Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
|
|
597696 | 2n7n RC | 25813 | cing | 4-filtered-FRED | STAR | entry | full | 54 |
data_FRED_restraints_with_modified_coordinates_PDB_code_2n7n
# This FRED archive file contains, for PDB entry <2n7n>:
#
# - Coordinates and sequence information from the PDB mmCIF file
# - NMR restraints from the PDB MR file
#
# In this file, the coordinates and NMR restraints share the same atom names,
# and in this way can differ from the data deposited at the wwPDB. To achieve
# this aim, the NMR restraints were parsed from their original format files, and
# the coordinates and NMR restraints information were subsequently harmonized.
#
# Due to the complexity of this harmonization process and the filtering process
# used in creating these files, the NMR restraints information in these files
# may differ significantly from that in the originally deposited file. Other
# modifications could have occurred to the NMR restraints information, or data
# could have been lost because of parsing or conversion errors. The PDB file
# remains the authoritative reference for the atomic coordinates and the
# originally deposited restraints files remain the primary reference for these
# data.
#
# This file is generated at the BioMagResBank (BMRB) in collaboration with the
# PDBe (formerly MSD) group at the European Bioinformatics Institute (EBI) and
# the CMBI/IMM group at the Radboud University of Nijmegen.
#
# Several software packages were used to produce this file:
#
# - Wattos (BMRB and CMBI/IMM).
# - FormatConverter and NMRStarExport (PDBe).
# - CCPN framework (http://www.ccpn.ac.uk/).
#
# More information about this process can be found in the references below.
# Please cite the original reference for this PDB entry.
#
# JF Doreleijers, A Nederveen, W Vranken, J Lin, AM Bonvin, R Kaptein, JL
# Markley, and EL Ulrich (2005). BioMagResBank databases DOCR and FRED
# containing converted and filtered sets of experimental NMR restraints and
# coordinates from over 500 protein PDB structures. J. Biomol. NMR 32, 1-12.
#
# WF Vranken, W Boucher, TJ Stevens, RH Fogh, A Pajon, M Llinas, EL Ulrich, JL
# Markley, J Ionides, ED Laue (2005). The CCPN data model for NMR spectroscopy:
# development of a software pipeline. Proteins 59, 687-696.
#
# JF Doreleijers, WF Vranken, C Schulte, J Lin, JR Wedell, CJ Penkett, GW Vuister,
# G Vriend, JL Markley, and EL Ulrich (2009). The NMR Restraints Grid at BMRB for
# 5,266 Protein and Nucleic Acid PDB Entries. J Biomol. NMR 45, 389–396.
save_Conversion_project_for_entry_Name_1
_Study_list.Sf_category study_list
_Study_list.Entry_ID 1
_Study_list.ID 1
loop_
_Study.ID
_Study.Name
_Study.Type
_Study.Details
_Study.Entry_ID
_Study.Study_list_ID
1 "Conversion project for entry 1" NMR . 1 1
stop_
save_
save_originalConstraints_1
_Entry.PDB_coordinate_file_version .
_Entry.Sf_category entry_information
_Entry.ID 1
_Entry.Title "Data for entry 1"
_Entry.NMR_STAR_version 3.1.0.8
_Entry.Experimental_method NMR
_Entry.Details .
save_
save_assembly_2n7n
_Assembly.Sf_category assembly
_Assembly.Entry_ID 1
_Assembly.ID 1
_Assembly.Name 2n7n
_Assembly.Number_of_components 1
_Assembly.Organic_ligands .
_Assembly.Metal_ions .
_Assembly.Paramagnetic .
