1 GLY N N 11.369 11.441 15.579 . . . 1.0 . . . . . . . . . . . . A . 1 GLY N . . . . . . . . . rr_6wpd 1
. 5 . 813 . 1 1 1 GLY O O 11.933 8.656 16.535 . . . 1.0 . . . . . . . . . . . . A . 1 GLY O . . . . . . . . . rr_6wpd 1
. 5 . 814 . 1 1 2 ILE C C 10.782 6.834 14.093 . . . 1.0 . . . . . . . . . . . . A . 2 ILE C . . . . . . . . . rr_6wpd 1
. 5 . 815 . 1 1 2 ILE CA C 10.024 7.002 15.405 . . . 1.0 . . . . . . . . . . . . A . 2 ILE CA . . . . . . . . . rr_6wpd 1
. 5 . 816 . 1 1 2 ILE CB C 8.641 6.344 15.326 . . . 1.0 . . . . . . . . . . . . A . 2 ILE CB . . . . . . . . . rr_6wpd 1
. 5 . 817 . 1 1 2 ILE CD1 C 6.449 6.150 16.521 . . . 1.0 . . . . . . . . . . . . A . 2 ILE CD1 . . . . . . . . . rr_6wpd 1
. 5 . 818 . 1 1 2 ILE CG1 C 7.918 6.553 16.661 . . . 1.0 . . . . . . . . . . . . A . 2 ILE CG1 . . . . . . . . . rr_6wpd 1
. 5 . 819 . 1 1 2 ILE CG2 C 8.791 4.839 15.060 . . . 1.0 . . . . . . . . . . . . A . 2 ILE CG2 . . . . . . . . . rr_6wpd 1
. 5 . 820 . 1 1 2 ILE H H 9.010 8.838 15.466 . . . 1.0 . . . . . . . . . . . . A . 2 ILE H . . . . . . . . . rr_6wpd 1
. 5 . 821 . 1 1 2 ILE HA H 10.588 6.544 16.206 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HA . . . . . . . . . rr_6wpd 1
. 5 . 822 . 1 1 2 ILE HB H 8.069 6.796 14.530 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HB . . . . . . . . . rr_6wpd 1
. 5 . 823 . 1 1 2 ILE HD11 H 5.963 6.804 15.811 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HD11 . . . . . . . . . rr_6wpd 1
. 5 . 824 . 1 1 2 ILE HD12 H 5.960 6.232 17.480 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HD12 . . . . . . . . . rr_6wpd 1
. 5 . 825 . 1 1 2 ILE HD13 H 6.389 5.130 16.171 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HD13 . . . . . . . . . rr_6wpd 1
. 5 . 826 . 1 1 2 ILE HG12 H 8.387 5.949 17.424 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HG12 . . . . . . . . . rr_6wpd 1
. 5 . 827 . 1 1 2 ILE HG13 H 7.976 7.595 16.944 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HG13 . . . . . . . . . rr_6wpd 1
. 5 . 828 . 1 1 2 ILE HG21 H 9.605 4.446 15.652 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HG21 . . . . . . . . . rr_6wpd 1
. 5 . 829 . 1 1 2 ILE HG22 H 8.996 4.678 14.015 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HG22 . . . . . . . . . rr_6wpd 1
. 5 . 830 . 1 1 2 ILE HG23 H 7.876 4.331 15.327 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HG23 . . . . . . . . . rr_6wpd 1
. 5 . 831 . 1 1 2 ILE N N 9.859 8.411 15.688 . . . 1.0 . . . . . . . . . . . . A . 2 ILE N . . . . . . . . . rr_6wpd 1
. 5 . 832 . 1 1 2 ILE O O 10.506 7.532 13.118 . . . 1.0 . . . . . . . . . . . . A . 2 ILE O . . . . . . . . . rr_6wpd 1
. 5 . 833 . 1 1 3 LEU C C 11.644 5.499 11.672 . . . 1.0 . . . . . . . . . . . . A . 3 LEU C . . . . . . . . . rr_6wpd 1
. 5 . 834 . 1 1 3 LEU CA C 12.537 5.663 12.894 . . . 1.0 . . . . . . . . . . . . A . 3 LEU CA . . . . . . . . . rr_6wpd 1
. 5 . 835 . 1 1 3 LEU CB C 13.351 4.389 13.103 . . . 1.0 . . . . . . . . . . . . A . 3 LEU CB . . . . . . . . . rr_6wpd 1
. 5 . 836 . 1 1 3 LEU CD1 C 15.010 3.280 14.621 . . . 1.0 . . . . . . . . . . . . A . 3 LEU CD1 . . . . . . . . . rr_6wpd 1
. 5 . 837 . 1 1 3 LEU CD2 C 15.587 5.483 13.568 . . . 1.0 . . . . . . . . . . . . A . 3 LEU CD2 . . . . . . . . . rr_6wpd 1
. 5 . 838 . 1 1 3 LEU CG C 14.447 4.629 14.157 . . . 1.0 . . . . . . . . . . . . A . 3 LEU CG . . . . . . . . . rr_6wpd 1
. 5 . 839 . 1 1 3 LEU H H 11.913 5.397 14.896 . . . 1.0 . . . . . . . . . . . . A . 3 LEU H . . . . . . . . . rr_6wpd 1
. 5 . 840 . 1 1 3 LEU HA H 13.207 6.491 12.734 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HA . . . . . . . . . rr_6wpd 1
. 5 . 841 . 1 1 3 LEU HB2 H 12.694 3.601 13.444 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HB2 . . . . . . . . . rr_6wpd 1
. 5 . 842 . 1 1 3 LEU HB3 H 13.794 4.096 12.171 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HB3 . . . . . . . . . rr_6wpd 1
. 5 . 843 . 1 1 3 LEU HD11 H 15.858 3.449 15.268 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HD11 . . . . . . . . . rr_6wpd 1
. 5 . 844 . 1 1 3 LEU HD12 H 15.321 2.706 13.761 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HD12 . . . . . . . . . rr_6wpd 1
. 5 . 845 . 1 1 3 LEU HD13 H 14.248 2.737 15.160 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HD13 . . . . . . . . . rr_6wpd 1
. 5 . 846 . 1 1 3 LEU HD21 H 16.494 5.316 14.130 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HD21 . . . . . . . . . rr_6wpd 1
. 5 . 847 . 1 1 3 LEU HD22 H 15.324 6.528 13.629 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HD22 . . . . . . . . . rr_6wpd 1
. 5 . 848 . 1 1 3 LEU HD23 H 15.753 5.216 12.534 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HD23 . . . . . . . . . rr_6wpd 1
. 5 . 849 . 1 1 3 LEU HG H 14.016 5.145 15.005 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HG . . . . . . . . . rr_6wpd 1
. 5 . 850 . 1 1 3 LEU N N 11.736 5.914 14.083 . . . 1.0 . . . . . . . . . . . . A . 3 LEU N . . . . . . . . . rr_6wpd 1
. 5 . 851 . 1 1 3 LEU O O 12.004 5.894 10.563 . . . 1.0 . . . . . . . . . . . . A . 3 LEU O . . . . . . . . . rr_6wpd 1
. 5 . 852 . 1 1 4 ASP C C 9.045 6.006 10.213 . . . 1.0 . . . . . . . . . . . . A . 4 ASP C . . . . . . . . . rr_6wpd 1
. 5 . 853 . 1 1 4 ASP CA C 9.523 4.684 10.816 . . . 1.0 . . . . . . . . . . . . A . 4 ASP CA . . . . . . . . . rr_6wpd 1
. 5 . 854 . 1 1 4 ASP CB C 8.323 3.920 11.372 . . . 1.0 . . . . . . . . . . . . A . 4 ASP CB . . . . . . . . . rr_6wpd 1
. 5 . 855 . 1 1 4 ASP CG C 7.447 3.405 10.237 . . . 1.0 . . . . . . . . . . . . A . 4 ASP CG . . . . . . . . . rr_6wpd 1
. 5 . 856 . 1 1 4 ASP H H 10.266 4.629 12.801 . . . 1.0 . . . . . . . . . . . . A . 4 ASP H . . . . . . . . . rr_6wpd 1
. 5 . 857 . 1 1 4 ASP HA H 9.990 4.091 10.044 . . . 1.0 . . . . . . . . . . . . A . 4 ASP HA . . . . . . . . . rr_6wpd 1
. 5 . 858 . 1 1 4 ASP HB2 H 8.674 3.086 11.960 . . . 1.0 . . . . . . . . . . . . A . 4 ASP HB2 . . . . . . . . . rr_6wpd 1
. 5 . 859 . 1 1 4 ASP HB3 H 7.741 4.580 11.997 . . . 1.0 . . . . . . . . . . . . A . 4 ASP HB3 . . . . . . . . . rr_6wpd 1
. 5 . 860 . 1 1 4 ASP N N 10.484 4.914 11.892 . . . 1.0 . . . . . . . . . . . . A . 4 ASP N . . . . . . . . . rr_6wpd 1
. 5 . 861 . 1 1 4 ASP O O 8.923 6.137 8.995 . . . 1.0 . . . . . . . . . . . . A . 4 ASP O . . . . . . . . . rr_6wpd 1
. 5 . 862 . 1 1 4 ASP OD1 O 7.916 2.566 9.482 . . . 1.0 . . . . . . . . . . . . A . 4 ASP OD1 . . . . . . . . . rr_6wpd 1
. 5 . 863 . 1 1 4 ASP OD2 O 6.318 3.853 10.140 . . . 1.0 . . . . . . . . . . . . A . 4 ASP OD2 . . . . . . . . . rr_6wpd 1
. 5 . 864 . 1 1 5 ALA C C 9.371 9.028 9.845 . . . 1.0 . . . . . . . . . . . . A . 5 ALA C . . . . . . . . . rr_6wpd 1
. 5 . 865 . 1 1 5 ALA CA C 8.298 8.286 10.640 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CA . . . . . . . . . rr_6wpd 1
. 5 . 866 . 1 1 5 ALA CB C 7.910 9.123 11.858 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CB . . . . . . . . . rr_6wpd 1
. 5 . 867 . 1 1 5 ALA H H 8.886 6.808 12.038 . . . 1.0 . . . . . . . . . . . . A . 5 ALA H . . . . . . . . . rr_6wpd 1
. 5 . 868 . 1 1 5 ALA HA H 7.425 8.155 10.018 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HA . . . . . . . . . rr_6wpd 1
. 5 . 869 . 1 1 5 ALA HB1 H 7.295 8.530 12.517 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB1 . . . . . . . . . rr_6wpd 1
. 5 . 870 . 1 1 5 ALA HB2 H 7.361 9.993 11.535 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB2 . . . . . . . . . rr_6wpd 1
. 5 . 871 . 1 1 5 ALA HB3 H 8.804 9.434 12.382 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB3 . . . . . . . . . rr_6wpd 1
. 5 . 872 . 1 1 5 ALA N N 8.772 6.977 11.080 . . . 1.0 . . . . . . . . . . . . A . 5 ALA N . . . . . . . . . rr_6wpd 1
. 5 . 873 . 1 1 5 ALA O O 9.078 9.674 8.838 . . . 1.0 . . . . . . . . . . . . A . 5 ALA O . . . . . . . . . rr_6wpd 1
. 5 . 874 . 1 1 6 ILE C C 11.946 9.046 8.253 . . . 1.0 . . . . . . . . . . . . A . 6 ILE C . . . . . . . . . rr_6wpd 1
. 5 . 875 . 1 1 6 ILE CA C 11.733 9.591 9.662 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CA . . . . . . . . . rr_6wpd 1
. 5 . 876 . 1 1 6 ILE CB C 12.987 9.370 10.512 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CB . . . . . . . . . rr_6wpd 1
. 5 . 877 . 1 1 6 ILE CD1 C 13.896 9.682 12.825 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CD1 . . . . . . . . . rr_6wpd 1
. 5 . 878 . 1 1 6 ILE CG1 C 12.832 10.141 11.825 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CG1 . . . . . . . . . rr_6wpd 1
. 5 . 879 . 1 1 6 ILE CG2 C 14.231 9.863 9.769 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CG2 . . . . . . . . . rr_6wpd 1
. 5 . 880 . 1 1 6 ILE H H 10.771 8.399 11.120 . . . 1.0 . . . . . . . . . . . . A . 6 ILE H . . . . . . . . . rr_6wpd 1
. 5 . 881 . 1 1 6 ILE HA H 11.535 10.650 9.604 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HA . . . . . . . . . rr_6wpd 1
. 5 . 882 . 1 1 6 ILE HB H 13.092 8.315 10.726 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HB . . . . . . . . . rr_6wpd 1
. 5 . 883 . 1 1 6 ILE HD11 H 13.607 8.731 13.245 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HD11 . . . . . . . . . rr_6wpd 1
. 5 . 884 . 1 1 6 ILE HD12 H 13.984 10.412 13.617 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HD12 . . . . . . . . . rr_6wpd 1
. 5 . 885 . 1 1 6 ILE HD13 H 14.846 9.582 12.322 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HD13 . . . . . . . . . rr_6wpd 1
. 5 . 886 . 1 1 6 ILE HG12 H 12.949 11.199 11.637 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG12 . . . . . . . . . rr_6wpd 1
. 5 . 887 . 1 1 6 ILE HG13 H 11.852 9.958 12.239 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG13 . . . . . . . . . rr_6wpd 1
. 5 . 888 . 1 1 6 ILE HG21 H 15.070 9.876 10.447 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG21 . . . . . . . . . rr_6wpd 1
. 5 . 889 . 1 1 6 ILE HG22 H 14.056 10.860 9.391 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG22 . . . . . . . . . rr_6wpd 1
. 5 . 890 . 1 1 6 ILE HG23 H 14.447 9.198 8.945 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG23 . . . . . . . . . rr_6wpd 1
. 5 . 891 . 1 1 6 ILE N N 10.608 8.929 10.312 . . . 1.0 . . . . . . . . . . . . A . 6 ILE N . . . . . . . . . rr_6wpd 1
. 5 . 892 . 1 1 6 ILE O O 12.190 9.798 7.309 . . . 1.0 . . . . . . . . . . . . A . 6 ILE O . . . . . . . . . rr_6wpd 1
. 5 . 893 . 1 1 7 LYS C C 10.963 7.478 5.853 . . . 1.0 . . . . . . . . . . . . A . 7 LYS C . . . . . . . . . rr_6wpd 1
. 5 . 894 . 1 1 7 LYS CA C 12.038 7.065 6.853 . . . 1.0 . . . . . . . . . . . . A . 7 LYS CA . . . . . . . . . rr_6wpd 1
. 5 . 895 . 1 1 7 LYS CB C 11.972 5.561 7.085 . . . 1.0 . . . . . . . . . . . . A . 7 LYS CB . . . . . . . . . rr_6wpd 1
. 5 . 896 . 1 1 7 LYS CD C 14.394 4.875 7.060 . . . 1.0 . . . . . . . . . . . . A . 7 LYS CD . . . . . . . . . rr_6wpd 1
. 5 . 897 . 1 1 7 LYS CE C 15.565 4.404 7.915 . . . 1.0 . . . . . . . . . . . . A . 7 LYS CE . . . . . . . . . rr_6wpd 1
. 5 . 898 . 1 1 7 LYS CG C 13.166 5.095 7.941 . . . 1.0 . . . . . . . . . . . . A . 7 LYS CG . . . . . . . . . rr_6wpd 1
. 5 . 899 . 1 1 7 LYS H H 11.661 7.185 8.918 . . . 1.0 . . . . . . . . . . . . A . 7 LYS H . . . . . . . . . rr_6wpd 1
. 5 . 900 . 1 1 7 LYS HA H 12.999 7.318 6.460 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HA . . . . . . . . . rr_6wpd 1
. 5 . 901 . 1 1 7 LYS HB2 H 11.055 5.329 7.599 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HB2 . . . . . . . . . rr_6wpd 1
. 5 . 902 . 1 1 7 LYS HB3 H 11.987 5.054 6.137 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HB3 . . . . . . . . . rr_6wpd 1
. 5 . 903 . 1 1 7 LYS HD2 H 14.165 4.127 6.325 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HD2 . . . . . . . . . rr_6wpd 1
. 5 . 904 . 1 1 7 LYS HD3 H 14.663 5.793 6.567 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HD3 . . . . . . . . . rr_6wpd 1
. 5 . 905 . 1 1 7 LYS HE2 H 15.799 5.155 8.656 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HE2 . . . . . . . . . rr_6wpd 1
. 5 . 906 . 1 1 7 LYS HE3 H 15.305 3.478 8.408 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HE3 . . . . . . . . . rr_6wpd 1
. 5 . 907 . 1 1 7 LYS HG2 H 13.397 5.843 8.680 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HG2 . . . . . . . . . rr_6wpd 1
. 5 . 908 . 1 1 7 LYS HG3 H 12.913 4.171 8.436 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HG3 . . . . . . . . . rr_6wpd 1
. 5 . 909 . 1 1 7 LYS HZ1 H 16.820 4.969 6.356 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HZ1 . . . . . . . . . rr_6wpd 1
. 5 . 910 . 1 1 7 LYS HZ2 H 16.635 3.288 6.522 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HZ2 . . . . . . . . . rr_6wpd 1
. 5 . 911 . 1 1 7 LYS HZ3 H 17.608 4.150 7.615 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HZ3 . . . . . . . . . rr_6wpd 1
. 5 . 912 . 1 1 7 LYS N N 11.855 7.730 8.129 . . . 1.0 . . . . . . . . . . . . A . 7 LYS N . . . . . . . . . rr_6wpd 1
. 5 . 913 . 1 1 7 LYS NZ N 16.747 4.186 7.037 . . . 1.0 . . . . . . . . . . . . A . 7 LYS NZ . . . . . . . . . rr_6wpd 1
. 5 . 914 . 1 1 7 LYS O O 11.252 7.718 4.680 . . . 1.0 . . . . . . . . . . . . A . 7 LYS O . . . . . . . . . rr_6wpd 1
. 5 . 915 . 1 1 8 ALA C C 8.775 9.345 4.929 . . . 1.0 . . . . . . . . . . . . A . 8 ALA C . . . . . . . . . rr_6wpd 1
. 5 . 916 . 1 1 8 ALA CA C 8.606 7.926 5.468 . . . 1.0 . . . . . . . . . . . . A . 8 ALA CA . . . . . . . . . rr_6wpd 1
. 5 . 917 . 1 1 8 ALA CB C 7.308 7.841 6.270 . . . 1.0 . . . . . . . . . . . . A . 8 ALA CB . . . . . . . . . rr_6wpd 1
. 5 . 918 . 1 1 8 ALA H H 9.555 7.342 7.266 . . . 1.0 . . . . . . . . . . . . A . 8 ALA H . . . . . . . . . rr_6wpd 1
. 5 . 919 . 1 1 8 ALA HA H 8.547 7.235 4.640 . . . 1.0 . . . . . . . . . . . . A . 8 ALA HA . . . . . . . . . rr_6wpd 1
. 5 . 920 . 1 1 8 ALA HB1 H 6.473 8.062 5.626 . . . 1.0 . . . . . . . . . . . . A . 8 ALA HB1 . . . . . . . . . rr_6wpd 1
. 5 . 921 . 1 1 8 ALA HB2 H 7.340 8.556 7.081 . . . 1.0 . . . . . . . . . . . . A . 8 ALA HB2 . . . . . . . . . rr_6wpd 1
. 5 . 922 . 1 1 8 ALA HB3 H 7.202 6.846 6.672 . . . 1.0 . . . . . . . . . . . . A . 8 ALA HB3 . . . . . . . . . rr_6wpd 1
. 5 . 923 . 1 1 8 ALA N N 9.723 7.551 6.324 . . . 1.0 . . . . . . . . . . . . A . 8 ALA N . . . . . . . . . rr_6wpd 1
. 5 . 924 . 1 1 8 ALA O O 8.504 9.612 3.758 . . . 1.0 . . . . . . . . . . . . A . 8 ALA O . . . . . . . . . rr_6wpd 1
. 5 . 925 . 1 1 9 ILE C C 10.511 11.768 4.355 . . . 1.0 . . . . . . . . . . . . A . 9 ILE C . . . . . . . . . rr_6wpd 1
. 5 . 926 . 1 1 9 ILE CA C 9.426 11.641 5.425 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CA . . . . . . . . . rr_6wpd 1
. 5 . 927 . 1 1 9 ILE CB C 9.828 12.427 6.675 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CB . . . . . . . . . rr_6wpd 1
. 5 . 928 . 1 1 9 ILE CD1 C 9.101 12.942 9.009 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CD1 . . . . . . . . . rr_6wpd 1
. 5 . 929 . 1 1 9 ILE CG1 C 8.632 12.493 7.623 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CG1 . . . . . . . . . rr_6wpd 1
. 5 . 930 . 1 1 9 ILE CG2 C 10.263 13.847 6.300 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CG2 . . . . . . . . . rr_6wpd 1
. 5 . 931 . 1 1 9 ILE H H 9.418 9.968 6.717 . . . 1.0 . . . . . . . . . . . . A . 9 ILE H . . . . . . . . . rr_6wpd 1
. 5 . 932 . 1 1 9 ILE HA H 8.502 12.042 5.041 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HA . . . . . . . . . rr_6wpd 1
. 5 . 933 . 1 1 9 ILE HB H 10.642 11.924 7.167 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HB . . . . . . . . . rr_6wpd 1
. 5 . 934 . 1 1 9 ILE HD11 H 9.705 13.832 8.914 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HD11 . . . . . . . . . rr_6wpd 1
. 5 . 935 . 1 1 9 ILE HD12 H 9.687 12.157 9.463 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HD12 . . . . . . . . . rr_6wpd 1
. 5 . 936 . 1 1 9 ILE HD13 H 8.242 13.154 9.629 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HD13 . . . . . . . . . rr_6wpd 1
. 5 . 937 . 1 1 9 ILE HG12 H 7.916 13.199 7.242 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG12 . . . . . . . . . rr_6wpd 1
. 5 . 938 . 1 1 9 ILE HG13 H 8.173 11.519 7.700 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG13 . . . . . . . . . rr_6wpd 1
. 5 . 939 . 1 1 9 ILE HG21 H 11.215 13.810 5.792 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG21 . . . . . . . . . rr_6wpd 1
. 5 . 940 . 1 1 9 ILE HG22 H 10.359 14.439 7.198 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG22 . . . . . . . . . rr_6wpd 1
. 5 . 941 . 1 1 9 ILE HG23 H 9.524 14.294 5.651 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG23 . . . . . . . . . rr_6wpd 1
. 5 . 942 . 1 1 9 ILE N N 9.223 10.245 5.798 . . . 1.0 . . . . . . . . . . . . A . 9 ILE N . . . . . . . . . rr_6wpd 1
. 5 . 943 . 1 1 9 ILE O O 10.361 12.515 3.388 . . . 1.0 . . . . . . . . . . . . A . 9 ILE O . . . . . . . . . rr_6wpd 1
. 5 . 944 . 1 1 10 ALA C C 12.291 10.510 2.243 . . . 1.0 . . . . . . . . . . . . A . 10 ALA C . . . . . . . . . rr_6wpd 1
. 5 . 945 . 1 1 10 ALA CA C 12.711 11.067 3.598 . . . 1.0 . . . . . . . . . . . . A . 10 ALA CA . . . . . . . . . rr_6wpd 1
. 5 . 946 . 1 1 10 ALA CB C 13.870 10.241 4.147 . . . 1.0 . . . . . . . . . . . . A . 10 ALA CB . . . . . . . . . rr_6wpd 1
. 5 . 947 . 1 1 10 ALA H H 11.665 10.458 5.332 . . . 1.0 . . . . . . . . . . . . A . 10 ALA H . . . . . . . . . rr_6wpd 1
. 5 . 948 . 1 1 10 ALA HA H 13.037 12.086 3.476 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HA . . . . . . . . . rr_6wpd 1
. 5 . 949 . 1 1 10 ALA HB1 H 13.596 9.195 4.153 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB1 . . . . . . . . . rr_6wpd 1
. 5 . 950 . 1 1 10 ALA HB2 H 14.092 10.562 5.153 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB2 . . . . . . . . . rr_6wpd 1
. 5 . 951 . 1 1 10 ALA HB3 H 14.738 10.382 3.523 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB3 . . . . . . . . . rr_6wpd 1
. 5 . 952 . 1 1 10 ALA N N 11.601 11.033 4.541 . . . 1.0 . . . . . . . . . . . . A . 10 ALA N . . . . . . . . . rr_6wpd 1
. 5 . 953 . 1 1 10 ALA O O 12.686 11.021 1.195 . . . 1.0 . . . . . . . . . . . . A . 10 ALA O . . . . . . . . . rr_6wpd 1
. 5 . 954 . 1 1 11 LYS C C 10.202 9.766 0.218 . . . 1.0 . . . . . . . . . . . . A . 11 LYS C . . . . . . . . . rr_6wpd 1
. 5 . 955 . 1 1 11 LYS CA C 11.013 8.799 1.077 . . . 1.0 . . . . . . . . . . . . A . 11 LYS CA . . . . . . . . . rr_6wpd 1
. 5 . 956 . 1 1 11 LYS CB C 10.138 7.615 1.487 . . . 1.0 . . . . . . . . . . . . A . 11 LYS CB . . . . . . . . . rr_6wpd 1
. 5 . 957 . 1 1 11 LYS CD C 10.797 6.202 -0.495 . . . 1.0 . . . . . . . . . . . . A . 11 LYS CD . . . . . . . . . rr_6wpd 1
. 5 . 958 . 1 1 11 LYS CE C 10.279 5.029 -1.331 . . . 1.0 . . . . . . . . . . . . A . 11 LYS CE . . . . . . . . . rr_6wpd 1
. 5 . 959 . 1 1 11 LYS CG C 9.628 6.847 0.259 . . . 1.0 . . . . . . . . . . . . A . 11 LYS CG . . . . . . . . . rr_6wpd 1
. 5 . 960 . 1 1 11 LYS H H 11.227 9.098 3.158 . . . 1.0 . . . . . . . . . . . . A . 11 LYS H . . . . . . . . . rr_6wpd 1
. 5 . 961 . 1 1 11 LYS HA H 11.857 8.436 0.512 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HA . . . . . . . . . rr_6wpd 1
. 5 . 962 . 1 1 11 LYS HB2 H 10.714 6.948 2.108 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HB2 . . . . . . . . . rr_6wpd 1
. 5 . 963 . 1 1 11 LYS HB3 H 9.291 7.981 2.051 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HB3 . . . . . . . . . rr_6wpd 1
. 5 . 964 . 1 1 11 LYS HD2 H 11.251 6.930 -1.150 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HD2 . . . . . . . . . rr_6wpd 1
. 5 . 965 . 1 1 11 LYS HD3 H 11.527 5.843 0.207 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HD3 . . . . . . . . . rr_6wpd 1
. 5 . 966 . 1 1 11 LYS HE2 H 9.474 5.365 -1.968 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HE2 . . . . . . . . . rr_6wpd 1
. 5 . 967 . 1 1 11 LYS HE3 H 11.081 4.635 -1.937 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HE3 . . . . . . . . . rr_6wpd 1
. 5 . 968 . 1 1 11 LYS HG2 H 8.942 6.079 0.589 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HG2 . . . . . . . . . rr_6wpd 1
. 5 . 969 . 1 1 11 LYS HG3 H 9.111 7.520 -0.400 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HG3 . . . . . . . . . rr_6wpd 1
. 5 . 970 . 1 1 11 LYS HZ1 H 10.275 3.074 -0.612 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HZ1 . . . . . . . . . rr_6wpd 1
. 5 . 971 . 1 1 11 LYS HZ2 H 8.757 3.836 -0.559 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HZ2 . . . . . . . . . rr_6wpd 1
. 5 . 972 . 1 1 11 LYS HZ3 H 9.958 4.248 0.571 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HZ3 . . . . . . . . . rr_6wpd 1
. 5 . 973 . 1 1 11 LYS N N 11.495 9.453 2.286 . . . 1.0 . . . . . . . . . . . . A . 11 LYS N . . . . . . . . . rr_6wpd 1
. 5 . 974 . 1 1 11 LYS NZ N 9.779 3.965 -0.413 . . . 1.0 . . . . . . . . . . . . A . 11 LYS NZ . . . . . . . . . rr_6wpd 1
. 5 . 975 . 1 1 11 LYS O O 10.382 9.835 -0.997 . . . 1.0 . . . . . . . . . . . . A . 11 LYS O . . . . . . . . . rr_6wpd 1
. 5 . 976 . 1 1 12 ALA C C 9.288 12.593 -0.435 . . . 1.0 . . . . . . . . . . . . A . 12 ALA C . . . . . . . . . rr_6wpd 1
. 5 . 977 . 1 1 12 ALA CA C 8.458 11.458 0.159 . . . 1.0 . . . . . . . . . . . . A . 12 ALA CA . . . . . . . . . rr_6wpd 1