_Assembly.Thiol_state "not present"
_Assembly.Molecular_mass 1082.28
loop_
_Entity_assembly.ID
_Entity_assembly.Entity_assembly_name
_Entity_assembly.Entity_ID
_Entity_assembly.Entity_label
_Entity_assembly.Asym_ID
_Entity_assembly.Details
_Entity_assembly.Entry_ID
_Entity_assembly.Assembly_ID
1 . 1 $Peptide_PG_989 A . 1 1
stop_
save_
save_Peptide_PG_989
_Entity.Sf_category entity
_Entity.Entry_ID 1
_Entity.ID 1
_Entity.Name "Peptide PG 989"
_Entity.Type polymer
_Entity.Polymer_type polypeptide(L)
_Entity.Polymer_seq_one_letter_code XXDPPXRWKX
_Entity.Number_of_monomers 10
loop_
_Entity_comp_index.ID
_Entity_comp_index.Comp_ID
_Entity_comp_index.Comp_label
_Entity_comp_index.Entry_ID
_Entity_comp_index.Entity_ID
1 ACE $ACE 1 1
2 NLE $NLE 1 1
3 ASP . 1 1
4 PRO . 1 1
5 PRO . 1 1
6 . $. 1 1
7 ARG . 1 1
8 TRP . 1 1
9 LYS . 1 1
10 NH2 $NH2 1 1
stop_
loop_
_Entity_poly_seq.Mon_ID
_Entity_poly_seq.Num
_Entity_poly_seq.Comp_index_ID
_Entity_poly_seq.Entry_ID
_Entity_poly_seq.Entity_ID
ACE 1 1 1 1
NLE 2 2 1 1
ASP 3 3 1 1
PRO 4 4 1 1
PRO 5 5 1 1
. 6 6 1 1
ARG 7 7 1 1
TRP 8 8 1 1
LYS 9 9 1 1
NH2 10 10 1 1
stop_
save_
save_ACE
_Chem_comp.Sf_category chem_comp
_Chem_comp.Entry_ID 1
_Chem_comp.ID ACE
_Chem_comp.Type non-polymer
save_
save_NH2
_Chem_comp.Sf_category chem_comp
_Chem_comp.Entry_ID 1
_Chem_comp.ID NH2
_Chem_comp.Type non-polymer
save_
save_.
_Chem_comp.Sf_category chem_comp
_Chem_comp.Entry_ID 1
_Chem_comp.ID .
_Chem_comp.Type non-polymer
save_
save_NLE
_Chem_comp.Sf_category chem_comp
_Chem_comp.Entry_ID 1
_Chem_comp.ID NLE
_Chem_comp.Type non-polymer
save_
save_DYANA/DIANA_distance_constraints_2_1
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID 1
_Distance_constraint_list.ID 1
_Distance_constraint_list.Constraint_type NOE
_Distance_constraint_list.Constraint_file_ID .
_Distance_constraint_list.Block_ID .
loop_
_Dist_constraint_tree.Constraint_ID
_Dist_constraint_tree.Node_ID
_Dist_constraint_tree.Down_node_ID
_Dist_constraint_tree.Right_node_ID
_Dist_constraint_tree.Logic_operation
_Dist_constraint_tree.Entry_ID
_Dist_constraint_tree.Distance_constraint_list_ID
1 1 . . . 1 1
2 1 . . . 1 1
3 1 . . . 1 1
4 1 . . . 1 1
5 1 . . . 1 1
6 1 . . . 1 1
7 1 . . . 1 1
8 1 . . . 1 1
9 1 . . . 1 1
10 1 . . . 1 1
11 1 . . . 1 1
12 1 . . . 1 1
13 1 . . . 1 1
14 1 . . . 1 1
15 1 . . . 1 1
16 1 . . . 1 1
17 1 . . . 1 1
18 1 . . . 1 1
19 1 . . . 1 1
20 1 . . . 1 1
21 1 . . . 1 1
22 1 . . . 1 1
23 1 . . . 1 1
24 1 . . . 1 1
25 1 . . . 1 1
26 1 . . . 1 1
27 1 . . . 1 1
28 1 . . . 1 1
29 1 . . . 1 1
30 1 . . . 1 1
31 1 . . . 1 1
32 1 . . . 1 1
33 1 . . . 1 1
34 1 . . . 1 1
35 1 . . . 1 1
36 1 . . . 1 1
37 1 . . . 1 1
38 1 . . . 1 1
39 1 . . . 1 1
40 1 . . . 1 1
41 1 . . . 1 1
42 1 . . . 1 1
43 1 . . . 1 1
44 1 . . . 1 1
45 1 . . . 1 1
46 1 . . . 1 1
47 1 . . . 1 1
48 1 . . . 1 1
49 1 . . . 1 1
50 1 . . . 1 1
51 1 . . . 1 1
52 1 . . . 1 1
53 1 . . . 1 1
54 1 . . . 1 1
stop_
loop_
_Dist_constraint.Tree_node_member_constraint_ID
_Dist_constraint.Tree_node_member_node_ID
_Dist_constraint.Constraint_tree_node_member_ID
_Dist_constraint.Entity_assembly_ID
_Dist_constraint.Entity_ID
_Dist_constraint.Comp_index_ID
_Dist_constraint.Comp_ID
_Dist_constraint.Atom_ID
_Dist_constraint.Auth_asym_ID
_Dist_constraint.Auth_seq_ID
_Dist_constraint.Auth_comp_ID
_Dist_constraint.Auth_atom_ID
_Dist_constraint.Entry_ID
_Dist_constraint.Distance_constraint_list_ID
1 1 1 1 1 2 NLE HA . 4 NLE HA 1 1
1 1 2 1 1 3 ASP H . 5 ASP HN 1 1
2 1 1 1 1 2 NLE HA . 4 NLE HA 1 1
2 1 2 1 1 8 TRP HA . 10 TRP HA 1 1
3 1 1 1 1 2 NLE HA . 4 NLE HA 1 1
3 1 2 1 1 8 TRP HE3 . 10 TRP HE3 1 1
4 1 1 1 1 2 NLE HA . 4 NLE HA 1 1
4 1 2 1 1 9 LYS H . 11 LYS HN 1 1
5 1 1 1 1 2 NLE HB2 . 4 NLE HB2 1 1
5 1 2 1 1 3 ASP H . 5 ASP HN 1 1
6 1 1 1 1 2 NLE HB3 . 4 NLE HB3 1 1
6 1 2 1 1 3 ASP H . 5 ASP HN 1 1
7 1 1 1 1 3 ASP H . 5 ASP HN 1 1
7 1 2 1 1 3 ASP HB2 . 5 ASP HB2 1 1
8 1 1 1 1 3 ASP H . 5 ASP HN 1 1
8 1 2 1 1 3 ASP QB . 5 ASP QB 1 1
9 1 1 1 1 3 ASP H . 5 ASP HN 1 1
9 1 2 1 1 3 ASP HB3 . 5 ASP HB3 1 1
10 1 1 1 1 3 ASP H . 5 ASP HN 1 1
10 1 2 1 1 9 LYS H . 11 LYS HN 1 1
11 1 1 1 1 3 ASP HA . 5 ASP HA 1 1
11 1 2 1 1 4 PRO HD2 . 6 PRO HD2 1 1
12 1 1 1 1 3 ASP HA . 5 ASP HA 1 1
12 1 2 1 1 4 PRO QD . 6 PRO QD 1 1
13 1 1 1 1 3 ASP HA . 5 ASP HA 1 1
13 1 2 1 1 4 PRO HD3 . 6 PRO HD3 1 1
14 1 1 1 1 3 ASP QB . 5 ASP QB 1 1
14 1 2 1 1 4 PRO QD . 6 PRO QD 1 1
15 1 1 1 1 4 PRO HA . 6 PRO HA 1 1
15 1 2 1 1 5 PRO HA . 7 PRO HA 1 1
16 1 1 1 1 4 PRO HA . 6 PRO HA 1 1