. 5 . 978 . 1 1 12 ALA CB C 7.432 12.037 1.129 . . . 1.0 . . . . . . . . . . . . A . 12 ALA CB . . . . . . . . . rr_6wpd 1
. 5 . 979 . 1 1 12 ALA H H 9.200 10.398 1.833 . . . 1.0 . . . . . . . . . . . . A . 12 ALA H . . . . . . . . . rr_6wpd 1
. 5 . 980 . 1 1 12 ALA HA H 7.935 10.946 -0.635 . . . 1.0 . . . . . . . . . . . . A . 12 ALA HA . . . . . . . . . rr_6wpd 1
. 5 . 981 . 1 1 12 ALA HB1 H 6.794 12.730 0.604 . . . 1.0 . . . . . . . . . . . . A . 12 ALA HB1 . . . . . . . . . rr_6wpd 1
. 5 . 982 . 1 1 12 ALA HB2 H 7.944 12.553 1.929 . . . 1.0 . . . . . . . . . . . . A . 12 ALA HB2 . . . . . . . . . rr_6wpd 1
. 5 . 983 . 1 1 12 ALA HB3 H 6.834 11.238 1.540 . . . 1.0 . . . . . . . . . . . . A . 12 ALA HB3 . . . . . . . . . rr_6wpd 1
. 5 . 984 . 1 1 12 ALA N N 9.303 10.502 0.863 . . . 1.0 . . . . . . . . . . . . A . 12 ALA N . . . . . . . . . rr_6wpd 1
. 5 . 985 . 1 1 12 ALA O O 9.032 13.044 -1.551 . . . 1.0 . . . . . . . . . . . . A . 12 ALA O . . . . . . . . . rr_6wpd 1
. 5 . 986 . 1 1 13 ALA C C 11.933 13.756 -1.352 . . . 1.0 . . . . . . . . . . . . A . 13 ALA C . . . . . . . . . rr_6wpd 1
. 5 . 987 . 1 1 13 ALA CA C 11.128 14.150 -0.117 . . . 1.0 . . . . . . . . . . . . A . 13 ALA CA . . . . . . . . . rr_6wpd 1
. 5 . 988 . 1 1 13 ALA CB C 12.081 14.545 1.010 . . . 1.0 . . . . . . . . . . . . A . 13 ALA CB . . . . . . . . . rr_6wpd 1
. 5 . 989 . 1 1 13 ALA H H 10.420 12.666 1.214 . . . 1.0 . . . . . . . . . . . . A . 13 ALA H . . . . . . . . . rr_6wpd 1
. 5 . 990 . 1 1 13 ALA HA H 10.509 14.996 -0.360 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HA . . . . . . . . . rr_6wpd 1
. 5 . 991 . 1 1 13 ALA HB1 H 12.539 15.493 0.778 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB1 . . . . . . . . . rr_6wpd 1
. 5 . 992 . 1 1 13 ALA HB2 H 12.847 13.790 1.116 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB2 . . . . . . . . . rr_6wpd 1
. 5 . 993 . 1 1 13 ALA HB3 H 11.528 14.628 1.933 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB3 . . . . . . . . . rr_6wpd 1
. 5 . 994 . 1 1 13 ALA N N 10.273 13.057 0.328 . . . 1.0 . . . . . . . . . . . . A . 13 ALA N . . . . . . . . . rr_6wpd 1
. 5 . 995 . 1 1 13 ALA O O 12.134 14.567 -2.259 . . . 1.0 . . . . . . . . . . . . A . 13 ALA O . . . . . . . . . rr_6wpd 1
. 5 . 996 . 1 1 14 GLY C C 13.321 10.510 -2.452 . . . 1.0 . . . . . . . . . . . . A . 14 GLY C . . . . . . . . . rr_6wpd 1
. 5 . 997 . 1 1 14 GLY CA C 13.185 12.026 -2.499 . . . 1.0 . . . . . . . . . . . . A . 14 GLY CA . . . . . . . . . rr_6wpd 1
. 5 . 998 . 1 1 14 GLY H H 12.210 11.919 -0.625 . . . 1.0 . . . . . . . . . . . . A . 14 GLY H . . . . . . . . . rr_6wpd 1
. 5 . 999 . 1 1 14 GLY HA2 H 12.701 12.312 -3.421 . . . 1.0 . . . . . . . . . . . . A . 14 GLY HA2 . . . . . . . . . rr_6wpd 1
. 5 . 1000 . 1 1 14 GLY HA3 H 14.168 12.468 -2.461 . . . 1.0 . . . . . . . . . . . . A . 14 GLY HA3 . . . . . . . . . rr_6wpd 1
. 5 . 1001 . 1 1 14 GLY N N 12.398 12.514 -1.376 . . . 1.0 . . . . . . . . . . . . A . 14 GLY N . . . . . . . . . rr_6wpd 1
. 5 . 1002 . 1 1 14 GLY O O 12.319 9.793 -2.464 . . . 1.0 . . . . . . . . . . . . A . 14 GLY O . . . . . . . . . rr_6wpd 1
. 5 . 1003 . 1 1 15 NH2 HN1 H 15.305 10.540 -2.387 . . . 1.0 . . . . . . . . . . . . A . 15 NH2 HN1 . . . . . . . . . rr_6wpd 1
. 5 . 1004 . 1 1 15 NH2 HN2 H 14.602 8.996 -2.364 . . . 1.0 . . . . . . . . . . . . A . 15 NH2 HN2 . . . . . . . . . rr_6wpd 1
. 5 . 1005 . 1 1 15 NH2 N N 14.508 9.972 -2.398 . . . 1.0 . . . . . . . . . . . . A . 15 NH2 N . . . . . . . . . rr_6wpd 1
. 6 . 1006 . 1 1 1 GLY C C 10.588 8.638 16.964 . . . 1.0 . . . . . . . . . . . . A . 1 GLY C . . . . . . . . . rr_6wpd 1
. 6 . 1007 . 1 1 1 GLY CA C 10.242 10.028 17.476 . . . 1.0 . . . . . . . . . . . . A . 1 GLY CA . . . . . . . . . rr_6wpd 1
. 6 . 1008 . 1 1 1 GLY H1 H 9.856 10.798 19.371 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H1 . . . . . . . . . rr_6wpd 1
. 6 . 1009 . 1 1 1 GLY H2 H 11.476 10.348 19.123 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H2 . . . . . . . . . rr_6wpd 1
. 6 . 1010 . 1 1 1 GLY H3 H 10.289 9.158 19.367 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H3 . . . . . . . . . rr_6wpd 1
. 6 . 1011 . 1 1 1 GLY HA2 H 9.201 10.235 17.276 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA2 . . . . . . . . . rr_6wpd 1
. 6 . 1012 . 1 1 1 GLY HA3 H 10.860 10.758 16.977 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA3 . . . . . . . . . rr_6wpd 1
. 6 . 1013 . 1 1 1 GLY N N 10.484 10.088 18.945 . . . 1.0 . . . . . . . . . . . . A . 1 GLY N . . . . . . . . . rr_6wpd 1
. 6 . 1014 . 1 1 1 GLY O O 11.675 8.121 17.218 . . . 1.0 . . . . . . . . . . . . A . 1 GLY O . . . . . . . . . rr_6wpd 1
. 6 . 1015 . 1 1 2 ILE C C 10.655 6.788 14.417 . . . 1.0 . . . . . . . . . . . . A . 2 ILE C . . . . . . . . . rr_6wpd 1
. 6 . 1016 . 1 1 2 ILE CA C 9.829 6.703 15.695 . . . 1.0 . . . . . . . . . . . . A . 2 ILE CA . . . . . . . . . rr_6wpd 1
. 6 . 1017 . 1 1 2 ILE CB C 8.453 6.092 15.405 . . . 1.0 . . . . . . . . . . . . A . 2 ILE CB . . . . . . . . . rr_6wpd 1
. 6 . 1018 . 1 1 2 ILE CD1 C 6.172 5.686 16.339 . . . 1.0 . . . . . . . . . . . . A . 2 ILE CD1 . . . . . . . . . rr_6wpd 1
. 6 . 1019 . 1 1 2 ILE CG1 C 7.564 6.236 16.646 . . . 1.0 . . . . . . . . . . . . A . 2 ILE CG1 . . . . . . . . . rr_6wpd 1
. 6 . 1020 . 1 1 2 ILE CG2 C 8.595 4.609 15.055 . . . 1.0 . . . . . . . . . . . . A . 2 ILE CG2 . . . . . . . . . rr_6wpd 1
. 6 . 1021 . 1 1 2 ILE H H 8.803 8.503 16.082 . . . 1.0 . . . . . . . . . . . . A . 2 ILE H . . . . . . . . . rr_6wpd 1
. 6 . 1022 . 1 1 2 ILE HA H 10.348 6.082 16.410 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HA . . . . . . . . . rr_6wpd 1
. 6 . 1023 . 1 1 2 ILE HB H 7.997 6.613 14.576 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HB . . . . . . . . . rr_6wpd 1
. 6 . 1024 . 1 1 2 ILE HD11 H 5.841 6.057 15.380 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HD11 . . . . . . . . . rr_6wpd 1
. 6 . 1025 . 1 1 2 ILE HD12 H 5.482 6.004 17.106 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HD12 . . . . . . . . . rr_6wpd 1
. 6 . 1026 . 1 1 2 ILE HD13 H 6.210 4.607 16.313 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HD13 . . . . . . . . . rr_6wpd 1
. 6 . 1027 . 1 1 2 ILE HG12 H 7.999 5.685 17.467 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HG12 . . . . . . . . . rr_6wpd 1
. 6 . 1028 . 1 1 2 ILE HG13 H 7.483 7.278 16.913 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HG13 . . . . . . . . . rr_6wpd 1
. 6 . 1029 . 1 1 2 ILE HG21 H 9.414 4.479 14.367 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HG21 . . . . . . . . . rr_6wpd 1
. 6 . 1030 . 1 1 2 ILE HG22 H 7.681 4.258 14.598 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HG22 . . . . . . . . . rr_6wpd 1
. 6 . 1031 . 1 1 2 ILE HG23 H 8.787 4.042 15.954 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HG23 . . . . . . . . . rr_6wpd 1
. 6 . 1032 . 1 1 2 ILE N N 9.645 8.038 16.246 . . . 1.0 . . . . . . . . . . . . A . 2 ILE N . . . . . . . . . rr_6wpd 1
. 6 . 1033 . 1 1 2 ILE O O 10.425 7.657 13.578 . . . 1.0 . . . . . . . . . . . . A . 2 ILE O . . . . . . . . . rr_6wpd 1
. 6 . 1034 . 1 1 3 LEU C C 11.685 5.745 11.827 . . . 1.0 . . . . . . . . . . . . A . 3 LEU C . . . . . . . . . rr_6wpd 1
. 6 . 1035 . 1 1 3 LEU CA C 12.498 5.871 13.114 . . . 1.0 . . . . . . . . . . . . A . 3 LEU CA . . . . . . . . . rr_6wpd 1
. 6 . 1036 . 1 1 3 LEU CB C 13.469 4.682 13.228 . . . 1.0 . . . . . . . . . . . . A . 3 LEU CB . . . . . . . . . rr_6wpd 1
. 6 . 1037 . 1 1 3 LEU CD1 C 14.202 5.538 15.460 . . . 1.0 . . . . . . . . . . . . A . 3 LEU CD1 . . . . . . . . . rr_6wpd 1
. 6 . 1038 . 1 1 3 LEU CD2 C 15.605 3.871 14.242 . . . 1.0 . . . . . . . . . . . . A . 3 LEU CD2 . . . . . . . . . rr_6wpd 1
. 6 . 1039 . 1 1 3 LEU CG C 14.678 5.076 14.082 . . . 1.0 . . . . . . . . . . . . A . 3 LEU CG . . . . . . . . . rr_6wpd 1
. 6 . 1040 . 1 1 3 LEU H H 11.751 5.226 14.991 . . . 1.0 . . . . . . . . . . . . A . 3 LEU H . . . . . . . . . rr_6wpd 1
. 6 . 1041 . 1 1 3 LEU HA H 13.063 6.792 13.082 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HA . . . . . . . . . rr_6wpd 1
. 6 . 1042 . 1 1 3 LEU HB2 H 12.962 3.847 13.693 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HB2 . . . . . . . . . rr_6wpd 1
. 6 . 1043 . 1 1 3 LEU HB3 H 13.804 4.386 12.246 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HB3 . . . . . . . . . rr_6wpd 1
. 6 . 1044 . 1 1 3 LEU HD11 H 13.747 6.515 15.376 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HD11 . . . . . . . . . rr_6wpd 1
. 6 . 1045 . 1 1 3 LEU HD12 H 15.045 5.591 16.134 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HD12 . . . . . . . . . rr_6wpd 1
. 6 . 1046 . 1 1 3 LEU HD13 H 13.477 4.836 15.845 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HD13 . . . . . . . . . rr_6wpd 1
. 6 . 1047 . 1 1 3 LEU HD21 H 16.495 4.169 14.779 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HD21 . . . . . . . . . rr_6wpd 1
. 6 . 1048 . 1 1 3 LEU HD22 H 15.881 3.497 13.268 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HD22 . . . . . . . . . rr_6wpd 1
. 6 . 1049 . 1 1 3 LEU HD23 H 15.094 3.097 14.795 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HD23 . . . . . . . . . rr_6wpd 1
. 6 . 1050 . 1 1 3 LEU HG H 15.210 5.881 13.596 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HG . . . . . . . . . rr_6wpd 1
. 6 . 1051 . 1 1 3 LEU N N 11.618 5.888 14.284 . . . 1.0 . . . . . . . . . . . . A . 3 LEU N . . . . . . . . . rr_6wpd 1
. 6 . 1052 . 1 1 3 LEU O O 12.111 6.184 10.759 . . . 1.0 . . . . . . . . . . . . A . 3 LEU O . . . . . . . . . rr_6wpd 1
. 6 . 1053 . 1 1 4 ASP C C 9.175 6.250 10.210 . . . 1.0 . . . . . . . . . . . . A . 4 ASP C . . . . . . . . . rr_6wpd 1
. 6 . 1054 . 1 1 4 ASP CA C 9.630 4.920 10.814 . . . 1.0 . . . . . . . . . . . . A . 4 ASP CA . . . . . . . . . rr_6wpd 1
. 6 . 1055 . 1 1 4 ASP CB C 8.407 4.122 11.287 . . . 1.0 . . . . . . . . . . . . A . 4 ASP CB . . . . . . . . . rr_6wpd 1
. 6 . 1056 . 1 1 4 ASP CG C 7.422 3.901 10.142 . . . 1.0 . . . . . . . . . . . . A . 4 ASP CG . . . . . . . . . rr_6wpd 1
. 6 . 1057 . 1 1 4 ASP H H 10.256 4.815 12.836 . . . 1.0 . . . . . . . . . . . . A . 4 ASP H . . . . . . . . . rr_6wpd 1
. 6 . 1058 . 1 1 4 ASP HA H 10.149 4.353 10.057 . . . 1.0 . . . . . . . . . . . . A . 4 ASP HA . . . . . . . . . rr_6wpd 1
. 6 . 1059 . 1 1 4 ASP HB2 H 8.736 3.165 11.661 . . . 1.0 . . . . . . . . . . . . A . 4 ASP HB2 . . . . . . . . . rr_6wpd 1
. 6 . 1060 . 1 1 4 ASP HB3 H 7.911 4.663 12.085 . . . 1.0 . . . . . . . . . . . . A . 4 ASP HB3 . . . . . . . . . rr_6wpd 1
. 6 . 1061 . 1 1 4 ASP N N 10.523 5.134 11.951 . . . 1.0 . . . . . . . . . . . . A . 4 ASP N . . . . . . . . . rr_6wpd 1
. 6 . 1062 . 1 1 4 ASP O O 9.047 6.379 8.993 . . . 1.0 . . . . . . . . . . . . A . 4 ASP O . . . . . . . . . rr_6wpd 1
. 6 . 1063 . 1 1 4 ASP OD1 O 6.467 3.171 10.345 . . . 1.0 . . . . . . . . . . . . A . 4 ASP OD1 . . . . . . . . . rr_6wpd 1
. 6 . 1064 . 1 1 4 ASP OD2 O 7.639 4.461 9.082 . . . 1.0 . . . . . . . . . . . . A . 4 ASP OD2 . . . . . . . . . rr_6wpd 1
. 6 . 1065 . 1 1 5 ALA C C 9.533 9.242 9.780 . . . 1.0 . . . . . . . . . . . . A . 5 ALA C . . . . . . . . . rr_6wpd 1
. 6 . 1066 . 1 1 5 ALA CA C 8.476 8.545 10.636 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CA . . . . . . . . . rr_6wpd 1
. 6 . 1067 . 1 1 5 ALA CB C 8.170 9.404 11.868 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CB . . . . . . . . . rr_6wpd 1
. 6 . 1068 . 1 1 5 ALA H H 9.051 7.058 12.029 . . . 1.0 . . . . . . . . . . . . A . 5 ALA H . . . . . . . . . rr_6wpd 1
. 6 . 1069 . 1 1 5 ALA HA H 7.572 8.433 10.054 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HA . . . . . . . . . rr_6wpd 1
. 6 . 1070 . 1 1 5 ALA HB1 H 7.624 8.814 12.587 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB1 . . . . . . . . . rr_6wpd 1
. 6 . 1071 . 1 1 5 ALA HB2 H 7.580 10.258 11.577 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB2 . . . . . . . . . rr_6wpd 1
. 6 . 1072 . 1 1 5 ALA HB3 H 9.097 9.741 12.314 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB3 . . . . . . . . . rr_6wpd 1
. 6 . 1073 . 1 1 5 ALA N N 8.930 7.227 11.073 . . . 1.0 . . . . . . . . . . . . A . 5 ALA N . . . . . . . . . rr_6wpd 1
. 6 . 1074 . 1 1 5 ALA O O 9.217 9.845 8.754 . . . 1.0 . . . . . . . . . . . . A . 5 ALA O . . . . . . . . . rr_6wpd 1
. 6 . 1075 . 1 1 6 ILE C C 12.056 9.170 8.104 . . . 1.0 . . . . . . . . . . . . A . 6 ILE C . . . . . . . . . rr_6wpd 1
. 6 . 1076 . 1 1 6 ILE CA C 11.896 9.774 9.498 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CA . . . . . . . . . rr_6wpd 1
. 6 . 1077 . 1 1 6 ILE CB C 13.182 9.570 10.309 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CB . . . . . . . . . rr_6wpd 1
. 6 . 1078 . 1 1 6 ILE CD1 C 14.201 9.957 12.558 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CD1 . . . . . . . . . rr_6wpd 1
. 6 . 1079 . 1 1 6 ILE CG1 C 13.092 10.388 11.598 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CG1 . . . . . . . . . rr_6wpd 1
. 6 . 1080 . 1 1 6 ILE CG2 C 14.400 10.025 9.501 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CG2 . . . . . . . . . rr_6wpd 1
. 6 . 1081 . 1 1 6 ILE H H 10.968 8.657 11.036 . . . 1.0 . . . . . . . . . . . . A . 6 ILE H . . . . . . . . . rr_6wpd 1
. 6 . 1082 . 1 1 6 ILE HA H 11.705 10.833 9.400 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HA . . . . . . . . . rr_6wpd 1
. 6 . 1083 . 1 1 6 ILE HB H 13.287 8.521 10.555 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HB . . . . . . . . . rr_6wpd 1
. 6 . 1084 . 1 1 6 ILE HD11 H 13.950 8.998 12.989 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HD11 . . . . . . . . . rr_6wpd 1
. 6 . 1085 . 1 1 6 ILE HD12 H 14.301 10.690 13.344 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HD12 . . . . . . . . . rr_6wpd 1
. 6 . 1086 . 1 1 6 ILE HD13 H 15.133 9.876 12.019 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HD13 . . . . . . . . . rr_6wpd 1
. 6 . 1087 . 1 1 6 ILE HG12 H 13.202 11.436 11.365 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG12 . . . . . . . . . rr_6wpd 1
. 6 . 1088 . 1 1 6 ILE HG13 H 12.132 10.222 12.062 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG13 . . . . . . . . . rr_6wpd 1
. 6 . 1089 . 1 1 6 ILE HG21 H 14.605 9.306 8.721 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG21 . . . . . . . . . rr_6wpd 1
. 6 . 1090 . 1 1 6 ILE HG22 H 15.258 10.101 10.155 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG22 . . . . . . . . . rr_6wpd 1
. 6 . 1091 . 1 1 6 ILE HG23 H 14.198 10.989 9.059 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG23 . . . . . . . . . rr_6wpd 1
. 6 . 1092 . 1 1 6 ILE N N 10.784 9.152 10.213 . . . 1.0 . . . . . . . . . . . . A . 6 ILE N . . . . . . . . . rr_6wpd 1
. 6 . 1093 . 1 1 6 ILE O O 12.274 9.884 7.126 . . . 1.0 . . . . . . . . . . . . A . 6 ILE O . . . . . . . . . rr_6wpd 1
. 6 . 1094 . 1 1 7 LYS C C 11.011 7.540 5.778 . . . 1.0 . . . . . . . . . . . . A . 7 LYS C . . . . . . . . . rr_6wpd 1
. 6 . 1095 . 1 1 7 LYS CA C 12.093 7.136 6.769 . . . 1.0 . . . . . . . . . . . . A . 7 LYS CA . . . . . . . . . rr_6wpd 1
. 6 . 1096 . 1 1 7 LYS CB C 12.002 5.639 7.058 . . . 1.0 . . . . . . . . . . . . A . 7 LYS CB . . . . . . . . . rr_6wpd 1
. 6 . 1097 . 1 1 7 LYS CD C 14.405 4.894 7.045 . . . 1.0 . . . . . . . . . . . . A . 7 LYS CD . . . . . . . . . rr_6wpd 1
. 6 . 1098 . 1 1 7 LYS CE C 15.555 4.449 7.941 . . . 1.0 . . . . . . . . . . . . A . 7 LYS CE . . . . . . . . . rr_6wpd 1
. 6 . 1099 . 1 1 7 LYS CG C 13.195 5.207 7.924 . . . 1.0 . . . . . . . . . . . . A . 7 LYS CG . . . . . . . . . rr_6wpd 1
. 6 . 1100 . 1 1 7 LYS H H 11.778 7.341 8.846 . . . 1.0 . . . . . . . . . . . . A . 7 LYS H . . . . . . . . . rr_6wpd 1
. 6 . 1101 . 1 1 7 LYS HA H 13.054 7.351 6.346 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HA . . . . . . . . . rr_6wpd 1
. 6 . 1102 . 1 1 7 LYS HB2 H 11.085 5.440 7.587 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HB2 . . . . . . . . . rr_6wpd 1
. 6 . 1103 . 1 1 7 LYS HB3 H 12.004 5.089 6.134 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HB3 . . . . . . . . . rr_6wpd 1
. 6 . 1104 . 1 1 7 LYS HD2 H 14.151 4.104 6.362 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HD2 . . . . . . . . . rr_6wpd 1
. 6 . 1105 . 1 1 7 LYS HD3 H 14.698 5.770 6.493 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HD3 . . . . . . . . . rr_6wpd 1
. 6 . 1106 . 1 1 7 LYS HE2 H 16.436 4.275 7.339 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HE2 . . . . . . . . . rr_6wpd 1
. 6 . 1107 . 1 1 7 LYS HE3 H 15.762 5.218 8.672 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HE3 . . . . . . . . . rr_6wpd 1
. 6 . 1108 . 1 1 7 LYS HG2 H 13.458 6.001 8.602 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HG2 . . . . . . . . . rr_6wpd 1
. 6 . 1109 . 1 1 7 LYS HG3 H 12.931 4.330 8.493 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HG3 . . . . . . . . . rr_6wpd 1
. 6 . 1110 . 1 1 7 LYS HZ1 H 15.079 3.374 9.657 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HZ1 . . . . . . . . . rr_6wpd 1
. 6 . 1111 . 1 1 7 LYS HZ2 H 15.895 2.469 8.474 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HZ2 . . . . . . . . . rr_6wpd 1
. 6 . 1112 . 1 1 7 LYS HZ3 H 14.253 2.857 8.267 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HZ3 . . . . . . . . . rr_6wpd 1
. 6 . 1113 . 1 1 7 LYS N N 11.952 7.852 8.030 . . . 1.0 . . . . . . . . . . . . A . 7 LYS N . . . . . . . . . rr_6wpd 1
. 6 . 1114 . 1 1 7 LYS NZ N 15.167 3.192 8.639 . . . 1.0 . . . . . . . . . . . . A . 7 LYS NZ . . . . . . . . . rr_6wpd 1
. 6 . 1115 . 1 1 7 LYS O O 11.280 7.742 4.595 . . . 1.0 . . . . . . . . . . . . A . 7 LYS O . . . . . . . . . rr_6wpd 1
. 6 . 1116 . 1 1 8 ALA C C 8.851 9.431 4.846 . . . 1.0 . . . . . . . . . . . . A . 8 ALA C . . . . . . . . . rr_6wpd 1
. 6 . 1117 . 1 1 8 ALA CA C 8.657 8.034 5.434 . . . 1.0 . . . . . . . . . . . . A . 8 ALA CA . . . . . . . . . rr_6wpd 1
. 6 . 1118 . 1 1 8 ALA CB C 7.381 8.004 6.280 . . . 1.0 . . . . . . . . . . . . A . 8 ALA CB . . . . . . . . . rr_6wpd 1
. 6 . 1119 . 1 1 8 ALA H H 9.642 7.487 7.225 . . . 1.0 . . . . . . . . . . . . A . 8 ALA H . . . . . . . . . rr_6wpd 1
. 6 . 1120 . 1 1 8 ALA HA H 8.562 7.322 4.627 . . . 1.0 . . . . . . . . . . . . A . 8 ALA HA . . . . . . . . . rr_6wpd 1
. 6 . 1121 . 1 1 8 ALA HB1 H 7.401 8.818 6.994 . . . 1.0 . . . . . . . . . . . . A . 8 ALA HB1 . . . . . . . . . rr_6wpd 1
. 6 . 1122 . 1 1 8 ALA HB2 H 7.325 7.066 6.810 . . . 1.0 . . . . . . . . . . . . A . 8 ALA HB2 . . . . . . . . . rr_6wpd 1
. 6 . 1123 . 1 1 8 ALA HB3 H 6.518 8.108 5.640 . . . 1.0 . . . . . . . . . . . . A . 8 ALA HB3 . . . . . . . . . rr_6wpd 1
. 6 . 1124 . 1 1 8 ALA N N 9.790 7.658 6.272 . . . 1.0 . . . . . . . . . . . . A . 8 ALA N . . . . . . . . . rr_6wpd 1
. 6 . 1125 . 1 1 8 ALA O O 8.578 9.664 3.669 . . . 1.0 . . . . . . . . . . . . A . 8 ALA O . . . . . . . . . rr_6wpd 1
. 6 . 1126 . 1 1 9 ILE C C 10.628 11.796 4.173 . . . 1.0 . . . . . . . . . . . . A . 9 ILE C . . . . . . . . . rr_6wpd 1
. 6 . 1127 . 1 1 9 ILE CA C 9.556 11.729 5.258 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CA . . . . . . . . . rr_6wpd 1
. 6 . 1128 . 1 1 9 ILE CB C 9.993 12.541 6.483 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CB . . . . . . . . . rr_6wpd 1
. 6 . 1129 . 1 1 9 ILE CD1 C 9.288 13.157 8.802 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CD1 . . . . . . . . . rr_6wpd 1
. 6 . 1130 . 1 1 9 ILE CG1 C 8.809 12.654 7.441 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CG1 . . . . . . . . . rr_6wpd 1
. 6 . 1131 . 1 1 9 ILE CG2 C 10.455 13.940 6.068 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CG2 . . . . . . . . . rr_6wpd 1
. 6 . 1132 . 1 1 9 ILE H H 9.524 10.096 6.603 . . . 1.0 . . . . . . . . . . . . A . 9 ILE H . . . . . . . . . rr_6wpd 1
. 6 . 1133 . 1 1 9 ILE HA H 8.636 12.143 4.871 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HA . . . . . . . . . rr_6wpd 1
. 6 . 1134 . 1 1 9 ILE HB H 10.803 12.031 6.977 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HB . . . . . . . . . rr_6wpd 1
. 6 . 1135 . 1 1 9 ILE HD11 H 10.106 12.542 9.146 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HD11 . . . . . . . . . rr_6wpd 1
. 6 . 1136 . 1 1 9 ILE HD12 H 8.474 13.099 9.510 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HD12 . . . . . . . . . rr_6wpd 1
. 6 . 1137 . 1 1 9 ILE HD13 H 9.616 14.181 8.714 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HD13 . . . . . . . . . rr_6wpd 1
. 6 . 1138 . 1 1 9 ILE HG12 H 8.095 13.346 7.033 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG12 . . . . . . . . . rr_6wpd 1
. 6 . 1139 . 1 1 9 ILE HG13 H 8.346 11.685 7.557 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG13 . . . . . . . . . rr_6wpd 1
. 6 . 1140 . 1 1 9 ILE HG21 H 10.515 14.573 6.942 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG21 . . . . . . . . . rr_6wpd 1
. 6 . 1141 . 1 1 9 ILE HG22 H 9.751 14.358 5.366 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG22 . . . . . . . . . rr_6wpd 1
. 6 . 1142 . 1 1 9 ILE HG23 H 11.429 13.876 5.604 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG23 . . . . . . . . . rr_6wpd 1