16 1 2 1 1 7 ARG H . 9 ARG HN 1 1
17 1 1 1 1 7 ARG H . 9 ARG HN 1 1
17 1 2 1 1 7 ARG HB2 . 9 ARG HB2 1 1
18 1 1 1 1 7 ARG H . 9 ARG HN 1 1
18 1 2 1 1 7 ARG QB . 9 ARG QB 1 1
19 1 1 1 1 7 ARG H . 9 ARG HN 1 1
19 1 2 1 1 7 ARG HB3 . 9 ARG HB3 1 1
20 1 1 1 1 7 ARG H . 9 ARG HN 1 1
20 1 2 1 1 7 ARG HG2 . 9 ARG HG2 1 1
21 1 1 1 1 7 ARG H . 9 ARG HN 1 1
21 1 2 1 1 7 ARG HG3 . 9 ARG HG3 1 1
22 1 1 1 1 7 ARG H . 9 ARG HN 1 1
22 1 2 1 1 8 TRP H . 10 TRP HN 1 1
23 1 1 1 1 7 ARG HA . 9 ARG HA 1 1
23 1 2 1 1 8 TRP H . 10 TRP HN 1 1
24 1 1 1 1 7 ARG QB . 9 ARG QB 1 1
24 1 2 1 1 8 TRP H . 10 TRP HN 1 1
25 1 1 1 1 7 ARG HB2 . 9 ARG HB2 1 1
25 1 2 1 1 8 TRP H . 10 TRP HN 1 1
26 1 1 1 1 7 ARG HB3 . 9 ARG HB3 1 1
26 1 2 1 1 8 TRP H . 10 TRP HN 1 1
27 1 1 1 1 8 TRP H . 10 TRP HN 1 1
27 1 2 1 1 8 TRP HB2 . 10 TRP HB2 1 1
28 1 1 1 1 8 TRP H . 10 TRP HN 1 1
28 1 2 1 1 8 TRP HB3 . 10 TRP HB3 1 1
29 1 1 1 1 8 TRP H . 10 TRP HN 1 1
29 1 2 1 1 8 TRP HD1 . 10 TRP HD1 1 1
30 1 1 1 1 8 TRP H . 10 TRP HN 1 1
30 1 2 1 1 8 TRP HE3 . 10 TRP HE3 1 1
31 1 1 1 1 8 TRP H . 10 TRP HN 1 1
31 1 2 1 1 9 LYS H . 11 LYS HN 1 1
32 1 1 1 1 8 TRP HA . 10 TRP HA 1 1
32 1 2 1 1 8 TRP HD1 . 10 TRP HD1 1 1
33 1 1 1 1 8 TRP HA . 10 TRP HA 1 1
33 1 2 1 1 8 TRP HE3 . 10 TRP HE3 1 1
34 1 1 1 1 8 TRP HA . 10 TRP HA 1 1
34 1 2 1 1 9 LYS H . 11 LYS HN 1 1
35 1 1 1 1 8 TRP QB . 10 TRP QB 1 1
35 1 2 1 1 8 TRP HE3 . 10 TRP HE3 1 1
36 1 1 1 1 8 TRP QB . 10 TRP QB 1 1
36 1 2 1 1 9 LYS H . 11 LYS HN 1 1
37 1 1 1 1 8 TRP HB2 . 10 TRP HB2 1 1
37 1 2 1 1 8 TRP HD1 . 10 TRP HD1 1 1
38 1 1 1 1 8 TRP HB2 . 10 TRP HB2 1 1
38 1 2 1 1 8 TRP HE3 . 10 TRP HE3 1 1
39 1 1 1 1 8 TRP HB2 . 10 TRP HB2 1 1
39 1 2 1 1 9 LYS H . 11 LYS HN 1 1
40 1 1 1 1 8 TRP HB3 . 10 TRP HB3 1 1
40 1 2 1 1 8 TRP HD1 . 10 TRP HD1 1 1
41 1 1 1 1 8 TRP HB3 . 10 TRP HB3 1 1
41 1 2 1 1 8 TRP HE3 . 10 TRP HE3 1 1
42 1 1 1 1 8 TRP HB3 . 10 TRP HB3 1 1
42 1 2 1 1 9 LYS H . 11 LYS HN 1 1
43 1 1 1 1 8 TRP HD1 . 10 TRP HD1 1 1
43 1 2 1 1 9 LYS H . 11 LYS HN 1 1
44 1 1 1 1 8 TRP HE3 . 10 TRP HE3 1 1
44 1 2 1 1 9 LYS H . 11 LYS HN 1 1
45 1 1 1 1 9 LYS H . 11 LYS HN 1 1
45 1 2 1 1 9 LYS HB2 . 11 LYS HB2 1 1
46 1 1 1 1 9 LYS H . 11 LYS HN 1 1
46 1 2 1 1 9 LYS QB . 11 LYS QB 1 1
47 1 1 1 1 9 LYS H . 11 LYS HN 1 1