. 6 . 1143 . 1 1 9 ILE N N 9.324 10.349 5.678 . . . 1.0 . . . . . . . . . . . . A . 9 ILE N . . . . . . . . . rr_6wpd 1
. 6 . 1144 . 1 1 9 ILE O O 10.485 12.514 3.184 . . . 1.0 . . . . . . . . . . . . A . 9 ILE O . . . . . . . . . rr_6wpd 1
. 6 . 1145 . 1 1 10 ALA C C 12.356 10.454 2.072 . . . 1.0 . . . . . . . . . . . . A . 10 ALA C . . . . . . . . . rr_6wpd 1
. 6 . 1146 . 1 1 10 ALA CA C 12.806 11.006 3.420 . . . 1.0 . . . . . . . . . . . . A . 10 ALA CA . . . . . . . . . rr_6wpd 1
. 6 . 1147 . 1 1 10 ALA CB C 13.928 10.126 3.985 . . . 1.0 . . . . . . . . . . . . A . 10 ALA CB . . . . . . . . . rr_6wpd 1
. 6 . 1148 . 1 1 10 ALA H H 11.748 10.489 5.179 . . . 1.0 . . . . . . . . . . . . A . 10 ALA H . . . . . . . . . rr_6wpd 1
. 6 . 1149 . 1 1 10 ALA HA H 13.180 12.006 3.280 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HA . . . . . . . . . rr_6wpd 1
. 6 . 1150 . 1 1 10 ALA HB1 H 14.834 10.287 3.422 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB1 . . . . . . . . . rr_6wpd 1
. 6 . 1151 . 1 1 10 ALA HB2 H 13.642 9.084 3.917 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB2 . . . . . . . . . rr_6wpd 1
. 6 . 1152 . 1 1 10 ALA HB3 H 14.095 10.382 5.021 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB3 . . . . . . . . . rr_6wpd 1
. 6 . 1153 . 1 1 10 ALA N N 11.699 11.039 4.371 . . . 1.0 . . . . . . . . . . . . A . 10 ALA N . . . . . . . . . rr_6wpd 1
. 6 . 1154 . 1 1 10 ALA O O 12.736 10.959 1.019 . . . 1.0 . . . . . . . . . . . . A . 10 ALA O . . . . . . . . . rr_6wpd 1
. 6 . 1155 . 1 1 11 LYS C C 10.184 9.727 0.093 . . . 1.0 . . . . . . . . . . . . A . 11 LYS C . . . . . . . . . rr_6wpd 1
. 6 . 1156 . 1 1 11 LYS CA C 11.035 8.773 0.920 . . . 1.0 . . . . . . . . . . . . A . 11 LYS CA . . . . . . . . . rr_6wpd 1
. 6 . 1157 . 1 1 11 LYS CB C 10.207 7.570 1.343 . . . 1.0 . . . . . . . . . . . . A . 11 LYS CB . . . . . . . . . rr_6wpd 1
. 6 . 1158 . 1 1 11 LYS CD C 11.712 5.639 0.802 . . . 1.0 . . . . . . . . . . . . A . 11 LYS CD . . . . . . . . . rr_6wpd 1
. 6 . 1159 . 1 1 11 LYS CE C 12.598 4.537 1.375 . . . 1.0 . . . . . . . . . . . . A . 11 LYS CE . . . . . . . . . rr_6wpd 1
. 6 . 1160 . 1 1 11 LYS CG C 11.129 6.488 1.929 . . . 1.0 . . . . . . . . . . . . A . 11 LYS CG . . . . . . . . . rr_6wpd 1
. 6 . 1161 . 1 1 11 LYS H H 11.279 9.062 2.993 . . . 1.0 . . . . . . . . . . . . A . 11 LYS H . . . . . . . . . rr_6wpd 1
. 6 . 1162 . 1 1 11 LYS HA H 11.855 8.432 0.333 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HA . . . . . . . . . rr_6wpd 1
. 6 . 1163 . 1 1 11 LYS HB2 H 9.501 7.883 2.086 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HB2 . . . . . . . . . rr_6wpd 1
. 6 . 1164 . 1 1 11 LYS HB3 H 9.677 7.177 0.494 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HB3 . . . . . . . . . rr_6wpd 1
. 6 . 1165 . 1 1 11 LYS HD2 H 10.906 5.194 0.237 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HD2 . . . . . . . . . rr_6wpd 1
. 6 . 1166 . 1 1 11 LYS HD3 H 12.299 6.255 0.153 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HD3 . . . . . . . . . rr_6wpd 1
. 6 . 1167 . 1 1 11 LYS HE2 H 13.419 4.976 1.926 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HE2 . . . . . . . . . rr_6wpd 1
. 6 . 1168 . 1 1 11 LYS HE3 H 12.016 3.904 2.031 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HE3 . . . . . . . . . rr_6wpd 1
. 6 . 1169 . 1 1 11 LYS HG2 H 11.934 6.954 2.482 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HG2 . . . . . . . . . rr_6wpd 1
. 6 . 1170 . 1 1 11 LYS HG3 H 10.570 5.862 2.589 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HG3 . . . . . . . . . rr_6wpd 1
. 6 . 1171 . 1 1 11 LYS HZ1 H 13.805 3.031 0.596 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HZ1 . . . . . . . . . rr_6wpd 1
. 6 . 1172 . 1 1 11 LYS HZ2 H 13.597 4.362 -0.438 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HZ2 . . . . . . . . . rr_6wpd 1
. 6 . 1173 . 1 1 11 LYS HZ3 H 12.338 3.240 -0.229 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HZ3 . . . . . . . . . rr_6wpd 1
. 6 . 1174 . 1 1 11 LYS N N 11.544 9.414 2.122 . . . 1.0 . . . . . . . . . . . . A . 11 LYS N . . . . . . . . . rr_6wpd 1
. 6 . 1175 . 1 1 11 LYS NZ N 13.126 3.730 0.242 . . . 1.0 . . . . . . . . . . . . A . 11 LYS NZ . . . . . . . . . rr_6wpd 1
. 6 . 1176 . 1 1 11 LYS O O 10.303 9.787 -1.132 . . . 1.0 . . . . . . . . . . . . A . 11 LYS O . . . . . . . . . rr_6wpd 1
. 6 . 1177 . 1 1 12 ALA C C 9.243 12.550 -0.529 . . . 1.0 . . . . . . . . . . . . A . 12 ALA C . . . . . . . . . rr_6wpd 1
. 6 . 1178 . 1 1 12 ALA CA C 8.443 11.425 0.120 . . . 1.0 . . . . . . . . . . . . A . 12 ALA CA . . . . . . . . . rr_6wpd 1
. 6 . 1179 . 1 1 12 ALA CB C 7.483 12.010 1.162 . . . 1.0 . . . . . . . . . . . . A . 12 ALA CB . . . . . . . . . rr_6wpd 1
. 6 . 1180 . 1 1 12 ALA H H 9.287 10.372 1.750 . . . 1.0 . . . . . . . . . . . . A . 12 ALA H . . . . . . . . . rr_6wpd 1
. 6 . 1181 . 1 1 12 ALA HA H 7.869 10.914 -0.641 . . . 1.0 . . . . . . . . . . . . A . 12 ALA HA . . . . . . . . . rr_6wpd 1
. 6 . 1182 . 1 1 12 ALA HB1 H 6.713 12.580 0.666 . . . 1.0 . . . . . . . . . . . . A . 12 ALA HB1 . . . . . . . . . rr_6wpd 1
. 6 . 1183 . 1 1 12 ALA HB2 H 8.030 12.653 1.837 . . . 1.0 . . . . . . . . . . . . A . 12 ALA HB2 . . . . . . . . . rr_6wpd 1
. 6 . 1184 . 1 1 12 ALA HB3 H 7.032 11.205 1.722 . . . 1.0 . . . . . . . . . . . . A . 12 ALA HB3 . . . . . . . . . rr_6wpd 1
. 6 . 1185 . 1 1 12 ALA N N 9.328 10.469 0.777 . . . 1.0 . . . . . . . . . . . . A . 12 ALA N . . . . . . . . . rr_6wpd 1
. 6 . 1186 . 1 1 12 ALA O O 8.914 13.013 -1.621 . . . 1.0 . . . . . . . . . . . . A . 12 ALA O . . . . . . . . . rr_6wpd 1
. 6 . 1187 . 1 1 13 ALA C C 11.821 13.688 -1.647 . . . 1.0 . . . . . . . . . . . . A . 13 ALA C . . . . . . . . . rr_6wpd 1
. 6 . 1188 . 1 1 13 ALA CA C 11.145 14.067 -0.333 . . . 1.0 . . . . . . . . . . . . A . 13 ALA CA . . . . . . . . . rr_6wpd 1
. 6 . 1189 . 1 1 13 ALA CB C 12.208 14.390 0.721 . . . 1.0 . . . . . . . . . . . . A . 13 ALA CB . . . . . . . . . rr_6wpd 1
. 6 . 1190 . 1 1 13 ALA H H 10.496 12.576 1.023 . . . 1.0 . . . . . . . . . . . . A . 13 ALA H . . . . . . . . . rr_6wpd 1
. 6 . 1191 . 1 1 13 ALA HA H 10.541 14.943 -0.497 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HA . . . . . . . . . rr_6wpd 1
. 6 . 1192 . 1 1 13 ALA HB1 H 12.869 15.156 0.346 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB1 . . . . . . . . . rr_6wpd 1
. 6 . 1193 . 1 1 13 ALA HB2 H 12.776 13.499 0.944 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB2 . . . . . . . . . rr_6wpd 1
. 6 . 1194 . 1 1 13 ALA HB3 H 11.722 14.740 1.621 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB3 . . . . . . . . . rr_6wpd 1
. 6 . 1195 . 1 1 13 ALA N N 10.292 12.986 0.159 . . . 1.0 . . . . . . . . . . . . A . 13 ALA N . . . . . . . . . rr_6wpd 1
. 6 . 1196 . 1 1 13 ALA O O 11.959 14.516 -2.544 . . . 1.0 . . . . . . . . . . . . A . 13 ALA O . . . . . . . . . rr_6wpd 1
. 6 . 1197 . 1 1 14 GLY C C 12.987 10.424 -2.963 . . . 1.0 . . . . . . . . . . . . A . 14 GLY C . . . . . . . . . rr_6wpd 1
. 6 . 1198 . 1 1 14 GLY CA C 12.900 11.949 -2.963 . . . 1.0 . . . . . . . . . . . . A . 14 GLY CA . . . . . . . . . rr_6wpd 1
. 6 . 1199 . 1 1 14 GLY H H 12.100 11.823 -1.000 . . . 1.0 . . . . . . . . . . . . A . 14 GLY H . . . . . . . . . rr_6wpd 1
. 6 . 1200 . 1 1 14 GLY HA2 H 12.339 12.274 -3.829 . . . 1.0 . . . . . . . . . . . . A . 14 GLY HA2 . . . . . . . . . rr_6wpd 1
. 6 . 1201 . 1 1 14 GLY HA3 H 13.900 12.359 -3.014 . . . 1.0 . . . . . . . . . . . . A . 14 GLY HA3 . . . . . . . . . rr_6wpd 1
. 6 . 1202 . 1 1 14 GLY N N 12.239 12.434 -1.751 . . . 1.0 . . . . . . . . . . . . A . 14 GLY N . . . . . . . . . rr_6wpd 1
. 6 . 1203 . 1 1 14 GLY O O 13.205 9.809 -1.919 . . . 1.0 . . . . . . . . . . . . A . 14 GLY O . . . . . . . . . rr_6wpd 1
. 6 . 1204 . 1 1 15 NH2 HN1 H 12.650 10.263 -4.912 . . . 1.0 . . . . . . . . . . . . A . 15 NH2 HN1 . . . . . . . . . rr_6wpd 1
. 6 . 1205 . 1 1 15 NH2 HN2 H 12.874 8.794 -4.093 . . . 1.0 . . . . . . . . . . . . A . 15 NH2 HN2 . . . . . . . . . rr_6wpd 1
. 6 . 1206 . 1 1 15 NH2 N N 12.825 9.771 -4.081 . . . 1.0 . . . . . . . . . . . . A . 15 NH2 N . . . . . . . . . rr_6wpd 1
. 7 . 1207 . 1 1 1 GLY C C 10.856 9.145 16.319 . . . 1.0 . . . . . . . . . . . . A . 1 GLY C . . . . . . . . . rr_6wpd 1
. 7 . 1208 . 1 1 1 GLY CA C 10.471 10.596 16.561 . . . 1.0 . . . . . . . . . . . . A . 1 GLY CA . . . . . . . . . rr_6wpd 1
. 7 . 1209 . 1 1 1 GLY H1 H 12.510 10.969 16.430 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H1 . . . . . . . . . rr_6wpd 1
. 7 . 1210 . 1 1 1 GLY H2 H 11.577 12.344 16.785 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H2 . . . . . . . . . rr_6wpd 1
. 7 . 1211 . 1 1 1 GLY H3 H 11.594 11.707 15.210 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H3 . . . . . . . . . rr_6wpd 1
. 7 . 1212 . 1 1 1 GLY HA2 H 10.208 10.734 17.602 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA2 . . . . . . . . . rr_6wpd 1
. 7 . 1213 . 1 1 1 GLY HA3 H 9.626 10.847 15.938 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA3 . . . . . . . . . rr_6wpd 1
. 7 . 1214 . 1 1 1 GLY N N 11.624 11.471 16.221 . . . 1.0 . . . . . . . . . . . . A . 1 GLY N . . . . . . . . . rr_6wpd 1
. 7 . 1215 . 1 1 1 GLY O O 11.990 8.743 16.595 . . . 1.0 . . . . . . . . . . . . A . 1 GLY O . . . . . . . . . rr_6wpd 1
. 7 . 1216 . 1 1 2 ILE C C 10.856 6.826 14.186 . . . 1.0 . . . . . . . . . . . . A . 2 ILE C . . . . . . . . . rr_6wpd 1
. 7 . 1217 . 1 1 2 ILE CA C 10.133 6.963 15.521 . . . 1.0 . . . . . . . . . . . . A . 2 ILE CA . . . . . . . . . rr_6wpd 1
. 7 . 1218 . 1 1 2 ILE CB C 8.781 6.250 15.472 . . . 1.0 . . . . . . . . . . . . A . 2 ILE CB . . . . . . . . . rr_6wpd 1
. 7 . 1219 . 1 1 2 ILE CD1 C 6.603 5.968 16.666 . . . 1.0 . . . . . . . . . . . . A . 2 ILE CD1 . . . . . . . . . rr_6wpd 1
. 7 . 1220 . 1 1 2 ILE CG1 C 8.034 6.488 16.788 . . . 1.0 . . . . . . . . . . . . A . 2 ILE CG1 . . . . . . . . . rr_6wpd 1
. 7 . 1221 . 1 1 2 ILE CG2 C 8.975 4.742 15.277 . . . 1.0 . . . . . . . . . . . . A . 2 ILE CG2 . . . . . . . . . rr_6wpd 1
. 7 . 1222 . 1 1 2 ILE H H 9.030 8.748 15.606 . . . 1.0 . . . . . . . . . . . . A . 2 ILE H . . . . . . . . . rr_6wpd 1
. 7 . 1223 . 1 1 2 ILE HA H 10.738 6.536 16.310 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HA . . . . . . . . . rr_6wpd 1
. 7 . 1224 . 1 1 2 ILE HB H 8.200 6.646 14.652 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HB . . . . . . . . . rr_6wpd 1
. 7 . 1225 . 1 1 2 ILE HD11 H 6.608 4.888 16.702 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HD11 . . . . . . . . . rr_6wpd 1
. 7 . 1226 . 1 1 2 ILE HD12 H 6.178 6.296 15.729 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HD12 . . . . . . . . . rr_6wpd 1
. 7 . 1227 . 1 1 2 ILE HD13 H 6.011 6.352 17.482 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HD13 . . . . . . . . . rr_6wpd 1
. 7 . 1228 . 1 1 2 ILE HG12 H 8.541 5.967 17.589 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HG12 . . . . . . . . . rr_6wpd 1
. 7 . 1229 . 1 1 2 ILE HG13 H 8.012 7.546 17.005 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HG13 . . . . . . . . . rr_6wpd 1
. 7 . 1230 . 1 1 2 ILE HG21 H 9.413 4.315 16.167 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HG21 . . . . . . . . . rr_6wpd 1
. 7 . 1231 . 1 1 2 ILE HG22 H 9.625 4.562 14.436 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HG22 . . . . . . . . . rr_6wpd 1
. 7 . 1232 . 1 1 2 ILE HG23 H 8.016 4.280 15.093 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HG23 . . . . . . . . . rr_6wpd 1
. 7 . 1233 . 1 1 2 ILE N N 9.907 8.367 15.805 . . . 1.0 . . . . . . . . . . . . A . 2 ILE N . . . . . . . . . rr_6wpd 1
. 7 . 1234 . 1 1 2 ILE O O 10.500 7.494 13.215 . . . 1.0 . . . . . . . . . . . . A . 2 ILE O . . . . . . . . . rr_6wpd 1
. 7 . 1235 . 1 1 3 LEU C C 11.742 5.543 11.723 . . . 1.0 . . . . . . . . . . . . A . 3 LEU C . . . . . . . . . rr_6wpd 1
. 7 . 1236 . 1 1 3 LEU CA C 12.650 5.752 12.931 . . . 1.0 . . . . . . . . . . . . A . 3 LEU CA . . . . . . . . . rr_6wpd 1
. 7 . 1237 . 1 1 3 LEU CB C 13.559 4.524 13.129 . . . 1.0 . . . . . . . . . . . . A . 3 LEU CB . . . . . . . . . rr_6wpd 1
. 7 . 1238 . 1 1 3 LEU CD1 C 15.377 5.483 11.660 . . . 1.0 . . . . . . . . . . . . A . 3 LEU CD1 . . . . . . . . . rr_6wpd 1
. 7 . 1239 . 1 1 3 LEU CD2 C 15.259 3.011 12.121 . . . 1.0 . . . . . . . . . . . . A . 3 LEU CD2 . . . . . . . . . rr_6wpd 1
. 7 . 1240 . 1 1 3 LEU CG C 14.436 4.285 11.892 . . . 1.0 . . . . . . . . . . . . A . 3 LEU CG . . . . . . . . . rr_6wpd 1
. 7 . 1241 . 1 1 3 LEU H H 12.106 5.468 14.958 . . . 1.0 . . . . . . . . . . . . A . 3 LEU H . . . . . . . . . rr_6wpd 1
. 7 . 1242 . 1 1 3 LEU HA H 13.273 6.616 12.761 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HA . . . . . . . . . rr_6wpd 1
. 7 . 1243 . 1 1 3 LEU HB2 H 14.197 4.694 13.983 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HB2 . . . . . . . . . rr_6wpd 1
. 7 . 1244 . 1 1 3 LEU HB3 H 12.951 3.647 13.309 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HB3 . . . . . . . . . rr_6wpd 1
. 7 . 1245 . 1 1 3 LEU HD11 H 15.676 5.905 12.609 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HD11 . . . . . . . . . rr_6wpd 1
. 7 . 1246 . 1 1 3 LEU HD12 H 14.863 6.236 11.081 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HD12 . . . . . . . . . rr_6wpd 1
. 7 . 1247 . 1 1 3 LEU HD13 H 16.257 5.158 11.118 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HD13 . . . . . . . . . rr_6wpd 1
. 7 . 1248 . 1 1 3 LEU HD21 H 14.593 2.176 12.276 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HD21 . . . . . . . . . rr_6wpd 1
. 7 . 1249 . 1 1 3 LEU HD22 H 15.885 3.139 12.991 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HD22 . . . . . . . . . rr_6wpd 1
. 7 . 1250 . 1 1 3 LEU HD23 H 15.878 2.822 11.257 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HD23 . . . . . . . . . rr_6wpd 1
. 7 . 1251 . 1 1 3 LEU HG H 13.808 4.151 11.024 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HG . . . . . . . . . rr_6wpd 1
. 7 . 1252 . 1 1 3 LEU N N 11.865 5.963 14.147 . . . 1.0 . . . . . . . . . . . . A . 3 LEU N . . . . . . . . . rr_6wpd 1
. 7 . 1253 . 1 1 3 LEU O O 12.088 5.921 10.605 . . . 1.0 . . . . . . . . . . . . A . 3 LEU O . . . . . . . . . rr_6wpd 1
. 7 . 1254 . 1 1 4 ASP C C 9.089 5.913 10.280 . . . 1.0 . . . . . . . . . . . . A . 4 ASP C . . . . . . . . . rr_6wpd 1
. 7 . 1255 . 1 1 4 ASP CA C 9.644 4.627 10.890 . . . 1.0 . . . . . . . . . . . . A . 4 ASP CA . . . . . . . . . rr_6wpd 1
. 7 . 1256 . 1 1 4 ASP CB C 8.506 3.771 11.483 . . . 1.0 . . . . . . . . . . . . A . 4 ASP CB . . . . . . . . . rr_6wpd 1
. 7 . 1257 . 1 1 4 ASP CG C 8.896 2.286 11.491 . . . 1.0 . . . . . . . . . . . . A . 4 ASP CG . . . . . . . . . rr_6wpd 1
. 7 . 1258 . 1 1 4 ASP H H 10.385 4.645 12.868 . . . 1.0 . . . . . . . . . . . . A . 4 ASP H . . . . . . . . . rr_6wpd 1
. 7 . 1259 . 1 1 4 ASP HA H 10.147 4.072 10.117 . . . 1.0 . . . . . . . . . . . . A . 4 ASP HA . . . . . . . . . rr_6wpd 1
. 7 . 1260 . 1 1 4 ASP HB2 H 8.309 4.088 12.496 . . . 1.0 . . . . . . . . . . . . A . 4 ASP HB2 . . . . . . . . . rr_6wpd 1
. 7 . 1261 . 1 1 4 ASP HB3 H 7.609 3.895 10.891 . . . 1.0 . . . . . . . . . . . . A . 4 ASP HB3 . . . . . . . . . rr_6wpd 1
. 7 . 1262 . 1 1 4 ASP N N 10.593 4.924 11.960 . . . 1.0 . . . . . . . . . . . . A . 4 ASP N . . . . . . . . . rr_6wpd 1
. 7 . 1263 . 1 1 4 ASP O O 8.943 6.018 9.059 . . . 1.0 . . . . . . . . . . . . A . 4 ASP O . . . . . . . . . rr_6wpd 1
. 7 . 1264 . 1 1 4 ASP OD1 O 9.944 1.957 10.959 . . . 1.0 . . . . . . . . . . . . A . 4 ASP OD1 . . . . . . . . . rr_6wpd 1
. 7 . 1265 . 1 1 4 ASP OD2 O 8.145 1.504 12.050 . . . 1.0 . . . . . . . . . . . . A . 4 ASP OD2 . . . . . . . . . rr_6wpd 1
. 7 . 1266 . 1 1 5 ALA C C 9.254 8.931 9.881 . . . 1.0 . . . . . . . . . . . . A . 5 ALA C . . . . . . . . . rr_6wpd 1
. 7 . 1267 . 1 1 5 ALA CA C 8.235 8.149 10.703 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CA . . . . . . . . . rr_6wpd 1
. 7 . 1268 . 1 1 5 ALA CB C 7.825 8.955 11.937 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CB . . . . . . . . . rr_6wpd 1
. 7 . 1269 . 1 1 5 ALA H H 8.925 6.719 12.092 . . . 1.0 . . . . . . . . . . . . A . 5 ALA H . . . . . . . . . rr_6wpd 1
. 7 . 1270 . 1 1 5 ALA HA H 7.361 7.968 10.102 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HA . . . . . . . . . rr_6wpd 1
. 7 . 1271 . 1 1 5 ALA HB1 H 6.997 8.459 12.423 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB1 . . . . . . . . . rr_6wpd 1
. 7 . 1272 . 1 1 5 ALA HB2 H 7.523 9.946 11.638 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB2 . . . . . . . . . rr_6wpd 1
. 7 . 1273 . 1 1 5 ALA HB3 H 8.656 9.022 12.627 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB3 . . . . . . . . . rr_6wpd 1
. 7 . 1274 . 1 1 5 ALA N N 8.785 6.872 11.140 . . . 1.0 . . . . . . . . . . . . A . 5 ALA N . . . . . . . . . rr_6wpd 1
. 7 . 1275 . 1 1 5 ALA O O 8.907 9.536 8.864 . . . 1.0 . . . . . . . . . . . . A . 5 ALA O . . . . . . . . . rr_6wpd 1
. 7 . 1276 . 1 1 6 ILE C C 11.791 9.072 8.243 . . . 1.0 . . . . . . . . . . . . A . 6 ILE C . . . . . . . . . rr_6wpd 1
. 7 . 1277 . 1 1 6 ILE CA C 11.583 9.618 9.652 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CA . . . . . . . . . rr_6wpd 1
. 7 . 1278 . 1 1 6 ILE CB C 12.856 9.459 10.489 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CB . . . . . . . . . rr_6wpd 1
. 7 . 1279 . 1 1 6 ILE CD1 C 13.795 9.847 12.774 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CD1 . . . . . . . . . rr_6wpd 1
. 7 . 1280 . 1 1 6 ILE CG1 C 12.693 10.248 11.791 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CG1 . . . . . . . . . rr_6wpd 1
. 7 . 1281 . 1 1 6 ILE CG2 C 14.071 9.981 9.721 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CG2 . . . . . . . . . rr_6wpd 1
. 7 . 1282 . 1 1 6 ILE H H 10.709 8.411 11.145 . . . 1.0 . . . . . . . . . . . . A . 6 ILE H . . . . . . . . . rr_6wpd 1
. 7 . 1283 . 1 1 6 ILE HA H 11.333 10.667 9.592 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HA . . . . . . . . . rr_6wpd 1
. 7 . 1284 . 1 1 6 ILE HB H 13.006 8.415 10.722 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HB . . . . . . . . . rr_6wpd 1
. 7 . 1285 . 1 1 6 ILE HD11 H 14.737 9.770 12.250 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HD11 . . . . . . . . . rr_6wpd 1
. 7 . 1286 . 1 1 6 ILE HD12 H 13.549 8.893 13.215 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HD12 . . . . . . . . . rr_6wpd 1
. 7 . 1287 . 1 1 6 ILE HD13 H 13.873 10.594 13.551 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HD13 . . . . . . . . . rr_6wpd 1
. 7 . 1288 . 1 1 6 ILE HG12 H 12.761 11.308 11.583 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG12 . . . . . . . . . rr_6wpd 1
. 7 . 1289 . 1 1 6 ILE HG13 H 11.730 10.029 12.225 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG13 . . . . . . . . . rr_6wpd 1
. 7 . 1290 . 1 1 6 ILE HG21 H 14.310 9.296 8.922 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG21 . . . . . . . . . rr_6wpd 1
. 7 . 1291 . 1 1 6 ILE HG22 H 14.913 10.054 10.395 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG22 . . . . . . . . . rr_6wpd 1
. 7 . 1292 . 1 1 6 ILE HG23 H 13.851 10.953 9.311 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG23 . . . . . . . . . rr_6wpd 1
. 7 . 1293 . 1 1 6 ILE N N 10.504 8.910 10.330 . . . 1.0 . . . . . . . . . . . . A . 6 ILE N . . . . . . . . . rr_6wpd 1
. 7 . 1294 . 1 1 6 ILE O O 11.972 9.836 7.293 . . . 1.0 . . . . . . . . . . . . A . 6 ILE O . . . . . . . . . rr_6wpd 1
. 7 . 1295 . 1 1 7 LYS C C 10.884 7.488 5.854 . . . 1.0 . . . . . . . . . . . . A . 7 LYS C . . . . . . . . . rr_6wpd 1
. 7 . 1296 . 1 1 7 LYS CA C 11.962 7.087 6.850 . . . 1.0 . . . . . . . . . . . . A . 7 LYS CA . . . . . . . . . rr_6wpd 1
. 7 . 1297 . 1 1 7 LYS CB C 11.933 5.581 7.099 . . . 1.0 . . . . . . . . . . . . A . 7 LYS CB . . . . . . . . . rr_6wpd 1
. 7 . 1298 . 1 1 7 LYS CD C 14.364 4.970 7.046 . . . 1.0 . . . . . . . . . . . . A . 7 LYS CD . . . . . . . . . rr_6wpd 1
. 7 . 1299 . 1 1 7 LYS CE C 15.571 4.531 7.865 . . . 1.0 . . . . . . . . . . . . A . 7 LYS CE . . . . . . . . . rr_6wpd 1
. 7 . 1300 . 1 1 7 LYS CG C 13.154 5.168 7.949 . . . 1.0 . . . . . . . . . . . . A . 7 LYS CG . . . . . . . . . rr_6wpd 1
. 7 . 1301 . 1 1 7 LYS H H 11.623 7.201 8.920 . . . 1.0 . . . . . . . . . . . . A . 7 LYS H . . . . . . . . . rr_6wpd 1
. 7 . 1302 . 1 1 7 LYS HA H 12.918 7.360 6.453 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HA . . . . . . . . . rr_6wpd 1
. 7 . 1303 . 1 1 7 LYS HB2 H 11.026 5.328 7.623 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HB2 . . . . . . . . . rr_6wpd 1
. 7 . 1304 . 1 1 7 LYS HB3 H 11.957 5.062 6.155 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HB3 . . . . . . . . . rr_6wpd 1
. 7 . 1305 . 1 1 7 LYS HD2 H 14.137 4.213 6.321 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HD2 . . . . . . . . . rr_6wpd 1
. 7 . 1306 . 1 1 7 LYS HD3 H 14.599 5.891 6.543 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HD3 . . . . . . . . . rr_6wpd 1
. 7 . 1307 . 1 1 7 LYS HE2 H 15.824 5.298 8.583 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HE2 . . . . . . . . . rr_6wpd 1
. 7 . 1308 . 1 1 7 LYS HE3 H 15.350 3.609 8.378 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HE3 . . . . . . . . . rr_6wpd 1
. 7 . 1309 . 1 1 7 LYS HG2 H 13.378 5.939 8.667 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HG2 . . . . . . . . . rr_6wpd 1
. 7 . 1310 . 1 1 7 LYS HG3 H 12.941 4.245 8.469 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HG3 . . . . . . . . . rr_6wpd 1
. 7 . 1311 . 1 1 7 LYS HZ1 H 16.568 4.910 6.083 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HZ1 . . . . . . . . . rr_6wpd 1
. 7 . 1312 . 1 1 7 LYS HZ2 H 16.752 3.322 6.658 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HZ2 . . . . . . . . . rr_6wpd 1
. 7 . 1313 . 1 1 7 LYS HZ3 H 17.594 4.600 7.396 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HZ3 . . . . . . . . . rr_6wpd 1
. 7 . 1314 . 1 1 7 LYS N N 11.769 7.750 8.127 . . . 1.0 . . . . . . . . . . . . A . 7 LYS N . . . . . . . . . rr_6wpd 1
. 7 . 1315 . 1 1 7 LYS NZ N 16.708 4.325 6.932 . . . 1.0 . . . . . . . . . . . . A . 7 LYS NZ . . . . . . . . . rr_6wpd 1
. 7 . 1316 . 1 1 7 LYS O O 11.170 7.722 4.680 . . . 1.0 . . . . . . . . . . . . A . 7 LYS O . . . . . . . . . rr_6wpd 1
. 7 . 1317 . 1 1 8 ALA C C 8.714 9.328 4.905 . . . 1.0 . . . . . . . . . . . . A . 8 ALA C . . . . . . . . . rr_6wpd 1
. 7 . 1318 . 1 1 8 ALA CA C 8.525 7.930 5.491 . . . 1.0 . . . . . . . . . . . . A . 8 ALA CA . . . . . . . . . rr_6wpd 1
. 7 . 1319 . 1 1 8 ALA CB C 7.248 7.873 6.337 . . . 1.0 . . . . . . . . . . . . A . 8 ALA CB . . . . . . . . . rr_6wpd 1
. 7 . 1320 . 1 1 8 ALA H H 9.492 7.363 7.277 . . . 1.0 . . . . . . . . . . . . A . 8 ALA H . . . . . . . . . rr_6wpd 1
. 7 . 1321 . 1 1 8 ALA HA H 8.438 7.218 4.687 . . . 1.0 . . . . . . . . . . . . A . 8 ALA HA . . . . . . . . . rr_6wpd 1
. 7 . 1322 . 1 1 8 ALA HB1 H 7.427 8.336 7.299 . . . 1.0 . . . . . . . . . . . . A . 8 ALA HB1 . . . . . . . . . rr_6wpd 1
. 7 . 1323 . 1 1 8 ALA HB2 H 6.969 6.841 6.485 . . . 1.0 . . . . . . . . . . . . A . 8 ALA HB2 . . . . . . . . . rr_6wpd 1
. 7 . 1324 . 1 1 8 ALA HB3 H 6.451 8.392 5.828 . . . 1.0 . . . . . . . . . . . . A . 8 ALA HB3 . . . . . . . . . rr_6wpd 1
. 7 . 1325 . 1 1 8 ALA N N 9.652 7.563 6.335 . . . 1.0 . . . . . . . . . . . . A . 8 ALA N . . . . . . . . . rr_6wpd 1
. 7 . 1326 . 1 1 8 ALA O O 8.463 9.555 3.714 . . . 1.0 . . . . . . . . . . . . A . 8 ALA O . . . . . . . . . rr_6wpd 1
. 7 . 1327 . 1 1 9 ILE C C 10.454 11.726 4.274 . . . 1.0 . . . . . . . . . . . . A . 9 ILE C . . . . . . . . . rr_6wpd 1
. 7 . 1328 . 1 1 9 ILE CA C 9.367 11.640 5.335 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CA . . . . . . . . . rr_6wpd 1
. 7 . 1329 . 1 1 9 ILE CB C 9.753 12.459 6.572 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CB . . . . . . . . . rr_6wpd 1
. 7 . 1330 . 1 1 9 ILE CD1 C 7.332 13.219 6.884 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CD1 . . . . . . . . . rr_6wpd 1
. 7 . 1331 . 1 1 9 ILE CG1 C 8.550 12.524 7.529 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CG1 . . . . . . . . . rr_6wpd 1
. 7 . 1332 . 1 1 9 ILE CG2 C 10.179 13.874 6.179 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CG2 . . . . . . . . . rr_6wpd 1
. 7 . 1333 . 1 1 9 ILE H H 9.330 10.009 6.678 . . . 1.0 . . . . . . . . . . . . A . 9 ILE H . . . . . . . . . rr_6wpd 1
. 7 . 1334 . 1 1 9 ILE HA H 8.452 12.030 4.925 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HA . . . . . . . . . rr_6wpd 1
. 7 . 1335 . 1 1 9 ILE HB H 10.579 11.974 7.077 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HB . . . . . . . . . rr_6wpd 1
. 7 . 1336 . 1 1 9 ILE HD11 H 7.652 13.938 6.143 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HD11 . . . . . . . . . rr_6wpd 1
. 7 . 1337 . 1 1 9 ILE HD12 H 6.762 13.725 7.651 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HD12 . . . . . . . . . rr_6wpd 1
. 7 . 1338 . 1 1 9 ILE HD13 H 6.706 12.474 6.413 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HD13 . . . . . . . . . rr_6wpd 1
. 7 . 1339 . 1 1 9 ILE HG12 H 8.270 11.520 7.798 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG12 . . . . . . . . . rr_6wpd 1
. 7 . 1340 . 1 1 9 ILE HG13 H 8.835 13.062 8.421 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG13 . . . . . . . . . rr_6wpd 1
. 7 . 1341 . 1 1 9 ILE HG21 H 11.144 13.841 5.696 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG21 . . . . . . . . . rr_6wpd 1
. 7 . 1342 . 1 1 9 ILE HG22 H 10.240 14.485 7.068 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG22 . . . . . . . . . rr_6wpd 1
. 7 . 1343 . 1 1 9 ILE HG23 H 9.450 14.291 5.505 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG23 . . . . . . . . . rr_6wpd 1
. 7 . 1344 . 1 1 9 ILE N N 9.151 10.257 5.750 . . . 1.0 . . . . . . . . . . . . A . 9 ILE N . . . . . . . . . rr_6wpd 1
. 7 . 1345 . 1 1 9 ILE O O 10.312 12.447 3.284 . . . 1.0 . . . . . . . . . . . . A . 9 ILE O . . . . . . . . . rr_6wpd 1
. 7 . 1346 . 1 1 10 ALA C C 12.230 10.470 2.200 . . . 1.0 . . . . . . . . . . . . A . 10 ALA C . . . . . . . . . rr_6wpd 1
. 7 . 1347 . 1 1 10 ALA CA C 12.654 10.978 3.572 . . . 1.0 . . . . . . . . . . . . A . 10 ALA CA . . . . . . . . . rr_6wpd 1
. 7 . 1348 . 1 1 10 ALA CB C 13.756 10.087 4.150 . . . 1.0 . . . . . . . . . . . . A . 10 ALA CB . . . . . . . . . rr_6wpd 1
. 7 . 1349 . 1 1 10 ALA H H 11.577 10.440 5.303 . . . 1.0 . . . . . . . . . . . . A . 10 ALA H . . . . . . . . . rr_6wpd 1
. 7 . 1350 . 1 1 10 ALA HA H 13.036 11.978 3.471 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HA . . . . . . . . . rr_6wpd 1
. 7 . 1351 . 1 1 10 ALA HB1 H 13.405 9.065 4.213 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB1 . . . . . . . . . rr_6wpd 1
. 7 . 1352 . 1 1 10 ALA HB2 H 14.012 10.440 5.138 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB2 . . . . . . . . . rr_6wpd 1
. 7 . 1353 . 1 1 10 ALA HB3 H 14.626 10.131 3.515 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB3 . . . . . . . . . rr_6wpd 1
. 7 . 1354 . 1 1 10 ALA N N 11.531 10.989 4.496 . . . 1.0 . . . . . . . . . . . . A . 10 ALA N . . . . . . . . . rr_6wpd 1
. 7 . 1355 . 1 1 10 ALA O O 12.654 11.000 1.171 . . . 1.0 . . . . . . . . . . . . A . 10 ALA O . . . . . . . . . rr_6wpd 1
. 7 . 1356 . 1 1 11 LYS C C 10.151 9.846 0.122 . . . 1.0 . . . . . . . . . . . . A . 11 LYS C . . . . . . . . . rr_6wpd 1
. 7 . 1357 . 1 1 11 LYS CA C 10.917 8.842 0.969 . . . 1.0 . . . . . . . . . . . . A . 11 LYS CA . . . . . . . . . rr_6wpd 1
. 7 . 1358 . 1 1 11 LYS CB C 10.023 7.670 1.343 . . . 1.0 . . . . . . . . . . . . A . 11 LYS CB . . . . . . . . . rr_6wpd 1
. 7 . 1359 . 1 1 11 LYS CD C 11.468 5.687 0.823 . . . 1.0 . . . . . . . . . . . . A . 11 LYS CD . . . . . . . . . rr_6wpd 1
. 7 . 1360 . 1 1 11 LYS CE C 12.287 4.541 1.401 . . . 1.0 . . . . . . . . . . . . A . 11 LYS CE . . . . . . . . . rr_6wpd 1
. 7 . 1361 . 1 1 11 LYS CG C 10.881 6.538 1.942 . . . 1.0 . . . . . . . . . . . . A . 11 LYS CG . . . . . . . . . rr_6wpd 1
. 7 . 1362 . 1 1 11 LYS H H 11.101 9.066 3.051 . . . 1.0 . . . . . . . . . . . . A . 11 LYS H . . . . . . . . . rr_6wpd 1
. 7 . 1363 . 1 1 11 LYS HA H 11.745 8.472 0.413 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HA . . . . . . . . . rr_6wpd 1
. 7 . 1364 . 1 1 11 LYS HB2 H 9.302 8.001 2.071 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HB2 . . . . . . . . . rr_6wpd 1
. 7 . 1365 . 1 1 11 LYS HB3 H 9.510 7.312 0.466 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HB3 . . . . . . . . . rr_6wpd 1
. 7 . 1366 . 1 1 11 LYS HD2 H 10.668 5.284 0.226 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HD2 . . . . . . . . . rr_6wpd 1
. 7 . 1367 . 1 1 11 LYS HD3 H 12.103 6.292 0.206 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HD3 . . . . . . . . . rr_6wpd 1
. 7 . 1368 . 1 1 11 LYS HE2 H 13.106 4.935 1.987 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HE2 . . . . . . . . . rr_6wpd 1
. 7 . 1369 . 1 1 11 LYS HE3 H 11.661 3.917 2.018 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HE3 . . . . . . . . . rr_6wpd 1
. 7 . 1370 . 1 1 11 LYS HG2 H 11.686 6.956 2.531 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HG2 . . . . . . . . . rr_6wpd 1
. 7 . 1371 . 1 1 11 LYS HG3 H 10.269 5.921 2.568 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HG3 . . . . . . . . . rr_6wpd 1
. 7 . 1372 . 1 1 11 LYS HZ1 H 12.648 4.259 -0.625 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HZ1 . . . . . . . . . rr_6wpd 1
. 7 . 1373 . 1 1 11 LYS HZ2 H 12.343 2.824 0.233 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HZ2 . . . . . . . . . rr_6wpd 1
. 7 . 1374 . 1 1 11 LYS HZ3 H 13.843 3.608 0.387 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HZ3 . . . . . . . . . rr_6wpd 1
. 7 . 1375 . 1 1 11 LYS N N 11.396 9.441 2.200 . . . 1.0 . . . . . . . . . . . . A . 11 LYS N . . . . . . . . . rr_6wpd 1
. 7 . 1376 . 1 1 11 LYS NZ N 12.821 3.746 0.265 . . . 1.0 . . . . . . . . . . . . A . 11 LYS NZ . . . . . . . . . rr_6wpd 1
. 7 . 1377 . 1 1 11 LYS O O 10.335 9.913 -1.095 . . . 1.0 . . . . . . . . . . . . A . 11 LYS O . . . . . . . . . rr_6wpd 1
. 7 . 1378 . 1 1 12 ALA C C 9.386 12.725 -0.487 . . . 1.0 . . . . . . . . . . . . A . 12 ALA C . . . . . . . . . rr_6wpd 1
. 7 . 1379 . 1 1 12 ALA CA C 8.499 11.628 0.099 . . . 1.0 . . . . . . . . . . . . A . 12 ALA CA . . . . . . . . . rr_6wpd 1
. 7 . 1380 . 1 1 12 ALA CB C 7.512 12.227 1.102 . . . 1.0 . . . . . . . . . . . . A . 12 ALA CB . . . . . . . . . rr_6wpd 1
. 7 . 1381 . 1 1 12 ALA H H 9.202 10.511 1.750 . . . 1.0 . . . . . . . . . . . . A . 12 ALA H . . . . . . . . . rr_6wpd 1
. 7 . 1382 . 1 1 12 ALA HA H 7.943 11.160 -0.696 . . . 1.0 . . . . . . . . . . . . A . 12 ALA HA . . . . . . . . . rr_6wpd 1
. 7 . 1383 . 1 1 12 ALA HB1 H 6.994 11.425 1.609 . . . 1.0 . . . . . . . . . . . . A . 12 ALA HB1 . . . . . . . . . rr_6wpd 1
. 7 . 1384 . 1 1 12 ALA HB2 H 6.799 12.843 0.581 . . . 1.0 . . . . . . . . . . . . A . 12 ALA HB2 . . . . . . . . . rr_6wpd 1
. 7 . 1385 . 1 1 12 ALA HB3 H 8.045 12.825 1.830 . . . 1.0 . . . . . . . . . . . . A . 12 ALA HB3 . . . . . . . . . rr_6wpd 1
. 7 . 1386 . 1 1 12 ALA N N 9.300 10.621 0.780 . . . 1.0 . . . . . . . . . . . . A . 12 ALA N . . . . . . . . . rr_6wpd 1
. 7 . 1387 . 1 1 12 ALA O O 9.149 13.196 -1.603 . . . 1.0 . . . . . . . . . . . . A . 12 ALA O . . . . . . . . . rr_6wpd 1
. 7 . 1388 . 1 1 13 ALA C C 12.093 13.762 -1.385 . . . 1.0 . . . . . . . . . . . . A . 13 ALA C . . . . . . . . . rr_6wpd 1
. 7 . 1389 . 1 1 13 ALA CA C 11.319 14.170 -0.138 . . . 1.0 . . . . . . . . . . . . A . 13 ALA CA . . . . . . . . . rr_6wpd 1
. 7 . 1390 . 1 1 13 ALA CB C 12.288 14.463 1.008 . . . 1.0 . . . . . . . . . . . . A . 13 ALA CB . . . . . . . . . rr_6wpd 1
. 7 . 1391 . 1 1 13 ALA H H 10.517 12.710 1.157 . . . 1.0 . . . . . . . . . . . . A . 13 ALA H . . . . . . . . . rr_6wpd 1
. 7 . 1392 . 1 1 13 ALA HA H 10.759 15.064 -0.351 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HA . . . . . . . . . rr_6wpd 1
. 7 . 1393 . 1 1 13 ALA HB1 H 12.853 13.572 1.244 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB1 . . . . . . . . . rr_6wpd 1
. 7 . 1394 . 1 1 13 ALA HB2 H 11.725 14.771 1.878 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB2 . . . . . . . . . rr_6wpd 1
. 7 . 1395 . 1 1 13 ALA HB3 H 12.961 15.254 0.718 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB3 . . . . . . . . . rr_6wpd 1
. 7 . 1396 . 1 1 13 ALA N N 10.396 13.123 0.282 . . . 1.0 . . . . . . . . . . . . A . 13 ALA N . . . . . . . . . rr_6wpd 1
. 7 . 1397 . 1 1 13 ALA O O 12.313 14.581 -2.281 . . . 1.0 . . . . . . . . . . . . A . 13 ALA O . . . . . . . . . rr_6wpd 1
. 7 . 1398 . 1 1 14 GLY C C 13.144 10.465 -2.646 . . . 1.0 . . . . . . . . . . . . A . 14 GLY C . . . . . . . . . rr_6wpd 1
. 7 . 1399 . 1 1 14 GLY CA C 13.247 11.981 -2.579 . . . 1.0 . . . . . . . . . . . . A . 14 GLY CA . . . . . . . . . rr_6wpd 1
. 7 . 1400 . 1 1 14 GLY H H 12.291 11.900 -0.693 . . . 1.0 . . . . . . . . . . . . A . 14 GLY H . . . . . . . . . rr_6wpd 1
. 7 . 1401 . 1 1 14 GLY HA2 H 12.846 12.404 -3.487 . . . 1.0 . . . . . . . . . . . . A . 14 GLY HA2 . . . . . . . . . rr_6wpd 1
. 7 . 1402 . 1 1 14 GLY HA3 H 14.284 12.259 -2.482 . . . 1.0 . . . . . . . . . . . . A . 14 GLY HA3 . . . . . . . . . rr_6wpd 1
. 7 . 1403 . 1 1 14 GLY N N 12.498 12.497 -1.437 . . . 1.0 . . . . . . . . . . . . A . 14 GLY N . . . . . . . . . rr_6wpd 1
. 7 . 1404 . 1 1 14 GLY O O 13.482 9.859 -3.664 . . . 1.0 . . . . . . . . . . . . A . 14 GLY O . . . . . . . . . rr_6wpd 1
. 7 . 1405 . 1 1 15 NH2 HN1 H 12.427 10.299 -0.806 . . . 1.0 . . . . . . . . . . . . A . 15 NH2 HN1 . . . . . . . . . rr_6wpd 1
. 7 . 1406 . 1 1 15 NH2 HN2 H 12.616 8.834 -1.642 . . . 1.0 . . . . . . . . . . . . A . 15 NH2 HN2 . . . . . . . . . rr_6wpd 1
. 7 . 1407 . 1 1 15 NH2 N N 12.693 9.812 -1.613 . . . 1.0 . . . . . . . . . . . . A . 15 NH2 N . . . . . . . . . rr_6wpd 1
. 8 . 1408 . 1 1 1 GLY C C 10.912 9.098 16.312 . . . 1.0 . . . . . . . . . . . . A . 1 GLY C . . . . . . . . . rr_6wpd 1
. 8 . 1409 . 1 1 1 GLY CA C 10.580 10.559 16.596 . . . 1.0 . . . . . . . . . . . . A . 1 GLY CA . . . . . . . . . rr_6wpd 1
. 8 . 1410 . 1 1 1 GLY H1 H 10.375 11.067 14.584 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H1 . . . . . . . . . rr_6wpd 1
. 8 . 1411 . 1 1 1 GLY H2 H 9.597 12.135 15.652 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H2 . . . . . . . . . rr_6wpd 1
. 8 . 1412 . 1 1 1 GLY H3 H 8.923 10.609 15.332 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H3 . . . . . . . . . rr_6wpd 1
. 8 . 1413 . 1 1 1 GLY HA2 H 11.492 11.119 16.737 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA2 . . . . . . . . . rr_6wpd 1
. 8 . 1414 . 1 1 1 GLY HA3 H 9.980 10.616 17.493 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA3 . . . . . . . . . rr_6wpd 1
. 8 . 1415 . 1 1 1 GLY N N 9.811 11.136 15.454 . . . 1.0 . . . . . . . . . . . . A . 1 GLY N . . . . . . . . . rr_6wpd 1
. 8 . 1416 . 1 1 1 GLY O O 12.031 8.646 16.554 . . . 1.0 . . . . . . . . . . . . A . 1 GLY O . . . . . . . . . rr_6wpd 1
. 8 . 1417 . 1 1 2 ILE C C 10.804 6.817 14.154 . . . 1.0 . . . . . . . . . . . . A . 2 ILE C . . . . . . . . . rr_6wpd 1
. 8 . 1418 . 1 1 2 ILE CA C 10.096 6.956 15.495 . . . 1.0 . . . . . . . . . . . . A . 2 ILE CA . . . . . . . . . rr_6wpd 1
. 8 . 1419 . 1 1 2 ILE CB C 8.716 6.288 15.449 . . . 1.0 . . . . . . . . . . . . A . 2 ILE CB . . . . . . . . . rr_6wpd 1
. 8 . 1420 . 1 1 2 ILE CD1 C 6.539 6.069 16.651 . . . 1.0 . . . . . . . . . . . . A . 2 ILE CD1 . . . . . . . . . rr_6wpd 1
. 8 . 1421 . 1 1 2 ILE CG1 C 7.993 6.528 16.776 . . . 1.0 . . . . . . . . . . . . A . 2 ILE CG1 . . . . . . . . . rr_6wpd 1
. 8 . 1422 . 1 1 2 ILE CG2 C 8.863 4.780 15.233 . . . 1.0 . . . . . . . . . . . . A . 2 ILE CG2 . . . . . . . . . rr_6wpd 1
. 8 . 1423 . 1 1 2 ILE H H 9.059 8.787 15.640 . . . 1.0 . . . . . . . . . . . . A . 2 ILE H . . . . . . . . . rr_6wpd 1
. 8 . 1424 . 1 1 2 ILE HA H 10.693 6.482 16.262 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HA . . . . . . . . . rr_6wpd 1
. 8 . 1425 . 1 1 2 ILE HB H 8.138 6.713 14.642 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HB . . . . . . . . . rr_6wpd 1
. 8 . 1426 . 1 1 2 ILE HD11 H 6.515 5.025 16.377 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HD11 . . . . . . . . . rr_6wpd 1
. 8 . 1427 . 1 1 2 ILE HD12 H 6.041 6.652 15.890 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HD12 . . . . . . . . . rr_6wpd 1
. 8 . 1428 . 1 1 2 ILE HD13 H 6.035 6.206 17.596 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HD13 . . . . . . . . . rr_6wpd 1
. 8 . 1429 . 1 1 2 ILE HG12 H 8.482 5.971 17.562 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HG12 . . . . . . . . . rr_6wpd 1
. 8 . 1430 . 1 1 2 ILE HG13 H 8.013 7.582 17.013 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HG13 . . . . . . . . . rr_6wpd 1
. 8 . 1431 . 1 1 2 ILE HG21 H 9.429 4.598 14.340 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HG21 . . . . . . . . . rr_6wpd 1
. 8 . 1432 . 1 1 2 ILE HG22 H 7.883 4.333 15.135 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HG22 . . . . . . . . . rr_6wpd 1
. 8 . 1433 . 1 1 2 ILE HG23 H 9.374 4.344 16.078 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HG23 . . . . . . . . . rr_6wpd 1
. 8 . 1434 . 1 1 2 ILE N N 9.926 8.368 15.807 . . . 1.0 . . . . . . . . . . . . A . 2 ILE N . . . . . . . . . rr_6wpd 1
. 8 . 1435 . 1 1 2 ILE O O 10.469 7.509 13.197 . . . 1.0 . . . . . . . . . . . . A . 2 ILE O . . . . . . . . . rr_6wpd 1
. 8 . 1436 . 1 1 3 LEU C C 11.638 5.528 11.679 . . . 1.0 . . . . . . . . . . . . A . 3 LEU C . . . . . . . . . rr_6wpd 1
. 8 . 1437 . 1 1 3 LEU CA C 12.561 5.698 12.879 . . . 1.0 . . . . . . . . . . . . A . 3 LEU CA . . . . . . . . . rr_6wpd 1
. 8 . 1438 . 1 1 3 LEU CB C 13.432 4.442 13.049 . . . 1.0 . . . . . . . . . . . . A . 3 LEU CB . . . . . . . . . rr_6wpd 1
. 8 . 1439 . 1 1 3 LEU CD1 C 15.044 5.321 11.318 . . . 1.0 . . . . . . . . . . . . A . 3 LEU CD1 . . . . . . . . . rr_6wpd 1
. 8 . 1440 . 1 1 3 LEU CD2 C 15.089 2.902 12.003 . . . 1.0 . . . . . . . . . . . . A . 3 LEU CD2 . . . . . . . . . rr_6wpd 1
. 8 . 1441 . 1 1 3 LEU CG C 14.189 4.118 11.750 . . . 1.0 . . . . . . . . . . . . A . 3 LEU CG . . . . . . . . . rr_6wpd 1
. 8 . 1442 . 1 1 3 LEU H H 12.002 5.409 14.907 . . . 1.0 . . . . . . . . . . . . A . 3 LEU H . . . . . . . . . rr_6wpd 1
. 8 . 1443 . 1 1 3 LEU HA H 13.204 6.548 12.709 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HA . . . . . . . . . rr_6wpd 1
. 8 . 1444 . 1 1 3 LEU HB2 H 14.146 4.608 13.840 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HB2 . . . . . . . . . rr_6wpd 1
. 8 . 1445 . 1 1 3 LEU HB3 H 12.802 3.603 13.309 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HB3 . . . . . . . . . rr_6wpd 1
. 8 . 1446 . 1 1 3 LEU HD11 H 15.851 4.984 10.682 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HD11 . . . . . . . . . rr_6wpd 1
. 8 . 1447 . 1 1 3 LEU HD12 H 15.455 5.807 12.190 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HD12 . . . . . . . . . rr_6wpd 1
. 8 . 1448 . 1 1 3 LEU HD13 H 14.428 6.020 10.772 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HD13 . . . . . . . . . rr_6wpd 1
. 8 . 1449 . 1 1 3 LEU HD21 H 15.480 2.537 11.065 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HD21 . . . . . . . . . rr_6wpd 1
. 8 . 1450 . 1 1 3 LEU HD22 H 14.512 2.124 12.480 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HD22 . . . . . . . . . rr_6wpd 1
. 8 . 1451 . 1 1 3 LEU HD23 H 15.907 3.188 12.649 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HD23 . . . . . . . . . rr_6wpd 1
. 8 . 1452 . 1 1 3 LEU HG H 13.483 3.881 10.967 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HG . . . . . . . . . rr_6wpd 1
. 8 . 1453 . 1 1 3 LEU N N 11.787 5.924 14.102 . . . 1.0 . . . . . . . . . . . . A . 3 LEU N . . . . . . . . . rr_6wpd 1
. 8 . 1454 . 1 1 3 LEU O O 11.979 5.904 10.559 . . . 1.0 . . . . . . . . . . . . A . 3 LEU O . . . . . . . . . rr_6wpd 1
. 8 . 1455 . 1 1 4 ASP C C 8.999 6.011 10.263 . . . 1.0 . . . . . . . . . . . . A . 4 ASP C . . . . . . . . . rr_6wpd 1
. 8 . 1456 . 1 1 4 ASP CA C 9.491 4.707 10.883 . . . 1.0 . . . . . . . . . . . . A . 4 ASP CA . . . . . . . . . rr_6wpd 1
. 8 . 1457 . 1 1 4 ASP CB C 8.306 3.941 11.485 . . . 1.0 . . . . . . . . . . . . A . 4 ASP CB . . . . . . . . . rr_6wpd 1
. 8 . 1458 . 1 1 4 ASP CG C 8.731 2.510 11.799 . . . 1.0 . . . . . . . . . . . . A . 4 ASP CG . . . . . . . . . rr_6wpd 1
. 8 . 1459 . 1 1 4 ASP H H 10.271 4.684 12.850 . . . 1.0 . . . . . . . . . . . . A . 4 ASP H . . . . . . . . . rr_6wpd 1
. 8 . 1460 . 1 1 4 ASP HA H 9.941 4.103 10.112 . . . 1.0 . . . . . . . . . . . . A . 4 ASP HA . . . . . . . . . rr_6wpd 1
. 8 . 1461 . 1 1 4 ASP HB2 H 7.988 4.431 12.395 . . . 1.0 . . . . . . . . . . . . A . 4 ASP HB2 . . . . . . . . . rr_6wpd 1
. 8 . 1462 . 1 1 4 ASP HB3 H 7.486 3.925 10.781 . . . 1.0 . . . . . . . . . . . . A . 4 ASP HB3 . . . . . . . . . rr_6wpd 1
. 8 . 1463 . 1 1 4 ASP N N 10.475 4.954 11.932 . . . 1.0 . . . . . . . . . . . . A . 4 ASP N . . . . . . . . . rr_6wpd 1
. 8 . 1464 . 1 1 4 ASP O O 8.879 6.125 9.043 . . . 1.0 . . . . . . . . . . . . A . 4 ASP O . . . . . . . . . rr_6wpd 1
. 8 . 1465 . 1 1 4 ASP OD1 O 9.792 2.118 11.343 . . . 1.0 . . . . . . . . . . . . A . 4 ASP OD1 . . . . . . . . . rr_6wpd 1
. 8 . 1466 . 1 1 4 ASP OD2 O 7.992 1.828 12.489 . . . 1.0 . . . . . . . . . . . . A . 4 ASP OD2 . . . . . . . . . rr_6wpd 1
. 8 . 1467 . 1 1 5 ALA C C 9.289 9.031 9.861 . . . 1.0 . . . . . . . . . . . . A . 5 ALA C . . . . . . . . . rr_6wpd 1
. 8 . 1468 . 1 1 5 ALA CA C 8.225 8.284 10.664 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CA . . . . . . . . . rr_6wpd 1
. 8 . 1469 . 1 1 5 ALA CB C 7.832 9.127 11.885 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CB . . . . . . . . . rr_6wpd 1
. 8 . 1470 . 1 1 5 ALA H H 8.835 6.823 12.074 . . . 1.0 . . . . . . . . . . . . A . 5 ALA H . . . . . . . . . rr_6wpd 1
. 8 . 1471 . 1 1 5 ALA HA H 7.353 8.139 10.046 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HA . . . . . . . . . rr_6wpd 1
. 8 . 1472 . 1 1 5 ALA HB1 H 7.515 10.109 11.563 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB1 . . . . . . . . . rr_6wpd 1