47 1 2 1 1 9 LYS HB3 . 11 LYS HB3 1 1
48 1 1 1 1 9 LYS H . 11 LYS HN 1 1
48 1 2 1 1 9 LYS QD . 11 LYS QD 1 1
49 1 1 1 1 9 LYS H . 11 LYS HN 1 1
49 1 2 1 1 9 LYS HG2 . 11 LYS HG2 1 1
50 1 1 1 1 9 LYS H . 11 LYS HN 1 1
50 1 2 1 1 9 LYS QG . 11 LYS QG 1 1
51 1 1 1 1 9 LYS H . 11 LYS HN 1 1
51 1 2 1 1 9 LYS HG3 . 11 LYS HG3 1 1
52 1 1 1 1 9 LYS HA . 11 LYS HA 1 1
52 1 2 1 1 9 LYS QD . 11 LYS QD 1 1
53 1 1 1 1 9 LYS HA . 11 LYS HA 1 1
53 1 2 1 1 9 LYS QG . 11 LYS QG 1 1
54 1 1 1 1 9 LYS QB . 11 LYS QB 1 1
54 1 2 1 1 9 LYS QG . 11 LYS QG 1 1
stop_
loop_
_Dist_constraint_value.Constraint_ID
_Dist_constraint_value.Tree_node_ID
_Dist_constraint_value.Source_experiment_ID
_Dist_constraint_value.Spectral_peak_ID
_Dist_constraint_value.Intensity_val
_Dist_constraint_value.Intensity_lower_val_err
_Dist_constraint_value.Intensity_upper_val_err
_Dist_constraint_value.Distance_val
_Dist_constraint_value.Distance_lower_bound_val
_Dist_constraint_value.Distance_upper_bound_val
_Dist_constraint_value.Entry_ID
_Dist_constraint_value.Distance_constraint_list_ID
1 1 . . . . . . . 2.62 1 1
2 1 . . . . . . . 3.17 1 1
3 1 . . . . . . . 4.38 1 1
4 1 . . . . . . . 3.45 1 1
5 1 . . . . . . . 3.73 1 1
6 1 . . . . . . . 3.73 1 1
7 1 . . . . . . . 3.39 1 1
8 1 . . . . . . . 2.89 1 1
9 1 . . . . . . . 3.39 1 1
10 1 . . . . . . . 4.23 1 1
11 1 . . . . . . . 3.39 1 1
12 1 . . . . . . . 2.93 1 1
13 1 . . . . . . . 3.39 1 1
14 1 . . . . . . . 3.79 1 1
15 1 . . . . . . . 2.49 1 1
16 1 . . . . . . . 4.17 1 1
17 1 . . . . . . . 3.58 1 1
18 1 . . . . . . . 3.01 1 1
19 1 . . . . . . . 3.58 1 1
20 1 . . . . . . . 4.88 1 1
21 1 . . . . . . . 4.88 1 1
22 1 . . . . . . . 4.32 1 1
23 1 . . . . . . . 2.62 1 1
24 1 . . . . . . . 3.23 1 1
25 1 . . . . . . . 3.95 1 1
26 1 . . . . . . . 3.95 1 1
27 1 . . . . . . . 3.08 1 1
28 1 . . . . . . . 3.08 1 1
29 1 . . . . . . . 4.32 1 1
30 1 . . . . . . . 5.5 1 1
31 1 . . . . . . . 4.35 1 1
32 1 . . . . . . . 4.85 1 1
33 1 . . . . . . . 2.93 1 1
34 1 . . . . . . . 2.65 1 1
35 1 . . . . . . . 3.46 1 1
36 1 . . . . . . . 3.54 1 1
37 1 . . . . . . . 3.52 1 1
38 1 . . . . . . . 4.01 1 1
39 1 . . . . . . . 4.11 1 1
40 1 . . . . . . . 3.52 1 1
41 1 . . . . . . . 4.01 1 1
42 1 . . . . . . . 4.11 1 1
43 1 . . . . . . . 5.5 1 1
44 1 . . . . . . . 4.11 1 1
45 1 . . . . . . . 3.52 1 1
46 1 . . . . . . . 2.99 1 1
47 1 . . . . . . . 3.52 1 1
48 1 . . . . . . . 6.0 1 1
49 1 . . . . . . . 4.32 1 1
50 1 . . . . . . . 3.73 1 1
51 1 . . . . . . . 4.32 1 1
52 1 . . . . . . . 5.07 1 1
53 1 . . . . . . . 3.66 1 1
54 1 . . . . . . . 2.29 1 1
stop_
save_
save_conformer_family_coord_set_1
_Conformer_family_coord_set.Sf_category conformer_family_coord_set
_Conformer_family_coord_set.Entry_ID 1
_Conformer_family_coord_set.ID 1
loop_
_Atom_site.Model_ID
_Atom_site.ID
_Atom_site.Label_entity_assembly_ID
_Atom_site.Label_entity_ID
_Atom_site.Label_comp_index_ID
_Atom_site.Label_comp_ID
_Atom_site.Label_atom_ID
_Atom_site.Type_symbol
_Atom_site.Cartn_x
_Atom_site.Cartn_y
_Atom_site.Cartn_z
_Atom_site.Occupancy
_Atom_site.Uncertainty
_Atom_site.PDBX_label_asym_ID
_Atom_site.PDB_strand_ID
_Atom_site.PDB_ins_code
_Atom_site.PDB_residue_no
_Atom_site.PDB_residue_name
_Atom_site.PDB_atom_name
_Atom_site.Entry_ID
_Atom_site.Conformer_family_coord_set_ID
1 1 1 1 1 ACE C C 2.856 -3.722 0.134 1.00 . A A . 3 ACE C 1 1
1 2 1 1 1 ACE CH3 C 3.781 -4.912 -0.023 1.00 . A A . 3 ACE CH3 1 1
1 3 1 1 1 ACE H1 H 3.386 -5.610 -0.784 1.00 . A A . 3 ACE H1 1 1
1 4 1 1 1 ACE H2 H 4.789 -4.603 -0.352 1.00 . A A . 3 ACE H2 1 1
1 5 1 1 1 ACE H3 H 3.875 -5.476 0.922 1.00 . A A . 3 ACE H3 1 1
1 6 1 1 1 ACE O O 1.810 -3.653 -0.508 1.00 . A A . 3 ACE O 1 1
1 7 1 1 2 NLE C C 3.129 -0.319 0.675 1.00 . A A . 4 NLE C 1 1
1 8 1 1 2 NLE CA C 2.455 -1.577 1.309 1.00 . A A . 4 NLE CA 1 1
1 9 1 1 2 NLE CB C 2.359 -1.383 2.845 1.00 . A A . 4 NLE CB 1 1
1 10 1 1 2 NLE CD C 1.534 -2.156 5.150 1.00 . A A . 4 NLE CD 1 1
1 11 1 1 2 NLE CE C 0.883 -3.298 5.941 1.00 . A A . 4 NLE CE 1 1
1 12 1 1 2 NLE CG C 1.701 -2.515 3.664 1.00 . A A . 4 NLE CG 1 1
1 13 1 1 2 NLE H H 4.126 -2.992 1.494 1.00 . A A . 4 NLE H 1 1
1 14 1 1 2 NLE HA H 1.419 -1.685 0.920 1.00 . A A . 4 NLE HA 1 1
1 15 1 1 2 NLE HB2 H 1.802 -0.448 3.035 1.00 . A A . 4 NLE HB2 1 1
1 16 1 1 2 NLE HB3 H 3.373 -1.185 3.235 1.00 . A A . 4 NLE HB3 1 1
1 17 1 1 2 NLE HD2 H 0.918 -1.241 5.252 1.00 . A A . 4 NLE HD2 1 1
1 18 1 1 2 NLE HD3 H 2.517 -1.908 5.597 1.00 . A A . 4 NLE HD3 1 1
1 19 1 1 2 NLE HE1 H 0.756 -3.026 7.006 1.00 . A A . 4 NLE HE1 1 1