. 8 . 1473 . 1 1 5 ALA HB2 H 8.683 9.223 12.545 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB2 . . . . . . . . . rr_6wpd 1
. 8 . 1474 . 1 1 5 ALA HB3 H 7.023 8.643 12.412 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB3 . . . . . . . . . rr_6wpd 1
. 8 . 1475 . 1 1 5 ALA N N 8.715 6.983 11.115 . . . 1.0 . . . . . . . . . . . . A . 5 ALA N . . . . . . . . . rr_6wpd 1
. 8 . 1476 . 1 1 5 ALA O O 8.987 9.664 8.850 . . . 1.0 . . . . . . . . . . . . A . 5 ALA O . . . . . . . . . rr_6wpd 1
. 8 . 1477 . 1 1 6 ILE C C 11.863 9.064 8.256 . . . 1.0 . . . . . . . . . . . . A . 6 ILE C . . . . . . . . . rr_6wpd 1
. 8 . 1478 . 1 1 6 ILE CA C 11.648 9.611 9.663 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CA . . . . . . . . . rr_6wpd 1
. 8 . 1479 . 1 1 6 ILE CB C 12.907 9.396 10.513 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CB . . . . . . . . . rr_6wpd 1
. 8 . 1480 . 1 1 6 ILE CD1 C 13.814 9.736 12.825 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CD1 . . . . . . . . . rr_6wpd 1
. 8 . 1481 . 1 1 6 ILE CG1 C 12.755 10.182 11.817 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CG1 . . . . . . . . . rr_6wpd 1
. 8 . 1482 . 1 1 6 ILE CG2 C 14.154 9.875 9.764 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CG2 . . . . . . . . . rr_6wpd 1
. 8 . 1483 . 1 1 6 ILE H H 10.695 8.420 11.133 . . . 1.0 . . . . . . . . . . . . A . 6 ILE H . . . . . . . . . rr_6wpd 1
. 8 . 1484 . 1 1 6 ILE HA H 11.442 10.668 9.602 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HA . . . . . . . . . rr_6wpd 1
. 8 . 1485 . 1 1 6 ILE HB H 13.010 8.344 10.741 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HB . . . . . . . . . rr_6wpd 1
. 8 . 1486 . 1 1 6 ILE HD11 H 14.764 9.621 12.326 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HD11 . . . . . . . . . rr_6wpd 1
. 8 . 1487 . 1 1 6 ILE HD12 H 13.518 8.794 13.260 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HD12 . . . . . . . . . rr_6wpd 1
. 8 . 1488 . 1 1 6 ILE HD13 H 13.903 10.478 13.603 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HD13 . . . . . . . . . rr_6wpd 1
. 8 . 1489 . 1 1 6 ILE HG12 H 12.874 11.236 11.613 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG12 . . . . . . . . . rr_6wpd 1
. 8 . 1490 . 1 1 6 ILE HG13 H 11.772 10.005 12.230 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG13 . . . . . . . . . rr_6wpd 1
. 8 . 1491 . 1 1 6 ILE HG21 H 13.956 10.831 9.308 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG21 . . . . . . . . . rr_6wpd 1
. 8 . 1492 . 1 1 6 ILE HG22 H 14.414 9.157 8.999 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG22 . . . . . . . . . rr_6wpd 1
. 8 . 1493 . 1 1 6 ILE HG23 H 14.978 9.971 10.459 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG23 . . . . . . . . . rr_6wpd 1
. 8 . 1494 . 1 1 6 ILE N N 10.526 8.945 10.323 . . . 1.0 . . . . . . . . . . . . A . 6 ILE N . . . . . . . . . rr_6wpd 1
. 8 . 1495 . 1 1 6 ILE O O 12.105 9.816 7.312 . . . 1.0 . . . . . . . . . . . . A . 6 ILE O . . . . . . . . . rr_6wpd 1
. 8 . 1496 . 1 1 7 LYS C C 10.919 7.479 5.846 . . . 1.0 . . . . . . . . . . . . A . 7 LYS C . . . . . . . . . rr_6wpd 1
. 8 . 1497 . 1 1 7 LYS CA C 11.971 7.074 6.868 . . . 1.0 . . . . . . . . . . . . A . 7 LYS CA . . . . . . . . . rr_6wpd 1
. 8 . 1498 . 1 1 7 LYS CB C 11.888 5.574 7.135 . . . 1.0 . . . . . . . . . . . . A . 7 LYS CB . . . . . . . . . rr_6wpd 1
. 8 . 1499 . 1 1 7 LYS CD C 14.234 4.746 6.943 . . . 1.0 . . . . . . . . . . . . A . 7 LYS CD . . . . . . . . . rr_6wpd 1
. 8 . 1500 . 1 1 7 LYS CE C 15.519 4.395 7.685 . . . 1.0 . . . . . . . . . . . . A . 7 LYS CE . . . . . . . . . rr_6wpd 1
. 8 . 1501 . 1 1 7 LYS CG C 13.128 5.122 7.923 . . . 1.0 . . . . . . . . . . . . A . 7 LYS CG . . . . . . . . . rr_6wpd 1
. 8 . 1502 . 1 1 7 LYS H H 11.584 7.218 8.935 . . . 1.0 . . . . . . . . . . . . A . 7 LYS H . . . . . . . . . rr_6wpd 1
. 8 . 1503 . 1 1 7 LYS HA H 12.945 7.308 6.484 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HA . . . . . . . . . rr_6wpd 1
. 8 . 1504 . 1 1 7 LYS HB2 H 11.003 5.374 7.714 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HB2 . . . . . . . . . rr_6wpd 1
. 8 . 1505 . 1 1 7 LYS HB3 H 11.828 5.041 6.197 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HB3 . . . . . . . . . rr_6wpd 1
. 8 . 1506 . 1 1 7 LYS HD2 H 13.912 3.897 6.371 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HD2 . . . . . . . . . rr_6wpd 1
. 8 . 1507 . 1 1 7 LYS HD3 H 14.424 5.570 6.275 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HD3 . . . . . . . . . rr_6wpd 1
. 8 . 1508 . 1 1 7 LYS HE2 H 15.872 5.255 8.241 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HE2 . . . . . . . . . rr_6wpd 1
. 8 . 1509 . 1 1 7 LYS HE3 H 15.344 3.571 8.359 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HE3 . . . . . . . . . rr_6wpd 1
. 8 . 1510 . 1 1 7 LYS HG2 H 13.475 5.923 8.555 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HG2 . . . . . . . . . rr_6wpd 1
. 8 . 1511 . 1 1 7 LYS HG3 H 12.878 4.269 8.531 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HG3 . . . . . . . . . rr_6wpd 1
. 8 . 1512 . 1 1 7 LYS HZ1 H 17.296 4.701 6.647 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HZ1 . . . . . . . . . rr_6wpd 1
. 8 . 1513 . 1 1 7 LYS HZ2 H 16.064 3.973 5.732 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HZ2 . . . . . . . . . rr_6wpd 1
. 8 . 1514 . 1 1 7 LYS HZ3 H 16.908 3.067 6.895 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HZ3 . . . . . . . . . rr_6wpd 1
. 8 . 1515 . 1 1 7 LYS N N 11.781 7.754 8.140 . . . 1.0 . . . . . . . . . . . . A . 7 LYS N . . . . . . . . . rr_6wpd 1
. 8 . 1516 . 1 1 7 LYS NZ N 16.527 4.005 6.665 . . . 1.0 . . . . . . . . . . . . A . 7 LYS NZ . . . . . . . . . rr_6wpd 1
. 8 . 1517 . 1 1 7 LYS O O 11.226 7.718 4.678 . . . 1.0 . . . . . . . . . . . . A . 7 LYS O . . . . . . . . . rr_6wpd 1
. 8 . 1518 . 1 1 8 ALA C C 8.756 9.333 4.879 . . . 1.0 . . . . . . . . . . . . A . 8 ALA C . . . . . . . . . rr_6wpd 1
. 8 . 1519 . 1 1 8 ALA CA C 8.576 7.920 5.427 . . . 1.0 . . . . . . . . . . . . A . 8 ALA CA . . . . . . . . . rr_6wpd 1
. 8 . 1520 . 1 1 8 ALA CB C 7.271 7.840 6.222 . . . 1.0 . . . . . . . . . . . . A . 8 ALA CB . . . . . . . . . rr_6wpd 1
. 8 . 1521 . 1 1 8 ALA H H 9.502 7.351 7.240 . . . 1.0 . . . . . . . . . . . . A . 8 ALA H . . . . . . . . . rr_6wpd 1
. 8 . 1522 . 1 1 8 ALA HA H 8.529 7.224 4.602 . . . 1.0 . . . . . . . . . . . . A . 8 ALA HA . . . . . . . . . rr_6wpd 1
. 8 . 1523 . 1 1 8 ALA HB1 H 7.012 6.805 6.386 . . . 1.0 . . . . . . . . . . . . A . 8 ALA HB1 . . . . . . . . . rr_6wpd 1
. 8 . 1524 . 1 1 8 ALA HB2 H 6.480 8.327 5.671 . . . 1.0 . . . . . . . . . . . . A . 8 ALA HB2 . . . . . . . . . rr_6wpd 1
. 8 . 1525 . 1 1 8 ALA HB3 H 7.402 8.332 7.174 . . . 1.0 . . . . . . . . . . . . A . 8 ALA HB3 . . . . . . . . . rr_6wpd 1
. 8 . 1526 . 1 1 8 ALA N N 9.681 7.550 6.297 . . . 1.0 . . . . . . . . . . . . A . 8 ALA N . . . . . . . . . rr_6wpd 1
. 8 . 1527 . 1 1 8 ALA O O 8.515 9.588 3.700 . . . 1.0 . . . . . . . . . . . . A . 8 ALA O . . . . . . . . . rr_6wpd 1
. 8 . 1528 . 1 1 9 ILE C C 10.498 11.758 4.325 . . . 1.0 . . . . . . . . . . . . A . 9 ILE C . . . . . . . . . rr_6wpd 1
. 8 . 1529 . 1 1 9 ILE CA C 9.393 11.634 5.370 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CA . . . . . . . . . rr_6wpd 1
. 8 . 1530 . 1 1 9 ILE CB C 9.770 12.430 6.627 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CB . . . . . . . . . rr_6wpd 1
. 8 . 1531 . 1 1 9 ILE CD1 C 8.981 12.995 8.926 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CD1 . . . . . . . . . rr_6wpd 1
. 8 . 1532 . 1 1 9 ILE CG1 C 8.557 12.494 7.547 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CG1 . . . . . . . . . rr_6wpd 1
. 8 . 1533 . 1 1 9 ILE CG2 C 10.206 13.852 6.254 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CG2 . . . . . . . . . rr_6wpd 1
. 8 . 1534 . 1 1 9 ILE H H 9.356 9.964 6.674 . . . 1.0 . . . . . . . . . . . . A . 9 ILE H . . . . . . . . . rr_6wpd 1
. 8 . 1535 . 1 1 9 ILE HA H 8.478 12.035 4.965 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HA . . . . . . . . . rr_6wpd 1
. 8 . 1536 . 1 1 9 ILE HB H 10.575 11.933 7.137 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HB . . . . . . . . . rr_6wpd 1
. 8 . 1537 . 1 1 9 ILE HD11 H 8.106 13.115 9.549 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HD11 . . . . . . . . . rr_6wpd 1
. 8 . 1538 . 1 1 9 ILE HD12 H 9.484 13.945 8.825 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HD12 . . . . . . . . . rr_6wpd 1
. 8 . 1539 . 1 1 9 ILE HD13 H 9.649 12.278 9.378 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HD13 . . . . . . . . . rr_6wpd 1
. 8 . 1540 . 1 1 9 ILE HG12 H 7.833 13.165 7.126 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG12 . . . . . . . . . rr_6wpd 1
. 8 . 1541 . 1 1 9 ILE HG13 H 8.124 11.508 7.641 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG13 . . . . . . . . . rr_6wpd 1
. 8 . 1542 . 1 1 9 ILE HG21 H 10.256 14.459 7.148 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG21 . . . . . . . . . rr_6wpd 1
. 8 . 1543 . 1 1 9 ILE HG22 H 9.492 14.279 5.569 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG22 . . . . . . . . . rr_6wpd 1
. 8 . 1544 . 1 1 9 ILE HG23 H 11.179 13.820 5.787 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG23 . . . . . . . . . rr_6wpd 1
. 8 . 1545 . 1 1 9 ILE N N 9.180 10.239 5.750 . . . 1.0 . . . . . . . . . . . . A . 9 ILE N . . . . . . . . . rr_6wpd 1
. 8 . 1546 . 1 1 9 ILE O O 10.372 12.503 3.355 . . . 1.0 . . . . . . . . . . . . A . 9 ILE O . . . . . . . . . rr_6wpd 1
. 8 . 1547 . 1 1 10 ALA C C 12.341 10.513 2.252 . . . 1.0 . . . . . . . . . . . . A . 10 ALA C . . . . . . . . . rr_6wpd 1
. 8 . 1548 . 1 1 10 ALA CA C 12.719 11.043 3.632 . . . 1.0 . . . . . . . . . . . . A . 10 ALA CA . . . . . . . . . rr_6wpd 1
. 8 . 1549 . 1 1 10 ALA CB C 13.845 10.176 4.211 . . . 1.0 . . . . . . . . . . . . A . 10 ALA CB . . . . . . . . . rr_6wpd 1
. 8 . 1550 . 1 1 10 ALA H H 11.611 10.450 5.336 . . . 1.0 . . . . . . . . . . . . A . 10 ALA H . . . . . . . . . rr_6wpd 1
. 8 . 1551 . 1 1 10 ALA HA H 13.072 12.054 3.535 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HA . . . . . . . . . rr_6wpd 1
. 8 . 1552 . 1 1 10 ALA HB1 H 13.520 9.146 4.253 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB1 . . . . . . . . . rr_6wpd 1
. 8 . 1553 . 1 1 10 ALA HB2 H 14.085 10.515 5.208 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB2 . . . . . . . . . rr_6wpd 1
. 8 . 1554 . 1 1 10 ALA HB3 H 14.721 10.251 3.584 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB3 . . . . . . . . . rr_6wpd 1
. 8 . 1555 . 1 1 10 ALA N N 11.577 11.020 4.542 . . . 1.0 . . . . . . . . . . . . A . 10 ALA N . . . . . . . . . rr_6wpd 1
. 8 . 1556 . 1 1 10 ALA O O 12.760 11.054 1.228 . . . 1.0 . . . . . . . . . . . . A . 10 ALA O . . . . . . . . . rr_6wpd 1
. 8 . 1557 . 1 1 11 LYS C C 10.298 9.799 0.157 . . . 1.0 . . . . . . . . . . . . A . 11 LYS C . . . . . . . . . rr_6wpd 1
. 8 . 1558 . 1 1 11 LYS CA C 11.124 8.815 1.001 . . . 1.0 . . . . . . . . . . . . A . 11 LYS CA . . . . . . . . . rr_6wpd 1
. 8 . 1559 . 1 1 11 LYS CB C 10.274 7.581 1.369 . . . 1.0 . . . . . . . . . . . . A . 11 LYS CB . . . . . . . . . rr_6wpd 1
. 8 . 1560 . 1 1 11 LYS CD C 9.778 7.084 -1.023 . . . 1.0 . . . . . . . . . . . . A . 11 LYS CD . . . . . . . . . rr_6wpd 1
. 8 . 1561 . 1 1 11 LYS CE C 9.521 5.960 -2.020 . . . 1.0 . . . . . . . . . . . . A . 11 LYS CE . . . . . . . . . rr_6wpd 1
. 8 . 1562 . 1 1 11 LYS CG C 10.345 6.517 0.267 . . . 1.0 . . . . . . . . . . . . A . 11 LYS CG . . . . . . . . . rr_6wpd 1
. 8 . 1563 . 1 1 11 LYS H H 11.270 9.067 3.096 . . . 1.0 . . . . . . . . . . . . A . 11 LYS H . . . . . . . . . rr_6wpd 1
. 8 . 1564 . 1 1 11 LYS HA H 11.986 8.495 0.436 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HA . . . . . . . . . rr_6wpd 1
. 8 . 1565 . 1 1 11 LYS HB2 H 10.642 7.158 2.291 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HB2 . . . . . . . . . rr_6wpd 1
. 8 . 1566 . 1 1 11 LYS HB3 H 9.244 7.880 1.505 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HB3 . . . . . . . . . rr_6wpd 1
. 8 . 1567 . 1 1 11 LYS HD2 H 8.856 7.609 -0.818 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HD2 . . . . . . . . . rr_6wpd 1
. 8 . 1568 . 1 1 11 LYS HD3 H 10.492 7.758 -1.445 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HD3 . . . . . . . . . rr_6wpd 1
. 8 . 1569 . 1 1 11 LYS HE2 H 10.459 5.498 -2.292 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HE2 . . . . . . . . . rr_6wpd 1
. 8 . 1570 . 1 1 11 LYS HE3 H 8.868 5.224 -1.576 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HE3 . . . . . . . . . rr_6wpd 1
. 8 . 1571 . 1 1 11 LYS HG2 H 11.374 6.228 0.114 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HG2 . . . . . . . . . rr_6wpd 1
. 8 . 1572 . 1 1 11 LYS HG3 H 9.775 5.660 0.559 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HG3 . . . . . . . . . rr_6wpd 1
. 8 . 1573 . 1 1 11 LYS HZ1 H 7.883 6.228 -3.277 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HZ1 . . . . . . . . . rr_6wpd 1
. 8 . 1574 . 1 1 11 LYS HZ2 H 9.380 6.216 -4.080 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HZ2 . . . . . . . . . rr_6wpd 1
. 8 . 1575 . 1 1 11 LYS HZ3 H 8.908 7.576 -3.177 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HZ3 . . . . . . . . . rr_6wpd 1
. 8 . 1576 . 1 1 11 LYS N N 11.559 9.447 2.243 . . . 1.0 . . . . . . . . . . . . A . 11 LYS N . . . . . . . . . rr_6wpd 1
. 8 . 1577 . 1 1 11 LYS NZ N 8.874 6.538 -3.231 . . . 1.0 . . . . . . . . . . . . A . 11 LYS NZ . . . . . . . . . rr_6wpd 1
. 8 . 1578 . 1 1 11 LYS O O 10.520 9.956 -1.043 . . . 1.0 . . . . . . . . . . . . A . 11 LYS O . . . . . . . . . rr_6wpd 1
. 8 . 1579 . 1 1 12 ALA C C 9.315 12.583 -0.462 . . . 1.0 . . . . . . . . . . . . A . 12 ALA C . . . . . . . . . rr_6wpd 1
. 8 . 1580 . 1 1 12 ALA CA C 8.499 11.435 0.122 . . . 1.0 . . . . . . . . . . . . A . 12 ALA CA . . . . . . . . . rr_6wpd 1
. 8 . 1581 . 1 1 12 ALA CB C 7.474 11.991 1.117 . . . 1.0 . . . . . . . . . . . . A . 12 ALA CB . . . . . . . . . rr_6wpd 1
. 8 . 1582 . 1 1 12 ALA H H 9.237 10.318 1.766 . . . 1.0 . . . . . . . . . . . . A . 12 ALA H . . . . . . . . . rr_6wpd 1
. 8 . 1583 . 1 1 12 ALA HA H 7.975 10.934 -0.677 . . . 1.0 . . . . . . . . . . . . A . 12 ALA HA . . . . . . . . . rr_6wpd 1
. 8 . 1584 . 1 1 12 ALA HB1 H 6.966 11.173 1.604 . . . 1.0 . . . . . . . . . . . . A . 12 ALA HB1 . . . . . . . . . rr_6wpd 1
. 8 . 1585 . 1 1 12 ALA HB2 H 6.752 12.601 0.593 . . . 1.0 . . . . . . . . . . . . A . 12 ALA HB2 . . . . . . . . . rr_6wpd 1
. 8 . 1586 . 1 1 12 ALA HB3 H 7.979 12.592 1.860 . . . 1.0 . . . . . . . . . . . . A . 12 ALA HB3 . . . . . . . . . rr_6wpd 1
. 8 . 1587 . 1 1 12 ALA N N 9.358 10.471 0.806 . . . 1.0 . . . . . . . . . . . . A . 12 ALA N . . . . . . . . . rr_6wpd 1
. 8 . 1588 . 1 1 12 ALA O O 9.053 13.044 -1.574 . . . 1.0 . . . . . . . . . . . . A . 12 ALA O . . . . . . . . . rr_6wpd 1
. 8 . 1589 . 1 1 13 ALA C C 11.927 13.781 -1.392 . . . 1.0 . . . . . . . . . . . . A . 13 ALA C . . . . . . . . . rr_6wpd 1
. 8 . 1590 . 1 1 13 ALA CA C 11.157 14.138 -0.124 . . . 1.0 . . . . . . . . . . . . A . 13 ALA CA . . . . . . . . . rr_6wpd 1
. 8 . 1591 . 1 1 13 ALA CB C 12.143 14.472 0.997 . . . 1.0 . . . . . . . . . . . . A . 13 ALA CB . . . . . . . . . rr_6wpd 1
. 8 . 1592 . 1 1 13 ALA H H 10.448 12.624 1.176 . . . 1.0 . . . . . . . . . . . . A . 13 ALA H . . . . . . . . . rr_6wpd 1
. 8 . 1593 . 1 1 13 ALA HA H 10.548 15.002 -0.320 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HA . . . . . . . . . rr_6wpd 1
. 8 . 1594 . 1 1 13 ALA HB1 H 12.782 15.287 0.689 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB1 . . . . . . . . . rr_6wpd 1
. 8 . 1595 . 1 1 13 ALA HB2 H 12.748 13.604 1.216 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB2 . . . . . . . . . rr_6wpd 1
. 8 . 1596 . 1 1 13 ALA HB3 H 11.596 14.760 1.883 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB3 . . . . . . . . . rr_6wpd 1
. 8 . 1597 . 1 1 13 ALA N N 10.298 13.037 0.301 . . . 1.0 . . . . . . . . . . . . A . 13 ALA N . . . . . . . . . rr_6wpd 1
. 8 . 1598 . 1 1 13 ALA O O 12.078 14.609 -2.290 . . . 1.0 . . . . . . . . . . . . A . 13 ALA O . . . . . . . . . rr_6wpd 1
. 8 . 1599 . 1 1 14 GLY C C 13.691 10.668 -2.400 . . . 1.0 . . . . . . . . . . . . A . 14 GLY C . . . . . . . . . rr_6wpd 1
. 8 . 1600 . 1 1 14 GLY CA C 13.165 12.085 -2.619 . . . 1.0 . . . . . . . . . . . . A . 14 GLY CA . . . . . . . . . rr_6wpd 1
. 8 . 1601 . 1 1 14 GLY H H 12.255 11.940 -0.708 . . . 1.0 . . . . . . . . . . . . A . 14 GLY H . . . . . . . . . rr_6wpd 1
. 8 . 1602 . 1 1 14 GLY HA2 H 12.520 12.094 -3.489 . . . 1.0 . . . . . . . . . . . . A . 14 GLY HA2 . . . . . . . . . rr_6wpd 1
. 8 . 1603 . 1 1 14 GLY HA3 H 13.998 12.747 -2.790 . . . 1.0 . . . . . . . . . . . . A . 14 GLY HA3 . . . . . . . . . rr_6wpd 1
. 8 . 1604 . 1 1 14 GLY N N 12.409 12.549 -1.457 . . . 1.0 . . . . . . . . . . . . A . 14 GLY N . . . . . . . . . rr_6wpd 1
. 8 . 1605 . 1 1 14 GLY O O 14.069 10.306 -1.285 . . . 1.0 . . . . . . . . . . . . A . 14 GLY O . . . . . . . . . rr_6wpd 1
. 8 . 1606 . 1 1 15 NH2 HN1 H 13.439 10.125 -4.292 . . . 1.0 . . . . . . . . . . . . A . 15 NH2 HN1 . . . . . . . . . rr_6wpd 1
. 8 . 1607 . 1 1 15 NH2 HN2 H 14.075 8.926 -3.275 . . . 1.0 . . . . . . . . . . . . A . 15 NH2 HN2 . . . . . . . . . rr_6wpd 1
. 8 . 1608 . 1 1 15 NH2 N N 13.739 9.838 -3.406 . . . 1.0 . . . . . . . . . . . . A . 15 NH2 N . . . . . . . . . rr_6wpd 1
. 9 . 1609 . 1 1 1 GLY C C 10.909 9.245 16.188 . . . 1.0 . . . . . . . . . . . . A . 1 GLY C . . . . . . . . . rr_6wpd 1
. 9 . 1610 . 1 1 1 GLY CA C 10.647 10.738 16.371 . . . 1.0 . . . . . . . . . . . . A . 1 GLY CA . . . . . . . . . rr_6wpd 1
. 9 . 1611 . 1 1 1 GLY H1 H 10.305 10.719 18.428 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H1 . . . . . . . . . rr_6wpd 1
. 9 . 1612 . 1 1 1 GLY H2 H 8.928 10.364 17.496 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H2 . . . . . . . . . rr_6wpd 1
. 9 . 1613 . 1 1 1 GLY H3 H 9.497 11.961 17.605 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H3 . . . . . . . . . rr_6wpd 1
. 9 . 1614 . 1 1 1 GLY HA2 H 10.153 11.125 15.491 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA2 . . . . . . . . . rr_6wpd 1
. 9 . 1615 . 1 1 1 GLY HA3 H 11.585 11.252 16.512 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA3 . . . . . . . . . rr_6wpd 1
. 9 . 1616 . 1 1 1 GLY N N 9.778 10.961 17.565 . . . 1.0 . . . . . . . . . . . . A . 1 GLY N . . . . . . . . . rr_6wpd 1
. 9 . 1617 . 1 1 1 GLY O O 11.992 8.755 16.504 . . . 1.0 . . . . . . . . . . . . A . 1 GLY O . . . . . . . . . rr_6wpd 1
. 9 . 1618 . 1 1 2 ILE C C 10.762 6.847 14.130 . . . 1.0 . . . . . . . . . . . . A . 2 ILE C . . . . . . . . . rr_6wpd 1
. 9 . 1619 . 1 1 2 ILE CA C 10.021 7.104 15.442 . . . 1.0 . . . . . . . . . . . . A . 2 ILE CA . . . . . . . . . rr_6wpd 1
. 9 . 1620 . 1 1 2 ILE CB C 8.613 6.512 15.380 . . . 1.0 . . . . . . . . . . . . A . 2 ILE CB . . . . . . . . . rr_6wpd 1
. 9 . 1621 . 1 1 2 ILE CD1 C 6.415 6.484 16.557 . . . 1.0 . . . . . . . . . . . . A . 2 ILE CD1 . . . . . . . . . rr_6wpd 1
. 9 . 1622 . 1 1 2 ILE CG1 C 7.912 6.742 16.722 . . . 1.0 . . . . . . . . . . . . A . 2 ILE CG1 . . . . . . . . . rr_6wpd 1
. 9 . 1623 . 1 1 2 ILE CG2 C 8.681 5.013 15.089 . . . 1.0 . . . . . . . . . . . . A . 2 ILE CG2 . . . . . . . . . rr_6wpd 1
. 9 . 1624 . 1 1 2 ILE H H 9.073 8.979 15.436 . . . 1.0 . . . . . . . . . . . . A . 2 ILE H . . . . . . . . . rr_6wpd 1
. 9 . 1625 . 1 1 2 ILE HA H 10.567 6.651 16.260 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HA . . . . . . . . . rr_6wpd 1
. 9 . 1626 . 1 1 2 ILE HB H 8.054 7.004 14.597 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HB . . . . . . . . . rr_6wpd 1
. 9 . 1627 . 1 1 2 ILE HD11 H 5.934 6.515 17.522 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HD11 . . . . . . . . . rr_6wpd 1
. 9 . 1628 . 1 1 2 ILE HD12 H 6.265 5.513 16.109 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HD12 . . . . . . . . . rr_6wpd 1
. 9 . 1629 . 1 1 2 ILE HD13 H 5.990 7.244 15.917 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HD13 . . . . . . . . . rr_6wpd 1
. 9 . 1630 . 1 1 2 ILE HG12 H 8.317 6.067 17.462 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HG12 . . . . . . . . . rr_6wpd 1
. 9 . 1631 . 1 1 2 ILE HG13 H 8.066 7.763 17.042 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HG13 . . . . . . . . . rr_6wpd 1
. 9 . 1632 . 1 1 2 ILE HG21 H 8.883 4.862 14.041 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HG21 . . . . . . . . . rr_6wpd 1
. 9 . 1633 . 1 1 2 ILE HG22 H 7.737 4.551 15.341 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HG22 . . . . . . . . . rr_6wpd 1
. 9 . 1634 . 1 1 2 ILE HG23 H 9.469 4.564 15.677 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HG23 . . . . . . . . . rr_6wpd 1
. 9 . 1635 . 1 1 2 ILE N N 9.910 8.533 15.671 . . . 1.0 . . . . . . . . . . . . A . 2 ILE N . . . . . . . . . rr_6wpd 1
. 9 . 1636 . 1 1 2 ILE O O 10.500 7.510 13.129 . . . 1.0 . . . . . . . . . . . . A . 2 ILE O . . . . . . . . . rr_6wpd 1
. 9 . 1637 . 1 1 3 LEU C C 11.570 5.410 11.734 . . . 1.0 . . . . . . . . . . . . A . 3 LEU C . . . . . . . . . rr_6wpd 1
. 9 . 1638 . 1 1 3 LEU CA C 12.472 5.564 12.959 . . . 1.0 . . . . . . . . . . . . A . 3 LEU CA . . . . . . . . . rr_6wpd 1
. 9 . 1639 . 1 1 3 LEU CB C 13.235 4.255 13.221 . . . 1.0 . . . . . . . . . . . . A . 3 LEU CB . . . . . . . . . rr_6wpd 1
. 9 . 1640 . 1 1 3 LEU CD1 C 15.060 4.937 11.625 . . . 1.0 . . . . . . . . . . . . A . 3 LEU CD1 . . . . . . . . . rr_6wpd 1
. 9 . 1641 . 1 1 3 LEU CD2 C 14.790 2.535 12.314 . . . 1.0 . . . . . . . . . . . . A . 3 LEU CD2 . . . . . . . . . rr_6wpd 1
. 9 . 1642 . 1 1 3 LEU CG C 14.050 3.838 11.990 . . . 1.0 . . . . . . . . . . . . A . 3 LEU CG . . . . . . . . . rr_6wpd 1
. 9 . 1643 . 1 1 3 LEU H H 11.854 5.406 14.981 . . . 1.0 . . . . . . . . . . . . A . 3 LEU H . . . . . . . . . rr_6wpd 1
. 9 . 1644 . 1 1 3 LEU HA H 13.189 6.353 12.775 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HA . . . . . . . . . rr_6wpd 1
. 9 . 1645 . 1 1 3 LEU HB2 H 13.907 4.403 14.054 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HB2 . . . . . . . . . rr_6wpd 1
. 9 . 1646 . 1 1 3 LEU HB3 H 12.534 3.470 13.468 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HB3 . . . . . . . . . rr_6wpd 1
. 9 . 1647 . 1 1 3 LEU HD11 H 15.430 5.410 12.524 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HD11 . . . . . . . . . rr_6wpd 1
. 9 . 1648 . 1 1 3 LEU HD12 H 14.575 5.679 11.007 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HD12 . . . . . . . . . rr_6wpd 1
. 9 . 1649 . 1 1 3 LEU HD13 H 15.891 4.504 11.079 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HD13 . . . . . . . . . rr_6wpd 1
. 9 . 1650 . 1 1 3 LEU HD21 H 14.071 1.758 12.531 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HD21 . . . . . . . . . rr_6wpd 1
. 9 . 1651 . 1 1 3 LEU HD22 H 15.426 2.686 13.174 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HD22 . . . . . . . . . rr_6wpd 1
. 9 . 1652 . 1 1 3 LEU HD23 H 15.393 2.242 11.467 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HD23 . . . . . . . . . rr_6wpd 1
. 9 . 1653 . 1 1 3 LEU HG H 13.385 3.671 11.154 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HG . . . . . . . . . rr_6wpd 1
. 9 . 1654 . 1 1 3 LEU N N 11.685 5.893 14.147 . . . 1.0 . . . . . . . . . . . . A . 3 LEU N . . . . . . . . . rr_6wpd 1
. 9 . 1655 . 1 1 3 LEU O O 11.962 5.747 10.616 . . . 1.0 . . . . . . . . . . . . A . 3 LEU O . . . . . . . . . rr_6wpd 1
. 9 . 1656 . 1 1 4 ASP C C 8.979 5.975 10.241 . . . 1.0 . . . . . . . . . . . . A . 4 ASP C . . . . . . . . . rr_6wpd 1
. 9 . 1657 . 1 1 4 ASP CA C 9.413 4.660 10.885 . . . 1.0 . . . . . . . . . . . . A . 4 ASP CA . . . . . . . . . rr_6wpd 1
. 9 . 1658 . 1 1 4 ASP CB C 8.198 3.928 11.467 . . . 1.0 . . . . . . . . . . . . A . 4 ASP CB . . . . . . . . . rr_6wpd 1
. 9 . 1659 . 1 1 4 ASP CG C 7.313 3.377 10.358 . . . 1.0 . . . . . . . . . . . . A . 4 ASP CG . . . . . . . . . rr_6wpd 1
. 9 . 1660 . 1 1 4 ASP H H 10.131 4.641 12.874 . . . 1.0 . . . . . . . . . . . . A . 4 ASP H . . . . . . . . . rr_6wpd 1
. 9 . 1661 . 1 1 4 ASP HA H 9.868 4.033 10.130 . . . 1.0 . . . . . . . . . . . . A . 4 ASP HA . . . . . . . . . rr_6wpd 1
. 9 . 1662 . 1 1 4 ASP HB2 H 8.544 3.109 12.081 . . . 1.0 . . . . . . . . . . . . A . 4 ASP HB2 . . . . . . . . . rr_6wpd 1
. 9 . 1663 . 1 1 4 ASP HB3 H 7.624 4.611 12.077 . . . 1.0 . . . . . . . . . . . . A . 4 ASP HB3 . . . . . . . . . rr_6wpd 1
. 9 . 1664 . 1 1 4 ASP N N 10.374 4.889 11.960 . . . 1.0 . . . . . . . . . . . . A . 4 ASP N . . . . . . . . . rr_6wpd 1
. 9 . 1665 . 1 1 4 ASP O O 8.868 6.073 9.018 . . . 1.0 . . . . . . . . . . . . A . 4 ASP O . . . . . . . . . rr_6wpd 1
. 9 . 1666 . 1 1 4 ASP OD1 O 6.181 3.821 10.257 . . . 1.0 . . . . . . . . . . . . A . 4 ASP OD1 . . . . . . . . . rr_6wpd 1
. 9 . 1667 . 1 1 4 ASP OD2 O 7.772 2.510 9.633 . . . 1.0 . . . . . . . . . . . . A . 4 ASP OD2 . . . . . . . . . rr_6wpd 1
. 9 . 1668 . 1 1 5 ALA C C 9.379 8.981 9.811 . . . 1.0 . . . . . . . . . . . . A . 5 ALA C . . . . . . . . . rr_6wpd 1
. 9 . 1669 . 1 1 5 ALA CA C 8.290 8.280 10.617 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CA . . . . . . . . . rr_6wpd 1
. 9 . 1670 . 1 1 5 ALA CB C 7.912 9.128 11.834 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CB . . . . . . . . . rr_6wpd 1
. 9 . 1671 . 1 1 5 ALA H H 8.829 6.818 12.042 . . . 1.0 . . . . . . . . . . . . A . 5 ALA H . . . . . . . . . rr_6wpd 1
. 9 . 1672 . 1 1 5 ALA HA H 7.413 8.161 9.997 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HA . . . . . . . . . rr_6wpd 1
. 9 . 1673 . 1 1 5 ALA HB1 H 8.745 9.163 12.526 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB1 . . . . . . . . . rr_6wpd 1
. 9 . 1674 . 1 1 5 ALA HB2 H 7.058 8.684 12.325 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB2 . . . . . . . . . rr_6wpd 1
. 9 . 1675 . 1 1 5 ALA HB3 H 7.665 10.128 11.519 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB3 . . . . . . . . . rr_6wpd 1
. 9 . 1676 . 1 1 5 ALA N N 8.727 6.970 11.081 . . . 1.0 . . . . . . . . . . . . A . 5 ALA N . . . . . . . . . rr_6wpd 1
. 9 . 1677 . 1 1 5 ALA O O 9.104 9.594 8.782 . . . 1.0 . . . . . . . . . . . . A . 5 ALA O . . . . . . . . . rr_6wpd 1
. 9 . 1678 . 1 1 6 ILE C C 11.954 8.956 8.227 . . . 1.0 . . . . . . . . . . . . A . 6 ILE C . . . . . . . . . rr_6wpd 1
. 9 . 1679 . 1 1 6 ILE CA C 11.745 9.527 9.630 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CA . . . . . . . . . rr_6wpd 1
. 9 . 1680 . 1 1 6 ILE CB C 12.985 9.296 10.496 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CB . . . . . . . . . rr_6wpd 1
. 9 . 1681 . 1 1 6 ILE CD1 C 13.889 9.627 12.800 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CD1 . . . . . . . . . rr_6wpd 1
. 9 . 1682 . 1 1 6 ILE CG1 C 12.822 10.077 11.803 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CG1 . . . . . . . . . rr_6wpd 1
. 9 . 1683 . 1 1 6 ILE CG2 C 14.242 9.771 9.769 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CG2 . . . . . . . . . rr_6wpd 1
. 9 . 1684 . 1 1 6 ILE H H 10.766 8.394 11.119 . . . 1.0 . . . . . . . . . . . . A . 6 ILE H . . . . . . . . . rr_6wpd 1
. 9 . 1685 . 1 1 6 ILE HA H 11.566 10.591 9.555 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HA . . . . . . . . . rr_6wpd 1
. 9 . 1686 . 1 1 6 ILE HB H 13.079 8.242 10.719 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HB . . . . . . . . . rr_6wpd 1
. 9 . 1687 . 1 1 6 ILE HD11 H 13.885 10.289 13.654 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HD11 . . . . . . . . . rr_6wpd 1
. 9 . 1688 . 1 1 6 ILE HD12 H 14.858 9.656 12.325 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HD12 . . . . . . . . . rr_6wpd 1
. 9 . 1689 . 1 1 6 ILE HD13 H 13.675 8.619 13.123 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HD13 . . . . . . . . . rr_6wpd 1
. 9 . 1690 . 1 1 6 ILE HG12 H 12.928 11.135 11.609 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG12 . . . . . . . . . rr_6wpd 1
. 9 . 1691 . 1 1 6 ILE HG13 H 11.843 9.883 12.216 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG13 . . . . . . . . . rr_6wpd 1
. 9 . 1692 . 1 1 6 ILE HG21 H 14.473 9.086 8.967 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG21 . . . . . . . . . rr_6wpd 1
. 9 . 1693 . 1 1 6 ILE HG22 H 15.068 9.802 10.466 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG22 . . . . . . . . . rr_6wpd 1
. 9 . 1694 . 1 1 6 ILE HG23 H 14.075 10.758 9.365 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG23 . . . . . . . . . rr_6wpd 1
. 9 . 1695 . 1 1 6 ILE N N 10.612 8.892 10.290 . . . 1.0 . . . . . . . . . . . . A . 6 ILE N . . . . . . . . . rr_6wpd 1
. 9 . 1696 . 1 1 6 ILE O O 12.195 9.697 7.274 . . . 1.0 . . . . . . . . . . . . A . 6 ILE O . . . . . . . . . rr_6wpd 1
. 9 . 1697 . 1 1 7 LYS C C 10.995 7.381 5.830 . . . 1.0 . . . . . . . . . . . . A . 7 LYS C . . . . . . . . . rr_6wpd 1
. 9 . 1698 . 1 1 7 LYS CA C 12.048 6.957 6.849 . . . 1.0 . . . . . . . . . . . . A . 7 LYS CA . . . . . . . . . rr_6wpd 1
. 9 . 1699 . 1 1 7 LYS CB C 11.958 5.456 7.114 . . . 1.0 . . . . . . . . . . . . A . 7 LYS CB . . . . . . . . . rr_6wpd 1
. 9 . 1700 . 1 1 7 LYS CD C 14.364 4.756 7.075 . . . 1.0 . . . . . . . . . . . . A . 7 LYS CD . . . . . . . . . rr_6wpd 1
. 9 . 1701 . 1 1 7 LYS CE C 15.549 4.274 7.898 . . . 1.0 . . . . . . . . . . . . A . 7 LYS CE . . . . . . . . . rr_6wpd 1
. 9 . 1702 . 1 1 7 LYS CG C 13.156 5.001 7.972 . . . 1.0 . . . . . . . . . . . . A . 7 LYS CG . . . . . . . . . rr_6wpd 1
. 9 . 1703 . 1 1 7 LYS H H 11.671 7.101 8.914 . . . 1.0 . . . . . . . . . . . . A . 7 LYS H . . . . . . . . . rr_6wpd 1
. 9 . 1704 . 1 1 7 LYS HA H 13.020 7.186 6.458 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HA . . . . . . . . . rr_6wpd 1
. 9 . 1705 . 1 1 7 LYS HB2 H 11.040 5.244 7.640 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HB2 . . . . . . . . . rr_6wpd 1
. 9 . 1706 . 1 1 7 LYS HB3 H 11.963 4.923 6.178 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HB3 . . . . . . . . . rr_6wpd 1
. 9 . 1707 . 1 1 7 LYS HD2 H 14.112 4.006 6.349 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HD2 . . . . . . . . . rr_6wpd 1
. 9 . 1708 . 1 1 7 LYS HD3 H 14.637 5.667 6.568 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HD3 . . . . . . . . . rr_6wpd 1
. 9 . 1709 . 1 1 7 LYS HE2 H 15.818 5.025 8.627 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HE2 . . . . . . . . . rr_6wpd 1
. 9 . 1710 . 1 1 7 LYS HE3 H 15.296 3.351 8.401 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HE3 . . . . . . . . . rr_6wpd 1
. 9 . 1711 . 1 1 7 LYS HG2 H 13.401 5.768 8.688 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HG2 . . . . . . . . . rr_6wpd 1
. 9 . 1712 . 1 1 7 LYS HG3 H 12.907 4.091 8.494 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HG3 . . . . . . . . . rr_6wpd 1
. 9 . 1713 . 1 1 7 LYS HZ1 H 17.485 3.641 7.490 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HZ1 . . . . . . . . . rr_6wpd 1
. 9 . 1714 . 1 1 7 LYS HZ2 H 16.963 4.948 6.537 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HZ2 . . . . . . . . . rr_6wpd 1
. 9 . 1715 . 1 1 7 LYS HZ3 H 16.387 3.381 6.223 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HZ3 . . . . . . . . . rr_6wpd 1
. 9 . 1716 . 1 1 7 LYS N N 11.863 7.638 8.119 . . . 1.0 . . . . . . . . . . . . A . 7 LYS N . . . . . . . . . rr_6wpd 1
. 9 . 1717 . 1 1 7 LYS NZ N 16.684 4.043 6.969 . . . 1.0 . . . . . . . . . . . . A . 7 LYS NZ . . . . . . . . . rr_6wpd 1
. 9 . 1718 . 1 1 7 LYS O O 11.307 7.621 4.664 . . . 1.0 . . . . . . . . . . . . A . 7 LYS O . . . . . . . . . rr_6wpd 1
. 9 . 1719 . 1 1 8 ALA C C 8.807 9.279 4.905 . . . 1.0 . . . . . . . . . . . . A . 8 ALA C . . . . . . . . . rr_6wpd 1
. 9 . 1720 . 1 1 8 ALA CA C 8.646 7.846 5.416 . . . 1.0 . . . . . . . . . . . . A . 8 ALA CA . . . . . . . . . rr_6wpd 1
. 9 . 1721 . 1 1 8 ALA CB C 7.346 7.713 6.208 . . . 1.0 . . . . . . . . . . . . A . 8 ALA CB . . . . . . . . . rr_6wpd 1
. 9 . 1722 . 1 1 8 ALA H H 9.569 7.254 7.220 . . . 1.0 . . . . . . . . . . . . A . 8 ALA H . . . . . . . . . rr_6wpd 1
. 9 . 1723 . 1 1 8 ALA HA H 8.607 7.174 4.569 . . . 1.0 . . . . . . . . . . . . A . 8 ALA HA . . . . . . . . . rr_6wpd 1
. 9 . 1724 . 1 1 8 ALA HB1 H 7.473 8.152 7.191 . . . 1.0 . . . . . . . . . . . . A . 8 ALA HB1 . . . . . . . . . rr_6wpd 1
. 9 . 1725 . 1 1 8 ALA HB2 H 7.102 6.666 6.316 . . . 1.0 . . . . . . . . . . . . A . 8 ALA HB2 . . . . . . . . . rr_6wpd 1
. 9 . 1726 . 1 1 8 ALA HB3 H 6.547 8.217 5.690 . . . 1.0 . . . . . . . . . . . . A . 8 ALA HB3 . . . . . . . . . rr_6wpd 1
. 9 . 1727 . 1 1 8 ALA N N 9.752 7.464 6.281 . . . 1.0 . . . . . . . . . . . . A . 8 ALA N . . . . . . . . . rr_6wpd 1
. 9 . 1728 . 1 1 8 ALA O O 8.545 9.562 3.736 . . . 1.0 . . . . . . . . . . . . A . 8 ALA O . . . . . . . . . rr_6wpd 1
. 9 . 1729 . 1 1 9 ILE C C 10.493 11.739 4.371 . . . 1.0 . . . . . . . . . . . . A . 9 ILE C . . . . . . . . . rr_6wpd 1
. 9 . 1730 . 1 1 9 ILE CA C 9.416 11.576 5.444 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CA . . . . . . . . . rr_6wpd 1
. 9 . 1731 . 1 1 9 ILE CB C 9.810 12.328 6.720 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CB . . . . . . . . . rr_6wpd 1
. 9 . 1732 . 1 1 9 ILE CD1 C 9.072 12.745 9.072 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CD1 . . . . . . . . . rr_6wpd 1
. 9 . 1733 . 1 1 9 ILE CG1 C 8.606 12.365 7.665 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CG1 . . . . . . . . . rr_6wpd 1
. 9 . 1734 . 1 1 9 ILE CG2 C 10.244 13.756 6.390 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CG2 . . . . . . . . . rr_6wpd 1
. 9 . 1735 . 1 1 9 ILE H H 9.415 9.883 6.710 . . . 1.0 . . . . . . . . . . . . A . 9 ILE H . . . . . . . . . rr_6wpd 1
. 9 . 1736 . 1 1 9 ILE HA H 8.482 11.978 5.075 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HA . . . . . . . . . rr_6wpd 1
. 9 . 1737 . 1 1 9 ILE HB H 10.625 11.814 7.203 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HB . . . . . . . . . rr_6wpd 1
. 9 . 1738 . 1 1 9 ILE HD11 H 9.736 13.593 9.011 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HD11 . . . . . . . . . rr_6wpd 1
. 9 . 1739 . 1 1 9 ILE HD12 H 9.594 11.909 9.515 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HD12 . . . . . . . . . rr_6wpd 1
. 9 . 1740 . 1 1 9 ILE HD13 H 8.216 12.999 9.679 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HD13 . . . . . . . . . rr_6wpd 1
. 9 . 1741 . 1 1 9 ILE HG12 H 7.898 13.095 7.309 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG12 . . . . . . . . . rr_6wpd 1
. 9 . 1742 . 1 1 9 ILE HG13 H 8.136 11.394 7.692 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG13 . . . . . . . . . rr_6wpd 1
. 9 . 1743 . 1 1 9 ILE HG21 H 10.283 14.339 7.300 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG21 . . . . . . . . . rr_6wpd 1
. 9 . 1744 . 1 1 9 ILE HG22 H 9.536 14.202 5.707 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG22 . . . . . . . . . rr_6wpd 1
. 9 . 1745 . 1 1 9 ILE HG23 H 11.222 13.736 5.935 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG23 . . . . . . . . . rr_6wpd 1
. 9 . 1746 . 1 1 9 ILE N N 9.230 10.172 5.792 . . . 1.0 . . . . . . . . . . . . A . 9 ILE N . . . . . . . . . rr_6wpd 1
. 9 . 1747 . 1 1 9 ILE O O 10.321 12.493 3.415 . . . 1.0 . . . . . . . . . . . . A . 9 ILE O . . . . . . . . . rr_6wpd 1
. 9 . 1748 . 1 1 10 ALA C C 12.305 10.546 2.238 . . . 1.0 . . . . . . . . . . . . A . 10 ALA C . . . . . . . . . rr_6wpd 1
. 9 . 1749 . 1 1 10 ALA CA C 12.708 11.086 3.605 . . . 1.0 . . . . . . . . . . . . A . 10 ALA CA . . . . . . . . . rr_6wpd 1
. 9 . 1750 . 1 1 10 ALA CB C 13.875 10.273 4.168 . . . 1.0 . . . . . . . . . . . . A . 10 ALA CB . . . . . . . . . rr_6wpd 1
. 9 . 1751 . 1 1 10 ALA H H 11.672 10.442 5.328 . . . 1.0 . . . . . . . . . . . . A . 10 ALA H . . . . . . . . . rr_6wpd 1
. 9 . 1752 . 1 1 10 ALA HA H 13.022 12.110 3.494 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HA . . . . . . . . . rr_6wpd 1
. 9 . 1753 . 1 1 10 ALA HB1 H 14.132 10.655 5.147 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB1 . . . . . . . . . rr_6wpd 1
. 9 . 1754 . 1 1 10 ALA HB2 H 14.728 10.358 3.517 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB2 . . . . . . . . . rr_6wpd 1
. 9 . 1755 . 1 1 10 ALA HB3 H 13.589 9.233 4.255 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB3 . . . . . . . . . rr_6wpd 1
. 9 . 1756 . 1 1 10 ALA N N 11.597 11.023 4.545 . . . 1.0 . . . . . . . . . . . . A . 10 ALA N . . . . . . . . . rr_6wpd 1
. 9 . 1757 . 1 1 10 ALA O O 12.690 11.089 1.203 . . . 1.0 . . . . . . . . . . . . A . 10 ALA O . . . . . . . . . rr_6wpd 1
. 9 . 1758 . 1 1 11 LYS C C 10.264 9.793 0.172 . . . 1.0 . . . . . . . . . . . . A . 11 LYS C . . . . . . . . . rr_6wpd 1
. 9 . 1759 . 1 1 11 LYS CA C 11.092 8.831 1.020 . . . 1.0 . . . . . . . . . . . . A . 11 LYS CA . . . . . . . . . rr_6wpd 1
. 9 . 1760 . 1 1 11 LYS CB C 10.255 7.600 1.398 . . . 1.0 . . . . . . . . . . . . A . 11 LYS CB . . . . . . . . . rr_6wpd 1
. 9 . 1761 . 1 1 11 LYS CD C 11.013 6.227 -0.555 . . . 1.0 . . . . . . . . . . . . A . 11 LYS CD . . . . . . . . . rr_6wpd 1
. 9 . 1762 . 1 1 11 LYS CE C 10.577 5.117 -1.499 . . . 1.0 . . . . . . . . . . . . A . 11 LYS CE . . . . . . . . . rr_6wpd 1
. 9 . 1763 . 1 1 11 LYS CG C 9.799 6.830 0.149 . . . 1.0 . . . . . . . . . . . . A . 11 LYS CG . . . . . . . . . rr_6wpd 1
. 9 . 1764 . 1 1 11 LYS H H 11.279 9.080 3.110 . . . 1.0 . . . . . . . . . . . . A . 11 LYS H . . . . . . . . . rr_6wpd 1
. 9 . 1765 . 1 1 11 LYS HA H 11.956 8.513 0.458 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HA . . . . . . . . . rr_6wpd 1
. 9 . 1766 . 1 1 11 LYS HB2 H 10.854 6.947 2.017 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HB2 . . . . . . . . . rr_6wpd 1
. 9 . 1767 . 1 1 11 LYS HB3 H 9.386 7.913 1.958 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HB3 . . . . . . . . . rr_6wpd 1
. 9 . 1768 . 1 1 11 LYS HD2 H 11.510 6.991 -1.131 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HD2 . . . . . . . . . rr_6wpd 1
. 9 . 1769 . 1 1 11 LYS HD3 H 11.695 5.825 0.172 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HD3 . . . . . . . . . rr_6wpd 1
. 9 . 1770 . 1 1 11 LYS HE2 H 10.073 4.339 -0.940 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HE2 . . . . . . . . . rr_6wpd 1
. 9 . 1771 . 1 1 11 LYS HE3 H 9.914 5.516 -2.250 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HE3 . . . . . . . . . rr_6wpd 1
. 9 . 1772 . 1 1 11 LYS HG2 H 9.122 6.040 0.443 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HG2 . . . . . . . . . rr_6wpd 1
. 9 . 1773 . 1 1 11 LYS HG3 H 9.293 7.499 -0.525 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HG3 . . . . . . . . . rr_6wpd 1
. 9 . 1774 . 1 1 11 LYS HZ1 H 12.361 5.346 -2.537 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HZ1 . . . . . . . . . rr_6wpd 1
. 9 . 1775 . 1 1 11 LYS HZ2 H 11.518 3.918 -2.907 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HZ2 . . . . . . . . . rr_6wpd 1
. 9 . 1776 . 1 1 11 LYS HZ3 H 12.360 4.054 -1.438 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HZ3 . . . . . . . . . rr_6wpd 1
. 9 . 1777 . 1 1 11 LYS N N 11.539 9.468 2.250 . . . 1.0 . . . . . . . . . . . . A . 11 LYS N . . . . . . . . . rr_6wpd 1
. 9 . 1778 . 1 1 11 LYS NZ N 11.793 4.564 -2.146 . . . 1.0 . . . . . . . . . . . . A . 11 LYS NZ . . . . . . . . . rr_6wpd 1
. 9 . 1779 . 1 1 11 LYS O O 10.466 9.903 -1.037 . . . 1.0 . . . . . . . . . . . . A . 11 LYS O . . . . . . . . . rr_6wpd 1
. 9 . 1780 . 1 1 12 ALA C C 9.261 12.594 -0.429 . . . 1.0 . . . . . . . . . . . . A . 12 ALA C . . . . . . . . . rr_6wpd 1
. 9 . 1781 . 1 1 12 ALA CA C 8.460 11.423 0.135 . . . 1.0 . . . . . . . . . . . . A . 12 ALA CA . . . . . . . . . rr_6wpd 1
. 9 . 1782 . 1 1 12 ALA CB C 7.414 11.928 1.129 . . . 1.0 . . . . . . . . . . . . A . 12 ALA CB . . . . . . . . . rr_6wpd 1
. 9 . 1783 . 1 1 12 ALA H H 9.220 10.343 1.782 . . . 1.0 . . . . . . . . . . . . A . 12 ALA H . . . . . . . . . rr_6wpd 1
. 9 . 1784 . 1 1 12 ALA HA H 7.954 10.919 -0.676 . . . 1.0 . . . . . . . . . . . . A . 12 ALA HA . . . . . . . . . rr_6wpd 1
. 9 . 1785 . 1 1 12 ALA HB1 H 6.856 12.740 0.692 . . . 1.0 . . . . . . . . . . . . A . 12 ALA HB1 . . . . . . . . . rr_6wpd 1
. 9 . 1786 . 1 1 12 ALA HB2 H 7.904 12.270 2.032 . . . 1.0 . . . . . . . . . . . . A . 12 ALA HB2 . . . . . . . . . rr_6wpd 1
. 9 . 1787 . 1 1 12 ALA HB3 H 6.739 11.119 1.374 . . . 1.0 . . . . . . . . . . . . A . 12 ALA HB3 . . . . . . . . . rr_6wpd 1
. 9 . 1788 . 1 1 12 ALA N N 9.332 10.480 0.819 . . . 1.0 . . . . . . . . . . . . A . 12 ALA N . . . . . . . . . rr_6wpd 1
. 9 . 1789 . 1 1 12 ALA O O 9.008 13.055 -1.542 . . . 1.0 . . . . . . . . . . . . A . 12 ALA O . . . . . . . . . rr_6wpd 1
. 9 . 1790 . 1 1 13 ALA C C 11.894 13.848 -1.272 . . . 1.0 . . . . . . . . . . . . A . 13 ALA C . . . . . . . . . rr_6wpd 1
. 9 . 1791 . 1 1 13 ALA CA C 11.060 14.184 -0.039 . . . 1.0 . . . . . . . . . . . . A . 13 ALA CA . . . . . . . . . rr_6wpd 1
. 9 . 1792 . 1 1 13 ALA CB C 11.981 14.546 1.124 . . . 1.0 . . . . . . . . . . . . A . 13 ALA CB . . . . . . . . . rr_6wpd 1
. 9 . 1793 . 1 1 13 ALA H H 10.360 12.655 1.233 . . . 1.0 . . . . . . . . . . . . A . 13 ALA H . . . . . . . . . rr_6wpd 1
. 9 . 1794 . 1 1 13 ALA HA H 10.434 15.032 -0.263 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HA . . . . . . . . . rr_6wpd 1
. 9 . 1795 . 1 1 13 ALA HB1 H 12.653 13.722 1.324 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB1 . . . . . . . . . rr_6wpd 1
. 9 . 1796 . 1 1 13 ALA HB2 H 11.382 14.740 2.002 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB2 . . . . . . . . . rr_6wpd 1
. 9 . 1797 . 1 1 13 ALA HB3 H 12.551 15.425 0.875 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB3 . . . . . . . . . rr_6wpd 1
. 9 . 1798 . 1 1 13 ALA N N 10.220 13.065 0.357 . . . 1.0 . . . . . . . . . . . . A . 13 ALA N . . . . . . . . . rr_6wpd 1
. 9 . 1799 . 1 1 13 ALA O O 12.091 14.695 -2.142 . . . 1.0 . . . . . . . . . . . . A . 13 ALA O . . . . . . . . . rr_6wpd 1
. 9 . 1800 . 1 1 14 GLY C C 14.443 13.046 -2.594 . . . 1.0 . . . . . . . . . . . . A . 14 GLY C . . . . . . . . . rr_6wpd 1
. 9 . 1801 . 1 1 14 GLY CA C 13.188 12.186 -2.476 . . . 1.0 . . . . . . . . . . . . A . 14 GLY CA . . . . . . . . . rr_6wpd 1
. 9 . 1802 . 1 1 14 GLY H H 12.191 11.984 -0.620 . . . 1.0 . . . . . . . . . . . . A . 14 GLY H . . . . . . . . . rr_6wpd 1
. 9 . 1803 . 1 1 14 GLY HA2 H 13.472 11.151 -2.339 . . . 1.0 . . . . . . . . . . . . A . 14 GLY HA2 . . . . . . . . . rr_6wpd 1
. 9 . 1804 . 1 1 14 GLY HA3 H 12.610 12.280 -3.384 . . . 1.0 . . . . . . . . . . . . A . 14 GLY HA3 . . . . . . . . . rr_6wpd 1
. 9 . 1805 . 1 1 14 GLY N N 12.379 12.614 -1.342 . . . 1.0 . . . . . . . . . . . . A . 14 GLY N . . . . . . . . . rr_6wpd 1
. 9 . 1806 . 1 1 14 GLY O O 15.478 12.721 -2.014 . . . 1.0 . . . . . . . . . . . . A . 14 GLY O . . . . . . . . . rr_6wpd 1
. 9 . 1807 . 1 1 15 NH2 HN1 H 13.585 14.395 -3.770 . . . 1.0 . . . . . . . . . . . . A . 15 NH2 HN1 . . . . . . . . . rr_6wpd 1
. 9 . 1808 . 1 1 15 NH2 HN2 H 15.208 14.703 -3.380 . . . 1.0 . . . . . . . . . . . . A . 15 NH2 HN2 . . . . . . . . . rr_6wpd 1
. 9 . 1809 . 1 1 15 NH2 N N 14.409 14.138 -3.309 . . . 1.0 . . . . . . . . . . . . A . 15 NH2 N . . . . . . . . . rr_6wpd 1
. 10 . 1810 . 1 1 1 GLY C C 10.768 9.224 16.309 . . . 1.0 . . . . . . . . . . . . A . 1 GLY C . . . . . . . . . rr_6wpd 1
. 10 . 1811 . 1 1 1 GLY CA C 10.430 10.697 16.511 . . . 1.0 . . . . . . . . . . . . A . 1 GLY CA . . . . . . . . . rr_6wpd 1
. 10 . 1812 . 1 1 1 GLY H1 H 11.100 11.932 18.049 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H1 . . . . . . . . . rr_6wpd 1
. 10 . 1813 . 1 1 1 GLY H2 H 11.061 10.281 18.452 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H2 . . . . . . . . . rr_6wpd 1
. 10 . 1814 . 1 1 1 GLY H3 H 9.617 11.172 18.369 . . . 1.0 . . . . . . . . . . . . A . 1 GLY H3 . . . . . . . . . rr_6wpd 1
. 10 . 1815 . 1 1 1 GLY HA2 H 9.414 10.881 16.193 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA2 . . . . . . . . . rr_6wpd 1
. 10 . 1816 . 1 1 1 GLY HA3 H 11.107 11.303 15.930 . . . 1.0 . . . . . . . . . . . . A . 1 GLY HA3 . . . . . . . . . rr_6wpd 1
. 10 . 1817 . 1 1 1 GLY N N 10.562 11.047 17.955 . . . 1.0 . . . . . . . . . . . . A . 1 GLY N . . . . . . . . . rr_6wpd 1
. 10 . 1818 . 1 1 1 GLY O O 11.870 8.776 16.627 . . . 1.0 . . . . . . . . . . . . A . 1 GLY O . . . . . . . . . rr_6wpd 1
. 10 . 1819 . 1 1 2 ILE C C 10.746 6.868 14.216 . . . 1.0 . . . . . . . . . . . . A . 2 ILE C . . . . . . . . . rr_6wpd 1
. 10 . 1820 . 1 1 2 ILE CA C 9.982 7.064 15.525 . . . 1.0 . . . . . . . . . . . . A . 2 ILE CA . . . . . . . . . rr_6wpd 1
. 10 . 1821 . 1 1 2 ILE CB C 8.598 6.400 15.453 . . . 1.0 . . . . . . . . . . . . A . 2 ILE CB . . . . . . . . . rr_6wpd 1
. 10 . 1822 . 1 1 2 ILE CD1 C 6.385 6.235 16.600 . . . 1.0 . . . . . . . . . . . . A . 2 ILE CD1 . . . . . . . . . rr_6wpd 1
. 10 . 1823 . 1 1 2 ILE CG1 C 7.842 6.670 16.756 . . . 1.0 . . . . . . . . . . . . A . 2 ILE CG1 . . . . . . . . . rr_6wpd 1
. 10 . 1824 . 1 1 2 ILE CG2 C 8.744 4.886 15.279 . . . 1.0 . . . . . . . . . . . . A . 2 ILE CG2 . . . . . . . . . rr_6wpd 1
. 10 . 1825 . 1 1 2 ILE H H 8.954 8.896 15.542 . . . 1.0 . . . . . . . . . . . . A . 2 ILE H . . . . . . . . . rr_6wpd 1
. 10 . 1826 . 1 1 2 ILE HA H 10.542 6.627 16.337 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HA . . . . . . . . . rr_6wpd 1
. 10 . 1827 . 1 1 2 ILE HB H 8.043 6.809 14.620 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HB . . . . . . . . . rr_6wpd 1
. 10 . 1828 . 1 1 2 ILE HD11 H 6.341 5.164 16.472 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HD11 . . . . . . . . . rr_6wpd 1
. 10 . 1829 . 1 1 2 ILE HD12 H 5.957 6.719 15.735 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HD12 . . . . . . . . . rr_6wpd 1
. 10 . 1830 . 1 1 2 ILE HD13 H 5.829 6.516 17.482 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HD13 . . . . . . . . . rr_6wpd 1
. 10 . 1831 . 1 1 2 ILE HG12 H 8.301 6.114 17.560 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HG12 . . . . . . . . . rr_6wpd 1
. 10 . 1832 . 1 1 2 ILE HG13 H 7.878 7.726 16.984 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HG13 . . . . . . . . . rr_6wpd 1
. 10 . 1833 . 1 1 2 ILE HG21 H 7.766 4.447 15.143 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HG21 . . . . . . . . . rr_6wpd 1
. 10 . 1834 . 1 1 2 ILE HG22 H 9.206 4.464 16.159 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HG22 . . . . . . . . . rr_6wpd 1
. 10 . 1835 . 1 1 2 ILE HG23 H 9.352 4.676 14.417 . . . 1.0 . . . . . . . . . . . . A . 2 ILE HG23 . . . . . . . . . rr_6wpd 1
. 10 . 1836 . 1 1 2 ILE N N 9.805 8.482 15.775 . . . 1.0 . . . . . . . . . . . . A . 2 ILE N . . . . . . . . . rr_6wpd 1
. 10 . 1837 . 1 1 2 ILE O O 10.472 7.543 13.221 . . . 1.0 . . . . . . . . . . . . A . 2 ILE O . . . . . . . . . rr_6wpd 1
. 10 . 1838 . 1 1 3 LEU C C 11.648 5.493 11.823 . . . 1.0 . . . . . . . . . . . . A . 3 LEU C . . . . . . . . . rr_6wpd 1
. 10 . 1839 . 1 1 3 LEU CA C 12.532 5.682 13.052 . . . 1.0 . . . . . . . . . . . . A . 3 LEU CA . . . . . . . . . rr_6wpd 1
. 10 . 1840 . 1 1 3 LEU CB C 13.356 4.410 13.296 . . . 1.0 . . . . . . . . . . . . A . 3 LEU CB . . . . . . . . . rr_6wpd 1
. 10 . 1841 . 1 1 3 LEU CD1 C 15.139 5.205 11.699 . . . 1.0 . . . . . . . . . . . . A . 3 LEU CD1 . . . . . . . . . rr_6wpd 1
. 10 . 1842 . 1 1 3 LEU CD2 C 15.008 2.787 12.368 . . . 1.0 . . . . . . . . . . . . A . 3 LEU CD2 . . . . . . . . . rr_6wpd 1
. 10 . 1843 . 1 1 3 LEU CG C 14.193 4.049 12.059 . . . 1.0 . . . . . . . . . . . . A . 3 LEU CG . . . . . . . . . rr_6wpd 1
. 10 . 1844 . 1 1 3 LEU H H 11.897 5.467 15.063 . . . 1.0 . . . . . . . . . . . . A . 3 LEU H . . . . . . . . . rr_6wpd 1
. 10 . 1845 . 1 1 3 LEU HA H 13.205 6.509 12.883 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HA . . . . . . . . . rr_6wpd 1
. 10 . 1846 . 1 1 3 LEU HB2 H 14.015 4.570 14.136 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HB2 . . . . . . . . . rr_6wpd 1
. 10 . 1847 . 1 1 3 LEU HB3 H 12.686 3.594 13.521 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HB3 . . . . . . . . . rr_6wpd 1
. 10 . 1848 . 1 1 3 LEU HD11 H 15.504 5.673 12.602 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HD11 . . . . . . . . . rr_6wpd 1
. 10 . 1849 . 1 1 3 LEU HD12 H 14.606 5.933 11.107 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HD12 . . . . . . . . . rr_6wpd 1
. 10 . 1850 . 1 1 3 LEU HD13 H 15.979 4.825 11.129 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HD13 . . . . . . . . . rr_6wpd 1
. 10 . 1851 . 1 1 3 LEU HD21 H 15.557 2.487 11.487 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HD21 . . . . . . . . . rr_6wpd 1
. 10 . 1852 . 1 1 3 LEU HD22 H 14.340 1.991 12.662 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HD22 . . . . . . . . . rr_6wpd 1
. 10 . 1853 . 1 1 3 LEU HD23 H 15.699 2.991 13.171 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HD23 . . . . . . . . . rr_6wpd 1
. 10 . 1854 . 1 1 3 LEU HG H 13.538 3.851 11.223 . . . 1.0 . . . . . . . . . . . . A . 3 LEU HG . . . . . . . . . rr_6wpd 1
. 10 . 1855 . 1 1 3 LEU N N 11.716 5.956 14.234 . . . 1.0 . . . . . . . . . . . . A . 3 LEU N . . . . . . . . . rr_6wpd 1
. 10 . 1856 . 1 1 3 LEU O O 12.027 5.846 10.707 . . . 1.0 . . . . . . . . . . . . A . 3 LEU O . . . . . . . . . rr_6wpd 1
. 10 . 1857 . 1 1 4 ASP C C 9.043 5.957 10.330 . . . 1.0 . . . . . . . . . . . . A . 4 ASP C . . . . . . . . . rr_6wpd 1
. 10 . 1858 . 1 1 4 ASP CA C 9.530 4.658 10.968 . . . 1.0 . . . . . . . . . . . . A . 4 ASP CA . . . . . . . . . rr_6wpd 1
. 10 . 1859 . 1 1 4 ASP CB C 8.336 3.885 11.530 . . . 1.0 . . . . . . . . . . . . A . 4 ASP CB . . . . . . . . . rr_6wpd 1
. 10 . 1860 . 1 1 4 ASP CG C 8.752 2.454 11.860 . . . 1.0 . . . . . . . . . . . . A . 4 ASP CG . . . . . . . . . rr_6wpd 1
. 10 . 1861 . 1 1 4 ASP H H 10.243 4.661 12.962 . . . 1.0 . . . . . . . . . . . . A . 4 ASP H . . . . . . . . . rr_6wpd 1
. 10 . 1862 . 1 1 4 ASP HA H 10.010 4.055 10.214 . . . 1.0 . . . . . . . . . . . . A . 4 ASP HA . . . . . . . . . rr_6wpd 1
. 10 . 1863 . 1 1 4 ASP HB2 H 7.987 4.373 12.427 . . . 1.0 . . . . . . . . . . . . A . 4 ASP HB2 . . . . . . . . . rr_6wpd 1
. 10 . 1864 . 1 1 4 ASP HB3 H 7.542 3.870 10.797 . . . 1.0 . . . . . . . . . . . . A . 4 ASP HB3 . . . . . . . . . rr_6wpd 1
. 10 . 1865 . 1 1 4 ASP N N 10.477 4.920 12.046 . . . 1.0 . . . . . . . . . . . . A . 4 ASP N . . . . . . . . . rr_6wpd 1
. 10 . 1866 . 1 1 4 ASP O O 8.932 6.059 9.106 . . . 1.0 . . . . . . . . . . . . A . 4 ASP O . . . . . . . . . rr_6wpd 1
. 10 . 1867 . 1 1 4 ASP OD1 O 8.019 1.801 12.583 . . . 1.0 . . . . . . . . . . . . A . 4 ASP OD1 . . . . . . . . . rr_6wpd 1
. 10 . 1868 . 1 1 4 ASP OD2 O 9.797 2.037 11.388 . . . 1.0 . . . . . . . . . . . . A . 4 ASP OD2 . . . . . . . . . rr_6wpd 1
. 10 . 1869 . 1 1 5 ALA C C 9.330 8.957 9.875 . . . 1.0 . . . . . . . . . . . . A . 5 ALA C . . . . . . . . . rr_6wpd 1
. 10 . 1870 . 1 1 5 ALA CA C 8.259 8.230 10.693 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CA . . . . . . . . . rr_6wpd 1
. 10 . 1871 . 1 1 5 ALA CB C 7.865 9.094 11.892 . . . 1.0 . . . . . . . . . . . . A . 5 ALA CB . . . . . . . . . rr_6wpd 1
. 10 . 1872 . 1 1 5 ALA H H 8.849 6.791 12.130 . . . 1.0 . . . . . . . . . . . . A . 5 ALA H . . . . . . . . . rr_6wpd 1
. 10 . 1873 . 1 1 5 ALA HA H 7.389 8.074 10.075 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HA . . . . . . . . . rr_6wpd 1
. 10 . 1874 . 1 1 5 ALA HB1 H 7.270 8.507 12.577 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB1 . . . . . . . . . rr_6wpd 1
. 10 . 1875 . 1 1 5 ALA HB2 H 7.293 9.945 11.555 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB2 . . . . . . . . . rr_6wpd 1
. 10 . 1876 . 1 1 5 ALA HB3 H 8.758 9.435 12.395 . . . 1.0 . . . . . . . . . . . . A . 5 ALA HB3 . . . . . . . . . rr_6wpd 1
. 10 . 1877 . 1 1 5 ALA N N 8.747 6.940 11.169 . . . 1.0 . . . . . . . . . . . . A . 5 ALA N . . . . . . . . . rr_6wpd 1
. 10 . 1878 . 1 1 5 ALA O O 9.038 9.572 8.849 . . . 1.0 . . . . . . . . . . . . A . 5 ALA O . . . . . . . . . rr_6wpd 1
. 10 . 1879 . 1 1 6 ILE C C 11.913 8.958 8.291 . . . 1.0 . . . . . . . . . . . . A . 6 ILE C . . . . . . . . . rr_6wpd 1
. 10 . 1880 . 1 1 6 ILE CA C 11.689 9.533 9.687 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CA . . . . . . . . . rr_6wpd 1
. 10 . 1881 . 1 1 6 ILE CB C 12.942 9.337 10.545 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CB . . . . . . . . . rr_6wpd 1
. 10 . 1882 . 1 1 6 ILE CD1 C 13.854 9.719 12.847 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CD1 . . . . . . . . . rr_6wpd 1
. 10 . 1883 . 1 1 6 ILE CG1 C 12.787 10.144 11.836 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CG1 . . . . . . . . . rr_6wpd 1
. 10 . 1884 . 1 1 6 ILE CG2 C 14.190 9.810 9.789 . . . 1.0 . . . . . . . . . . . . A . 6 ILE CG2 . . . . . . . . . rr_6wpd 1
. 10 . 1885 . 1 1 6 ILE H H 10.722 8.380 11.177 . . . 1.0 . . . . . . . . . . . . A . 6 ILE H . . . . . . . . . rr_6wpd 1
. 10 . 1886 . 1 1 6 ILE HA H 11.489 10.590 9.605 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HA . . . . . . . . . rr_6wpd 1
. 10 . 1887 . 1 1 6 ILE HB H 13.045 8.290 10.786 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HB . . . . . . . . . rr_6wpd 1
. 10 . 1888 . 1 1 6 ILE HD11 H 13.942 10.476 13.611 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HD11 . . . . . . . . . rr_6wpd 1
. 10 . 1889 . 1 1 6 ILE HD12 H 14.802 9.600 12.345 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HD12 . . . . . . . . . rr_6wpd 1
. 10 . 1890 . 1 1 6 ILE HD13 H 13.565 8.782 13.302 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HD13 . . . . . . . . . rr_6wpd 1
. 10 . 1891 . 1 1 6 ILE HG12 H 12.897 11.196 11.617 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG12 . . . . . . . . . rr_6wpd 1
. 10 . 1892 . 1 1 6 ILE HG13 H 11.807 9.966 12.256 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG13 . . . . . . . . . rr_6wpd 1
. 10 . 1893 . 1 1 6 ILE HG21 H 14.419 9.109 9.000 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG21 . . . . . . . . . rr_6wpd 1
. 10 . 1894 . 1 1 6 ILE HG22 H 15.022 9.862 10.475 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG22 . . . . . . . . . rr_6wpd 1
. 10 . 1895 . 1 1 6 ILE HG23 H 14.009 10.786 9.366 . . . 1.0 . . . . . . . . . . . . A . 6 ILE HG23 . . . . . . . . . rr_6wpd 1
. 10 . 1896 . 1 1 6 ILE N N 10.563 8.881 10.351 . . . 1.0 . . . . . . . . . . . . A . 6 ILE N . . . . . . . . . rr_6wpd 1
. 10 . 1897 . 1 1 6 ILE O O 12.170 9.692 7.333 . . . 1.0 . . . . . . . . . . . . A . 6 ILE O . . . . . . . . . rr_6wpd 1
. 10 . 1898 . 1 1 7 LYS C C 10.986 7.358 5.898 . . . 1.0 . . . . . . . . . . . . A . 7 LYS C . . . . . . . . . rr_6wpd 1
. 10 . 1899 . 1 1 7 LYS CA C 12.030 6.950 6.934 . . . 1.0 . . . . . . . . . . . . A . 7 LYS CA . . . . . . . . . rr_6wpd 1
. 10 . 1900 . 1 1 7 LYS CB C 11.943 5.450 7.195 . . . 1.0 . . . . . . . . . . . . A . 7 LYS CB . . . . . . . . . rr_6wpd 1
. 10 . 1901 . 1 1 7 LYS CD C 14.324 4.671 7.024 . . . 1.0 . . . . . . . . . . . . A . 7 LYS CD . . . . . . . . . rr_6wpd 1
. 10 . 1902 . 1 1 7 LYS CE C 15.547 4.189 7.799 . . . 1.0 . . . . . . . . . . . . A . 7 LYS CE . . . . . . . . . rr_6wpd 1
. 10 . 1903 . 1 1 7 LYS CG C 13.175 4.972 7.985 . . . 1.0 . . . . . . . . . . . . A . 7 LYS CG . . . . . . . . . rr_6wpd 1
. 10 . 1904 . 1 1 7 LYS H H 11.635 7.116 8.997 . . . 1.0 . . . . . . . . . . . . A . 7 LYS H . . . . . . . . . rr_6wpd 1
. 10 . 1905 . 1 1 7 LYS HA H 13.005 7.183 6.558 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HA . . . . . . . . . rr_6wpd 1
. 10 . 1906 . 1 1 7 LYS HB2 H 11.054 5.252 7.767 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HB2 . . . . . . . . . rr_6wpd 1
. 10 . 1907 . 1 1 7 LYS HB3 H 11.889 4.926 6.255 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HB3 . . . . . . . . . rr_6wpd 1
. 10 . 1908 . 1 1 7 LYS HD2 H 14.013 3.902 6.342 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HD2 . . . . . . . . . rr_6wpd 1
. 10 . 1909 . 1 1 7 LYS HD3 H 14.583 5.558 6.473 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HD3 . . . . . . . . . rr_6wpd 1
. 10 . 1910 . 1 1 7 LYS HE2 H 15.882 4.971 8.465 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HE2 . . . . . . . . . rr_6wpd 1
. 10 . 1911 . 1 1 7 LYS HE3 H 15.293 3.310 8.371 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HE3 . . . . . . . . . rr_6wpd 1
. 10 . 1912 . 1 1 7 LYS HG2 H 13.485 5.740 8.676 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HG2 . . . . . . . . . rr_6wpd 1
. 10 . 1913 . 1 1 7 LYS HG3 H 12.925 4.077 8.534 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HG3 . . . . . . . . . rr_6wpd 1
. 10 . 1914 . 1 1 7 LYS HZ1 H 16.462 4.374 5.941 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HZ1 . . . . . . . . . rr_6wpd 1
. 10 . 1915 . 1 1 7 LYS HZ2 H 16.629 2.838 6.645 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HZ2 . . . . . . . . . rr_6wpd 1
. 10 . 1916 . 1 1 7 LYS HZ3 H 17.549 4.145 7.224 . . . 1.0 . . . . . . . . . . . . A . 7 LYS HZ3 . . . . . . . . . rr_6wpd 1
. 10 . 1917 . 1 1 7 LYS N N 11.829 7.643 8.194 . . . 1.0 . . . . . . . . . . . . A . 7 LYS N . . . . . . . . . rr_6wpd 1
. 10 . 1918 . 1 1 7 LYS NZ N 16.630 3.862 6.830 . . . 1.0 . . . . . . . . . . . . A . 7 LYS NZ . . . . . . . . . rr_6wpd 1
. 10 . 1919 . 1 1 7 LYS O O 11.303 7.546 4.720 . . . 1.0 . . . . . . . . . . . . A . 7 LYS O . . . . . . . . . rr_6wpd 1
. 10 . 1920 . 1 1 8 ALA C C 8.866 9.234 4.854 . . . 1.0 . . . . . . . . . . . . A . 8 ALA C . . . . . . . . . rr_6wpd 1
. 10 . 1921 . 1 1 8 ALA CA C 8.647 7.846 5.457 . . . 1.0 . . . . . . . . . . . . A . 8 ALA CA . . . . . . . . . rr_6wpd 1
. 10 . 1922 . 1 1 8 ALA CB C 7.340 7.842 6.247 . . . 1.0 . . . . . . . . . . . . A . 8 ALA CB . . . . . . . . . rr_6wpd 1
. 10 . 1923 . 1 1 8 ALA H H 9.557 7.301 7.290 . . . 1.0 . . . . . . . . . . . . A . 8 ALA H . . . . . . . . . rr_6wpd 1
. 10 . 1924 . 1 1 8 ALA HA H 8.573 7.121 4.662 . . . 1.0 . . . . . . . . . . . . A . 8 ALA HA . . . . . . . . . rr_6wpd 1
. 10 . 1925 . 1 1 8 ALA HB1 H 7.270 6.929 6.823 . . . 1.0 . . . . . . . . . . . . A . 8 ALA HB1 . . . . . . . . . rr_6wpd 1
. 10 . 1926 . 1 1 8 ALA HB2 H 6.504 7.906 5.567 . . . 1.0 . . . . . . . . . . . . A . 8 ALA HB2 . . . . . . . . . rr_6wpd 1
. 10 . 1927 . 1 1 8 ALA HB3 H 7.328 8.688 6.916 . . . 1.0 . . . . . . . . . . . . A . 8 ALA HB3 . . . . . . . . . rr_6wpd 1
. 10 . 1928 . 1 1 8 ALA N N 9.744 7.476 6.344 . . . 1.0 . . . . . . . . . . . . A . 8 ALA N . . . . . . . . . rr_6wpd 1
. 10 . 1929 . 1 1 8 ALA O O 8.616 9.457 3.668 . . . 1.0 . . . . . . . . . . . . A . 8 ALA O . . . . . . . . . rr_6wpd 1
. 10 . 1930 . 1 1 9 ILE C C 10.667 11.587 4.190 . . . 1.0 . . . . . . . . . . . . A . 9 ILE C . . . . . . . . . rr_6wpd 1
. 10 . 1931 . 1 1 9 ILE CA C 9.563 11.537 5.246 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CA . . . . . . . . . rr_6wpd 1
. 10 . 1932 . 1 1 9 ILE CB C 9.952 12.382 6.464 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CB . . . . . . . . . rr_6wpd 1
. 10 . 1933 . 1 1 9 ILE CD1 C 7.550 13.201 6.741 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CD1 . . . . . . . . . rr_6wpd 1
. 10 . 1934 . 1 1 9 ILE CG1 C 8.742 12.496 7.414 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CG1 . . . . . . . . . rr_6wpd 1
. 10 . 1935 . 1 1 9 ILE CG2 C 10.425 13.777 6.033 . . . 1.0 . . . . . . . . . . . . A . 9 ILE CG2 . . . . . . . . . rr_6wpd 1
. 10 . 1936 . 1 1 9 ILE H H 9.489 9.923 6.623 . . . 1.0 . . . . . . . . . . . . A . 9 ILE H . . . . . . . . . rr_6wpd 1
. 10 . 1937 . 1 1 9 ILE HA H 8.658 11.933 4.816 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HA . . . . . . . . . rr_6wpd 1
. 10 . 1938 . 1 1 9 ILE HB H 10.759 11.886 6.982 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HB . . . . . . . . . rr_6wpd 1
. 10 . 1939 . 1 1 9 ILE HD11 H 6.909 12.459 6.285 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HD11 . . . . . . . . . rr_6wpd 1
. 10 . 1940 . 1 1 9 ILE HD12 H 7.896 13.886 5.982 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HD12 . . . . . . . . . rr_6wpd 1
. 10 . 1941 . 1 1 9 ILE HD13 H 6.991 13.744 7.488 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HD13 . . . . . . . . . rr_6wpd 1
. 10 . 1942 . 1 1 9 ILE HG12 H 8.435 11.504 7.708 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG12 . . . . . . . . . rr_6wpd 1
. 10 . 1943 . 1 1 9 ILE HG13 H 9.033 13.050 8.293 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG13 . . . . . . . . . rr_6wpd 1
. 10 . 1944 . 1 1 9 ILE HG21 H 11.408 13.703 5.592 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG21 . . . . . . . . . rr_6wpd 1
. 10 . 1945 . 1 1 9 ILE HG22 H 10.468 14.423 6.898 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG22 . . . . . . . . . rr_6wpd 1
. 10 . 1946 . 1 1 9 ILE HG23 H 9.736 14.190 5.310 . . . 1.0 . . . . . . . . . . . . A . 9 ILE HG23 . . . . . . . . . rr_6wpd 1
. 10 . 1947 . 1 1 9 ILE N N 9.320 10.163 5.684 . . . 1.0 . . . . . . . . . . . . A . 9 ILE N . . . . . . . . . rr_6wpd 1
. 10 . 1948 . 1 1 9 ILE O O 10.564 12.314 3.202 . . . 1.0 . . . . . . . . . . . . A . 9 ILE O . . . . . . . . . rr_6wpd 1
. 10 . 1949 . 1 1 10 ALA C C 12.388 10.388 2.087 . . . 1.0 . . . . . . . . . . . . A . 10 ALA C . . . . . . . . . rr_6wpd 1
. 10 . 1950 . 1 1 10 ALA CA C 12.849 10.787 3.487 . . . 1.0 . . . . . . . . . . . . A . 10 ALA CA . . . . . . . . . rr_6wpd 1
. 10 . 1951 . 1 1 10 ALA CB C 13.888 9.783 3.985 . . . 1.0 . . . . . . . . . . . . A . 10 ALA CB . . . . . . . . . rr_6wpd 1
. 10 . 1952 . 1 1 10 ALA H H 11.752 10.269 5.226 . . . 1.0 . . . . . . . . . . . . A . 10 ALA H . . . . . . . . . rr_6wpd 1
. 10 . 1953 . 1 1 10 ALA HA H 13.301 11.761 3.443 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HA . . . . . . . . . rr_6wpd 1
. 10 . 1954 . 1 1 10 ALA HB1 H 14.030 9.910 5.049 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB1 . . . . . . . . . rr_6wpd 1
. 10 . 1955 . 1 1 10 ALA HB2 H 14.824 9.947 3.473 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB2 . . . . . . . . . rr_6wpd 1
. 10 . 1956 . 1 1 10 ALA HB3 H 13.541 8.779 3.788 . . . 1.0 . . . . . . . . . . . . A . 10 ALA HB3 . . . . . . . . . rr_6wpd 1
. 10 . 1957 . 1 1 10 ALA N N 11.724 10.819 4.415 . . . 1.0 . . . . . . . . . . . . A . 10 ALA N . . . . . . . . . rr_6wpd 1
. 10 . 1958 . 1 1 10 ALA O O 12.762 11.013 1.093 . . . 1.0 . . . . . . . . . . . . A . 10 ALA O . . . . . . . . . rr_6wpd 1
. 10 . 1959 . 1 1 11 LYS C C 10.203 9.894 0.060 . . . 1.0 . . . . . . . . . . . . A . 11 LYS C . . . . . . . . . rr_6wpd 1
. 10 . 1960 . 1 1 11 LYS CA C 11.071 8.849 0.750 . . . 1.0 . . . . . . . . . . . . A . 11 LYS CA . . . . . . . . . rr_6wpd 1
. 10 . 1961 . 1 1 11 LYS CB C 10.264 7.597 0.989 . . . 1.0 . . . . . . . . . . . . A . 11 LYS CB . . . . . . . . . rr_6wpd 1
. 10 . 1962 . 1 1 11 LYS CD C 10.519 5.150 1.328 . . . 1.0 . . . . . . . . . . . . A . 11 LYS CD . . . . . . . . . rr_6wpd 1
. 10 . 1963 . 1 1 11 LYS CE C 11.442 4.043 1.843 . . . 1.0 . . . . . . . . . . . . A . 11 LYS CE . . . . . . . . . rr_6wpd 1
. 10 . 1964 . 1 1 11 LYS CG C 11.191 6.493 1.508 . . . 1.0 . . . . . . . . . . . . A . 11 LYS CG . . . . . . . . . rr_6wpd 1
. 10 . 1965 . 1 1 11 LYS H H 11.324 8.881 2.849 . . . 1.0 . . . . . . . . . . . . A . 11 LYS H . . . . . . . . . rr_6wpd 1
. 10 . 1966 . 1 1 11 LYS HA H 11.890 8.593 0.109 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HA . . . . . . . . . rr_6wpd 1
. 10 . 1967 . 1 1 11 LYS HB2 H 9.509 7.808 1.722 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HB2 . . . . . . . . . rr_6wpd 1
. 10 . 1968 . 1 1 11 LYS HB3 H 9.803 7.286 0.068 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HB3 . . . . . . . . . rr_6wpd 1
. 10 . 1969 . 1 1 11 LYS HD2 H 9.581 5.131 1.864 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HD2 . . . . . . . . . rr_6wpd 1
. 10 . 1970 . 1 1 11 LYS HD3 H 10.344 5.012 0.279 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HD3 . . . . . . . . . rr_6wpd 1
. 10 . 1971 . 1 1 11 LYS HE2 H 11.117 3.092 1.451 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HE2 . . . . . . . . . rr_6wpd 1
. 10 . 1972 . 1 1 11 LYS HE3 H 12.455 4.236 1.520 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HE3 . . . . . . . . . rr_6wpd 1
. 10 . 1973 . 1 1 11 LYS HG2 H 12.125 6.497 0.964 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HG2 . . . . . . . . . rr_6wpd 1
. 10 . 1974 . 1 1 11 LYS HG3 H 11.384 6.653 2.551 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HG3 . . . . . . . . . rr_6wpd 1
. 10 . 1975 . 1 1 11 LYS HZ1 H 11.647 3.061 3.670 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HZ1 . . . . . . . . . rr_6wpd 1
. 10 . 1976 . 1 1 11 LYS HZ2 H 10.432 4.250 3.653 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HZ2 . . . . . . . . . rr_6wpd 1
. 10 . 1977 . 1 1 11 LYS HZ3 H 12.067 4.703 3.718 . . . 1.0 . . . . . . . . . . . . A . 11 LYS HZ3 . . . . . . . . . rr_6wpd 1
. 10 . 1978 . 1 1 11 LYS N N 11.581 9.339 2.022 . . . 1.0 . . . . . . . . . . . . A . 11 LYS N . . . . . . . . . rr_6wpd 1
. 10 . 1979 . 1 1 11 LYS NZ N 11.393 4.012 3.333 . . . 1.0 . . . . . . . . . . . . A . 11 LYS NZ . . . . . . . . . rr_6wpd 1
. 10 . 1980 . 1 1 11 LYS O O 10.276 10.075 -1.158 . . . 1.0 . . . . . . . . . . . . A . 11 LYS O . . . . . . . . . rr_6wpd 1
. 10 . 1981 . 1 1 12 ALA C C 9.286 12.760 -0.267 . . . 1.0 . . . . . . . . . . . . A . 12 ALA C . . . . . . . . . rr_6wpd 1
. 10 . 1982 . 1 1 12 ALA CA C 8.489 11.595 0.319 . . . 1.0 . . . . . . . . . . . . A . 12 ALA CA . . . . . . . . . rr_6wpd 1
. 10 . 1983 . 1 1 12 ALA CB C 7.593 12.111 1.443 . . . 1.0 . . . . . . . . . . . . A . 12 ALA CB . . . . . . . . . rr_6wpd 1
. 10 . 1984 . 1 1 12 ALA H H 9.366 10.372 1.806 . . . 1.0 . . . . . . . . . . . . A . 12 ALA H . . . . . . . . . rr_6wpd 1
. 10 . 1985 . 1 1 12 ALA HA H 7.869 11.165 -0.452 . . . 1.0 . . . . . . . . . . . . A . 12 ALA HA . . . . . . . . . rr_6wpd 1
. 10 . 1986 . 1 1 12 ALA HB1 H 6.877 12.812 1.043 . . . 1.0 . . . . . . . . . . . . A . 12 ALA HB1 . . . . . . . . . rr_6wpd 1
. 10 . 1987 . 1 1 12 ALA HB2 H 8.201 12.604 2.185 . . . 1.0 . . . . . . . . . . . . A . 12 ALA HB2 . . . . . . . . . rr_6wpd 1
. 10 . 1988 . 1 1 12 ALA HB3 H 7.071 11.281 1.899 . . . 1.0 . . . . . . . . . . . . A . 12 ALA HB3 . . . . . . . . . rr_6wpd 1
. 10 . 1989 . 1 1 12 ALA N N 9.379 10.570 0.848 . . . 1.0 . . . . . . . . . . . . A . 12 ALA N . . . . . . . . . rr_6wpd 1
. 10 . 1990 . 1 1 12 ALA O O 8.931 13.310 -1.310 . . . 1.0 . . . . . . . . . . . . A . 12 ALA O . . . . . . . . . rr_6wpd 1
. 10 . 1991 . 1 1 13 ALA C C 11.863 13.943 -1.352 . . . 1.0 . . . . . . . . . . . . A . 13 ALA C . . . . . . . . . rr_6wpd 1
. 10 . 1992 . 1 1 13 ALA CA C 11.197 14.248 -0.014 . . . 1.0 . . . . . . . . . . . . A . 13 ALA CA . . . . . . . . . rr_6wpd 1
. 10 . 1993 . 1 1 13 ALA CB C 12.270 14.525 1.041 . . . 1.0 . . . . . . . . . . . . A . 13 ALA CB . . . . . . . . . rr_6wpd 1
. 10 . 1994 . 1 1 13 ALA H H 10.578 12.670 1.256 . . . 1.0 . . . . . . . . . . . . A . 13 ALA H . . . . . . . . . rr_6wpd 1
. 10 . 1995 . 1 1 13 ALA HA H 10.585 15.126 -0.122 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HA . . . . . . . . . rr_6wpd 1
. 10 . 1996 . 1 1 13 ALA HB1 H 12.804 15.428 0.784 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB1 . . . . . . . . . rr_6wpd 1
. 10 . 1997 . 1 1 13 ALA HB2 H 12.961 13.696 1.076 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB2 . . . . . . . . . rr_6wpd 1
. 10 . 1998 . 1 1 13 ALA HB3 H 11.803 14.646 2.008 . . . 1.0 . . . . . . . . . . . . A . 13 ALA HB3 . . . . . . . . . rr_6wpd 1
. 10 . 1999 . 1 1 13 ALA N N 10.355 13.139 0.426 . . . 1.0 . . . . . . . . . . . . A . 13 ALA N . . . . . . . . . rr_6wpd 1
. 10 . 2000 . 1 1 13 ALA O O 11.992 14.819 -2.210 . . . 1.0 . . . . . . . . . . . . A . 13 ALA O . . . . . . . . . rr_6wpd 1
. 10 . 2001 . 1 1 14 GLY C C 13.068 10.767 -2.823 . . . 1.0 . . . . . . . . . . . . A . 14 GLY C . . . . . . . . . rr_6wpd 1
. 10 . 2002 . 1 1 14 GLY CA C 12.937 12.283 -2.759 . . . 1.0 . . . . . . . . . . . . A . 14 GLY CA . . . . . . . . . rr_6wpd 1
. 10 . 2003 . 1 1 14 GLY H H 12.153 12.048 -0.804 . . . 1.0 . . . . . . . . . . . . A . 14 GLY H . . . . . . . . . rr_6wpd 1
. 10 . 2004 . 1 1 14 GLY HA2 H 12.356 12.627 -3.601 . . . 1.0 . . . . . . . . . . . . A . 14 GLY HA2 . . . . . . . . . rr_6wpd 1
. 10 . 2005 . 1 1 14 GLY HA3 H 13.922 12.725 -2.804 . . . 1.0 . . . . . . . . . . . . A . 14 GLY HA3 . . . . . . . . . rr_6wpd 1
. 10 . 2006 . 1 1 14 GLY N N 12.283 12.699 -1.524 . . . 1.0 . . . . . . . . . . . . A . 14 GLY N . . . . . . . . . rr_6wpd 1
. 10 . 2007 . 1 1 14 GLY O O 14.105 10.215 -2.454 . . . 1.0 . . . . . . . . . . . . A . 14 GLY O . . . . . . . . . rr_6wpd 1
. 10 . 2008 . 1 1 15 NH2 HN1 H 11.247 10.497 -3.566 . . . 1.0 . . . . . . . . . . . . A . 15 NH2 HN1 . . . . . . . . . rr_6wpd 1
. 10 . 2009 . 1 1 15 NH2 HN2 H 12.147 9.079 -3.315 . . . 1.0 . . . . . . . . . . . . A . 15 NH2 HN2 . . . . . . . . . rr_6wpd 1
. 10 . 2010 . 1 1 15 NH2 N N 12.072 10.055 -3.272 . . . 1.0 . . . . . . . . . . . . A . 15 NH2 N . . . . . . . . . rr_6wpd 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_6wpd
_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 6wpd.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 rr_6wpd 1
1 6wpd.mr . . XPLOR/CNS 2 "dihedral angle" "Not applicable" "Not applicable" 24 rr_6wpd 1
1 6wpd.mr . . unknown 3 distance NOE simple 0 rr_6wpd 1
1 6wpd.mr . . "MR format" 4 "nomenclature mapping" "Not applicable" "Not applicable" 0 rr_6wpd 1
stop_
save_
save_constraint_statistics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Sf_framecode constraint_statistics
_Constraint_stat_list.Entry_ID rr_6wpd
_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 "From CCPN project: '6wpd'" . . . . "dihedral angle" "Not applicable" . 24 rr_6wpd 1
stop_
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 6wpd.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 rr_6wpd 1
1 6wpd.mr . . XPLOR/CNS 2 "dihedral angle" "Not applicable" "Not applicable" 24 rr_6wpd 1
1 6wpd.mr . . unknown 3 distance NOE simple 0 rr_6wpd 1
1 6wpd.mr . . "MR format" 4 "nomenclature mapping" "Not applicable" "Not applicable" 0 rr_6wpd 1
stop_
save_
save_CNS/XPLOR_dihedral_2
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Sf_framecode CNS/XPLOR_dihedral_2
_Torsion_angle_constraint_list.Entry_ID rr_6wpd
_Torsion_angle_constraint_list.ID 1
_Torsion_angle_constraint_list.Details "Generated by Wattos"
_Torsion_angle_constraint_list.Constraint_file_ID 1
_Torsion_angle_constraint_list.Block_ID 2
loop_
_Torsion_angle_constraint_software.Software_ID
_Torsion_angle_constraint_software.Software_label
_Torsion_angle_constraint_software.Method_ID
_Torsion_angle_constraint_software.Method_label
_Torsion_angle_constraint_software.Entry_ID
_Torsion_angle_constraint_software.Torsion_angle_constraint_list_ID
. . . . rr_6wpd 1
stop_
loop_
_Torsion_angle_constraint.ID
_Torsion_angle_constraint.Torsion_angle_name
_Torsion_angle_constraint.Assembly_atom_ID_1
_Torsion_angle_constraint.Entity_assembly_ID_1
_Torsion_angle_constraint.Entity_ID_1
_Torsion_angle_constraint.Comp_index_ID_1
_Torsion_angle_constraint.Seq_ID_1
_Torsion_angle_constraint.Comp_ID_1
_Torsion_angle_constraint.Atom_ID_1
_Torsion_angle_constraint.Atom_type_1
_Torsion_angle_constraint.Resonance_ID_1
_Torsion_angle_constraint.Assembly_atom_ID_2
_Torsion_angle_constraint.Entity_assembly_ID_2
_Torsion_angle_constraint.Entity_ID_2
_Torsion_angle_constraint.Comp_index_ID_2
_Torsion_angle_constraint.Seq_ID_2
_Torsion_angle_constraint.Comp_ID_2
_Torsion_angle_constraint.Atom_ID_2
_Torsion_angle_constraint.Atom_type_2
_Torsion_angle_constraint.Resonance_ID_2
_Torsion_angle_constraint.Assembly_atom_ID_3
_Torsion_angle_constraint.Entity_assembly_ID_3
_Torsion_angle_constraint.Entity_ID_3
_Torsion_angle_constraint.Comp_index_ID_3
_Torsion_angle_constraint.Seq_ID_3
_Torsion_angle_constraint.Comp_ID_3
_Torsion_angle_constraint.Atom_ID_3
_Torsion_angle_constraint.Atom_type_3
_Torsion_angle_constraint.Resonance_ID_3
_Torsion_angle_constraint.Assembly_atom_ID_4
_Torsion_angle_constraint.Entity_assembly_ID_4
_Torsion_angle_constraint.Entity_ID_4
_Torsion_angle_constraint.Comp_index_ID_4
_Torsion_angle_constraint.Seq_ID_4
_Torsion_angle_constraint.Comp_ID_4
_Torsion_angle_constraint.Atom_ID_4
_Torsion_angle_constraint.Atom_type_4
_Torsion_angle_constraint.Resonance_ID_4
_Torsion_angle_constraint.Angle_lower_bound_val
_Torsion_angle_constraint.Angle_upper_bound_val
_Torsion_angle_constraint.Source_experiment_ID
_Torsion_angle_constraint.PDB_record_ID_1
_Torsion_angle_constraint.PDB_model_num_1
_Torsion_angle_constraint.PDB_strand_ID_1
_Torsion_angle_constraint.PDB_ins_code_1
_Torsion_angle_constraint.PDB_residue_no_1
_Torsion_angle_constraint.PDB_residue_name_1
_Torsion_angle_constraint.PDB_atom_name_1
_Torsion_angle_constraint.PDB_record_ID_2
_Torsion_angle_constraint.PDB_model_num_2
_Torsion_angle_constraint.PDB_strand_ID_2
_Torsion_angle_constraint.PDB_ins_code_2
_Torsion_angle_constraint.PDB_residue_no_2
_Torsion_angle_constraint.PDB_residue_name_2
_Torsion_angle_constraint.PDB_atom_name_2
_Torsion_angle_constraint.PDB_record_ID_3
_Torsion_angle_constraint.PDB_model_num_3
_Torsion_angle_constraint.PDB_strand_ID_3
_Torsion_angle_constraint.PDB_ins_code_3
_Torsion_angle_constraint.PDB_residue_no_3
_Torsion_angle_constraint.PDB_residue_name_3
_Torsion_angle_constraint.PDB_atom_name_3
_Torsion_angle_constraint.PDB_record_ID_4
_Torsion_angle_constraint.PDB_model_num_4
_Torsion_angle_constraint.PDB_strand_ID_4
_Torsion_angle_constraint.PDB_ins_code_4
_Torsion_angle_constraint.PDB_residue_no_4
_Torsion_angle_constraint.PDB_residue_name_4
_Torsion_angle_constraint.PDB_atom_name_4
_Torsion_angle_constraint.Auth_entity_assembly_ID_1
_Torsion_angle_constraint.Auth_asym_ID_1
_Torsion_angle_constraint.Auth_chain_ID_1
_Torsion_angle_constraint.Auth_seq_ID_1
_Torsion_angle_constraint.Auth_comp_ID_1
_Torsion_angle_constraint.Auth_atom_ID_1
_Torsion_angle_constraint.Auth_alt_ID_1
_Torsion_angle_constraint.Auth_atom_name_1
_Torsion_angle_constraint.Auth_entity_assembly_ID_2
_Torsion_angle_constraint.Auth_asym_ID_2
_Torsion_angle_constraint.Auth_chain_ID_2
_Torsion_angle_constraint.Auth_seq_ID_2
_Torsion_angle_constraint.Auth_comp_ID_2
_Torsion_angle_constraint.Auth_atom_ID_2
_Torsion_angle_constraint.Auth_alt_ID_2
_Torsion_angle_constraint.Auth_atom_name_2
_Torsion_angle_constraint.Auth_entity_assembly_ID_3
_Torsion_angle_constraint.Auth_asym_ID_3
_Torsion_angle_constraint.Auth_chain_ID_3
_Torsion_angle_constraint.Auth_seq_ID_3
_Torsion_angle_constraint.Auth_comp_ID_3
_Torsion_angle_constraint.Auth_atom_ID_3
_Torsion_angle_constraint.Auth_alt_ID_3
_Torsion_angle_constraint.Auth_atom_name_3
_Torsion_angle_constraint.Auth_entity_assembly_ID_4
_Torsion_angle_constraint.Auth_asym_ID_4
_Torsion_angle_constraint.Auth_chain_ID_4
_Torsion_angle_constraint.Auth_seq_ID_4
_Torsion_angle_constraint.Auth_comp_ID_4
_Torsion_angle_constraint.Auth_atom_ID_4
_Torsion_angle_constraint.Auth_alt_ID_4
_Torsion_angle_constraint.Auth_atom_name_4
_Torsion_angle_constraint.Entry_ID
_Torsion_angle_constraint.Torsion_angle_constraint_list_ID
1 . . 1 1 1 1 GLY C C . . 1 1 2 2 ILE N N . . 1 1 2 2 ILE CA C . . 1 1 2 2 ILE C C . -165.45 -78.69 . . . A . 1 GLY C . . A . 2 ILE N . . A . 2 ILE CA . . A . 2 ILE C . . . 1 . C . . . . . 2 . N . . . . . 2 . CA . . . . . 2 . C . . rr_6wpd 1
2 . . 1 1 2 2 ILE C C . . 1 1 3 3 LEU N N . . 1 1 3 3 LEU CA C . . 1 1 3 3 LEU C C . -154.89 -34.99 . . . A . 2 ILE C . . A . 3 LEU N . . A . 3 LEU CA . . A . 3 LEU C . . . 2 . C . . . . . 3 . N . . . . . 3 . CA . . . . . 3 . C . . rr_6wpd 1
3 . . 1 1 3 3 LEU C C . . 1 1 4 4 ASP N N . . 1 1 4 4 ASP CA C . . 1 1 4 4 ASP C C . -64.37 -53.53 . . . A . 3 LEU C . . A . 4 ASP N . . A . 4 ASP CA . . A . 4 ASP C . . . 3 . C . . . . . 4 . N . . . . . 4 . CA . . . . . 4 . C . . rr_6wpd 1
4 . . 1 1 4 4 ASP C C . . 1 1 5 5 ALA N N . . 1 1 5 5 ALA CA C . . 1 1 5 5 ALA C C . -70.67 -55.61 . . . A . 4 ASP C . . A . 5 ALA N . . A . 5 ALA CA . . A . 5 ALA C . . . 4 . C . . . . . 5 . N . . . . . 5 . CA . . . . . 5 . C . . rr_6wpd 1
5 . . 1 1 5 5 ALA C C . . 1 1 6 6 ILE N N . . 1 1 6 6 ILE CA C . . 1 1 6 6 ILE C C . -73.14 -60.64 . . . A . 5 ALA C . . A . 6 ILE N . . A . 6 ILE CA . . A . 6 ILE C . . . 5 . C . . . . . 6 . N . . . . . 6 . CA . . . . . 6 . C . . rr_6wpd 1
6 . . 1 1 6 6 ILE C C . . 1 1 7 7 LYS N N . . 1 1 7 7 LYS CA C . . 1 1 7 7 LYS C C . -69.62 -50.74 . . . A . 6 ILE C . . A . 7 LYS N . . A . 7 LYS CA . . A . 7 LYS C . . . 6 . C . . . . . 7 . N . . . . . 7 . CA . . . . . 7 . C . . rr_6wpd 1
7 . . 1 1 7 7 LYS C C . . 1 1 8 8 ALA N N . . 1 1 8 8 ALA CA C . . 1 1 8 8 ALA C C . -74.73 -53.37 . . . A . 7 LYS C . . A . 8 ALA N . . A . 8 ALA CA . . A . 8 ALA C . . . 7 . C . . . . . 8 . N . . . . . 8 . CA . . . . . 8 . C . . rr_6wpd 1
8 . . 1 1 8 8 ALA C C . . 1 1 9 9 ILE N N . . 1 1 9 9 ILE CA C . . 1 1 9 9 ILE C C . -79.23 -50.21 . . . A . 8 ALA C . . A . 9 ILE N . . A . 9 ILE CA . . A . 9 ILE C . . . 8 . C . . . . . 9 . N . . . . . 9 . CA . . . . . 9 . C . . rr_6wpd 1
9 . . 1 1 9 9 ILE C C . . 1 1 10 10 ALA N N . . 1 1 10 10 ALA CA C . . 1 1 10 10 ALA C C . -74.05 -51.17 . . . A . 9 ILE C . . A . 10 ALA N . . A . 10 ALA CA . . A . 10 ALA C . . . 9 . C . . . . . 10 . N . . . . . 10 . CA . . . . . 10 . C . . rr_6wpd 1
10 . . 1 1 10 10 ALA C C . . 1 1 11 11 LYS N N . . 1 1 11 11 LYS CA C . . 1 1 11 11 LYS C C . -70.45 -54.97 . . . A . 10 ALA C . . A . 11 LYS N . . A . 11 LYS CA . . A . 11 LYS C . . . 10 . C . . . . . 11 . N . . . . . 11 . CA . . . . . 11 . C . . rr_6wpd 1
11 . . 1 1 11 11 LYS C C . . 1 1 12 12 ALA N N . . 1 1 12 12 ALA CA C . . 1 1 12 12 ALA C C . -75.88 -53.74 . . . A . 11 LYS C . . A . 12 ALA N . . A . 12 ALA CA . . A . 12 ALA C . . . 11 . C . . . . . 12 . N . . . . . 12 . CA . . . . . 12 . C . . rr_6wpd 1
12 . . 1 1 12 12 ALA C C . . 1 1 13 13 ALA N N . . 1 1 13 13 ALA CA C . . 1 1 13 13 ALA C C . -86.55 -46.55 . . . A . 12 ALA C . . A . 13 ALA N . . A . 13 ALA CA . . A . 13 ALA C . . . 12 . C . . . . . 13 . N . . . . . 13 . CA . . . . . 13 . C . . rr_6wpd 1
13 . . 1 1 2 2 ILE N N . . 1 1 2 2 ILE CA C . . 1 1 2 2 ILE C C . . 1 1 3 3 LEU N N . 141.31 184.81 . . . A . 2 ILE N . . A . 2 ILE CA . . A . 2 ILE C . . A . 3 LEU N . . . 2 . N . . . . . 2 . CA . . . . . 2 . C . . . . . 3 . N . . rr_6wpd 1
14 . . 1 1 3 3 LEU N N . . 1 1 3 3 LEU CA C . . 1 1 3 3 LEU C C . . 1 1 4 4 ASP N N . 150.46 176.86 . . . A . 3 LEU N . . A . 3 LEU CA . . A . 3 LEU C . . A . 4 ASP N . . . 3 . N . . . . . 3 . CA . . . . . 3 . C . . . . . 4 . N . . rr_6wpd 1
15 . . 1 1 4 4 ASP N N . . 1 1 4 4 ASP CA C . . 1 1 4 4 ASP C C . . 1 1 5 5 ALA N N . -50.40 -32.86 . . . A . 4 ASP N . . A . 4 ASP CA . . A . 4 ASP C . . A . 5 ALA N . . . 4 . N . . . . . 4 . CA . . . . . 4 . C . . . . . 5 . N . . rr_6wpd 1
16 . . 1 1 5 5 ALA N N . . 1 1 5 5 ALA CA C . . 1 1 5 5 ALA C C . . 1 1 6 6 ILE N N . -55.99 -27.89 . . . A . 5 ALA N . . A . 5 ALA CA . . A . 5 ALA C . . A . 6 ILE N . . . 5 . N . . . . . 5 . CA . . . . . 5 . C . . . . . 6 . N . . rr_6wpd 1
17 . . 1 1 6 6 ILE N N . . 1 1 6 6 ILE CA C . . 1 1 6 6 ILE C C . . 1 1 7 7 LYS N N . -50.29 -36.43 . . . A . 6 ILE N . . A . 6 ILE CA . . A . 6 ILE C . . A . 7 LYS N . . . 6 . N . . . . . 6 . CA . . . . . 6 . C . . . . . 7 . N . . rr_6wpd 1
18 . . 1 1 7 7 LYS N N . . 1 1 7 7 LYS CA C . . 1 1 7 7 LYS C C . . 1 1 8 8 ALA N N . -54.51 -30.25 . . . A . 7 LYS N . . A . 7 LYS CA . . A . 7 LYS C . . A . 8 ALA N . . . 7 . N . . . . . 7 . CA . . . . . 7 . C . . . . . 8 . N . . rr_6wpd 1
19 . . 1 1 8 8 ALA N N . . 1 1 8 8 ALA CA C . . 1 1 8 8 ALA C C . . 1 1 9 9 ILE N N . -47.87 -29.45 . . . A . 8 ALA N . . A . 8 ALA CA . . A . 8 ALA C . . A . 9 ILE N . . . 8 . N . . . . . 8 . CA . . . . . 8 . C . . . . . 9 . N . . rr_6wpd 1
20 . . 1 1 9 9 ILE N N . . 1 1 9 9 ILE CA C . . 1 1 9 9 ILE C C . . 1 1 10 10 ALA N N . -57.21 -35.69 . . . A . 9 ILE N . . A . 9 ILE CA . . A . 9 ILE C . . A . 10 ALA N . . . 9 . N . . . . . 9 . CA . . . . . 9 . C . . . . . 10 . N . . rr_6wpd 1
21 . . 1 1 10 10 ALA N N . . 1 1 10 10 ALA CA C . . 1 1 10 10 ALA C C . . 1 1 11 11 LYS N N . -54.21 -25.87 . . . A . 10 ALA N . . A . 10 ALA CA . . A . 10 ALA C . . A . 11 LYS N . . . 10 . N . . . . . 10 . CA . . . . . 10 . C . . . . . 11 . N . . rr_6wpd 1
22 . . 1 1 11 11 LYS N N . . 1 1 11 11 LYS CA C . . 1 1 11 11 LYS C C . . 1 1 12 12 ALA N N . -46.11 -29.23 . . . A . 11 LYS N . . A . 11 LYS CA . . A . 11 LYS C . . A . 12 ALA N . . . 11 . N . . . . . 11 . CA . . . . . 11 . C . . . . . 12 . N . . rr_6wpd 1
23 . . 1 1 12 12 ALA N N . . 1 1 12 12 ALA CA C . . 1 1 12 12 ALA C C . . 1 1 13 13 ALA N N . -63.58 9.26 . . . A . 12 ALA N . . A . 12 ALA CA . . A . 12 ALA C . . A . 13 ALA N . . . 12 . N . . . . . 12 . CA . . . . . 12 . C . . . . . 13 . N . . rr_6wpd 1
24 . . 1 1 13 13 ALA N N . . 1 1 13 13 ALA CA C . . 1 1 13 13 ALA C C . . 1 1 14 14 GLY N N . -56.61 -16.71 . . . A . 13 ALA N . . A . 13 ALA CA . . A . 13 ALA C . . A . 14 GLY N . . . 13 . N . . . . . 13 . CA . . . . . 13 . C . . . . . 14 . N . . rr_6wpd 1
stop_
loop_
_TA_constraint_comment_org.ID
_TA_constraint_comment_org.Comment_text
_TA_constraint_comment_org.Comment_begin_line
_TA_constraint_comment_org.Comment_begin_column
_TA_constraint_comment_org.Comment_end_line
_TA_constraint_comment_org.Comment_end_column
_TA_constraint_comment_org.Entry_ID
_TA_constraint_comment_org.Torsion_angle_constraint_list_ID
1 "1. I 2 Phi -122.07 +/- 43.38 (-165.44 to -78.69)" 2 1 2 51 rr_6wpd 1
2 "2. L 3 Phi -94.94 +/- 59.95 (-154.89 to -34.99)" 7 1 7 50 rr_6wpd 1
3 "3. D 4 Phi -58.95 +/- 5.42 (-64.37 to -53.53)" 12 1 12 48 rr_6wpd 1
4 "4. A 5 Phi -63.14 +/- 7.53 (-70.67 to -55.61)" 17 1 17 48 rr_6wpd 1
5 "5. I 6 Phi -66.89 +/- 6.25 (-73.14 to -60.64)" 22 1 22 48 rr_6wpd 1
6 "6. K 7 Phi -60.18 +/- 9.44 (-69.62 to -50.74)" 27 1 27 48 rr_6wpd 1
7 "7. A 8 Phi -64.05 +/- 10.68 (-74.73 to -53.37)" 32 1 32 49 rr_6wpd 1
8 "8. I 9 Phi -64.72 +/- 14.51 (-79.23 to -50.21)" 37 1 37 49 rr_6wpd 1
9 "9. A 10 Phi -62.61 +/- 11.44 (-74.04 to -51.17)" 42 1 42 50 rr_6wpd 1
10 "10. K 11 Phi -62.71 +/- 7.74 (-70.45 to -54.98)" 47 1 47 50 rr_6wpd 1
11 "11. A 12 Phi -64.81 +/- 11.07 (-75.88 to -53.73)" 52 1 52 51 rr_6wpd 1
12 "12. A 13 Phi -66.55 +/- 20.00 (-86.55 to -46.55)" 57 1 57 51 rr_6wpd 1
13 "13. I 2 Psi 163.06 +/- 21.75 (141.31 to 184.81)" 63 1 63 50 rr_6wpd 1
14 "14. L 3 Psi 163.66 +/- 13.20 (150.46 to 176.86)" 68 1 68 50 rr_6wpd 1
15 "15. D 4 Psi -41.63 +/- 8.77 (-50.39 to -32.86)" 73 1 73 49 rr_6wpd 1
16 "16. A 5 Psi -41.94 +/- 14.05 (-55.99 to -27.88)" 78 1 78 50 rr_6wpd 1
17 "17. I 6 Psi -43.36 +/- 6.93 (-50.29 to -36.43)" 83 1 83 49 rr_6wpd 1
18 "18. K 7 Psi -42.38 +/- 12.13 (-54.52 to -30.25)" 88 1 88 50 rr_6wpd 1
19 "19. A 8 Psi -38.66 +/- 9.21 (-47.87 to -29.45)" 93 1 93 49 rr_6wpd 1
20 "20. I 9 Psi -46.45 +/- 10.76 (-57.20 to -35.69)" 98 1 98 50 rr_6wpd 1
21 "21. A 10 Psi -40.04 +/- 14.17 (-54.21 to -25.88)" 103 1 103 51 rr_6wpd 1
22 "22. K 11 Psi -37.67 +/- 8.44 (-46.11 to -29.23)" 108 1 108 50 rr_6wpd 1
23 "23. A 12 Psi -27.16 +/- 36.42 (-63.58 to 9.25)" 113 1 113 49 rr_6wpd 1
24 "24. A 13 Psi -36.66 +/- 19.95 (-56.61 to -16.71)" 118 1 118 51 rr_6wpd 1
stop_
loop_
_TA_constraint_parse_err.ID
_TA_constraint_parse_err.Content
_TA_constraint_parse_err.Begin_line
_TA_constraint_parse_err.Begin_column
_TA_constraint_parse_err.End_line
_TA_constraint_parse_err.End_column
_TA_constraint_parse_err.Entry_ID
_TA_constraint_parse_err.Torsion_angle_constraint_list_ID
1 "# Restraints file 1: diedro_novo-dpc.tbl" 1 1 1 40 rr_6wpd 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_6wpd
_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 27-APR-20 6WPD *TITLE NMR STRUCTURE OF HSP1-NH2 ANTIMICROBIAL PEPTIDE IN PRESENCE OF DPC-D38
*TITLE 2 MICELLES *COMPND MOL_ID: 1; *COMPND 2 MOLECULE: HSP1-NH2; *COMPND 3 CHAIN: A; *COMPND 4 SYNONYM: HSP1; *COMPND 5 ENGINEERED: YES *SOURCE MOL_ID: 1; *SOURCE 2 SYNTHETIC: YES; *SOURCE 3 ORGANISM_SCIENTIFIC: BOANA PUNCTATA; *SOURCE 4 ORGANISM_COMMON: POLKA-DOT TREE FROG; *SOURCE 5 ORGANISM_TAXID: 2499473 *KEYWDS ANTIMICROBIAL PEPTIDE, ANTIMICROBIAL PROTEIN *EXPDTA SOLUTION NMR *NUMMDL 10 *AUTHOR R.M.VERLY,I.P.GOMES *REVDAT 1 02-SEP-20 6WPD 0
;
save_
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