1 20 1 1 2 NLE HE2 H -0.121 -3.549 5.550 1.00 . A A . 4 NLE HE2 1 1
1 21 1 1 2 NLE HE3 H 1.491 -4.221 5.911 1.00 . A A . 4 NLE HE3 1 1
1 22 1 1 2 NLE HG2 H 2.304 -3.437 3.571 1.00 . A A . 4 NLE HG2 1 1
1 23 1 1 2 NLE HG3 H 0.714 -2.758 3.233 1.00 . A A . 4 NLE HG3 1 1
1 24 1 1 2 NLE N N 3.253 -2.792 1.000 1.00 . A A . 4 NLE N 1 1
1 25 1 1 2 NLE O O 4.233 0.076 1.065 1.00 . A A . 4 NLE O 1 1
1 26 1 1 3 ASP C C 2.192 2.838 -0.295 1.00 . A A . 5 ASP C 1 1
1 27 1 1 3 ASP CA C 2.930 1.589 -0.903 1.00 . A A . 5 ASP CA 1 1
1 28 1 1 3 ASP CB C 2.737 1.508 -2.433 1.00 . A A . 5 ASP CB 1 1
1 29 1 1 3 ASP CG C 3.748 0.616 -3.167 1.00 . A A . 5 ASP CG 1 1
1 30 1 1 3 ASP H H 1.569 -0.125 -0.565 1.00 . A A . 5 ASP H 1 1
1 31 1 1 3 ASP HA H 4.022 1.693 -0.753 1.00 . A A . 5 ASP HA 1 1
1 32 1 1 3 ASP HB2 H 1.693 1.241 -2.676 1.00 . A A . 5 ASP HB2 1 1
1 33 1 1 3 ASP HB3 H 2.869 2.522 -2.847 1.00 . A A . 5 ASP HB3 1 1
1 34 1 1 3 ASP N N 2.442 0.334 -0.271 1.00 . A A . 5 ASP N 1 1
1 35 1 1 3 ASP O O 0.968 2.920 -0.459 1.00 . A A . 5 ASP O 1 1
1 36 1 1 3 ASP OD1 O 4.898 1.015 -3.350 1.00 . A A . 5 ASP OD1 1 1
1 37 1 1 4 PRO C C 1.351 5.931 -0.075 1.00 . A A . 6 PRO C 1 1
1 38 1 1 4 PRO CA C 2.193 5.047 0.921 1.00 . A A . 6 PRO CA 1 1
1 39 1 1 4 PRO CB C 3.381 5.836 1.508 1.00 . A A . 6 PRO CB 1 1
1 40 1 1 4 PRO CD C 4.290 3.753 0.726 1.00 . A A . 6 PRO CD 1 1
1 41 1 1 4 PRO CG C 4.434 4.782 1.845 1.00 . A A . 6 PRO CG 1 1
1 42 1 1 4 PRO HA H 1.559 4.701 1.758 1.00 . A A . 6 PRO HA 1 1
1 43 1 1 4 PRO HB2 H 3.799 6.543 0.763 1.00 . A A . 6 PRO HB2 1 1
1 44 1 1 4 PRO HB3 H 3.093 6.441 2.388 1.00 . A A . 6 PRO HB3 1 1
1 45 1 1 4 PRO HD2 H 4.907 4.009 -0.158 1.00 . A A . 6 PRO HD2 1 1
1 46 1 1 4 PRO HD3 H 4.596 2.748 1.076 1.00 . A A . 6 PRO HD3 1 1
1 47 1 1 4 PRO HG2 H 5.456 5.200 1.909 1.00 . A A . 6 PRO HG2 1 1
1 48 1 1 4 PRO HG3 H 4.213 4.315 2.826 1.00 . A A . 6 PRO HG3 1 1
1 49 1 1 4 PRO N N 2.860 3.830 0.371 1.00 . A A . 6 PRO N 1 1
1 50 1 1 4 PRO O O 1.804 6.114 -1.211 1.00 . A A . 6 PRO O 1 1
1 51 1 1 5 PRO C C -1.173 5.124 2.118 1.00 . A A . 7 PRO C 1 1
1 52 1 1 5 PRO CA C -0.456 6.437 1.640 1.00 . A A . 7 PRO CA 1 1
1 53 1 1 5 PRO CB C -1.423 7.640 1.570 1.00 . A A . 7 PRO CB 1 1
1 54 1 1 5 PRO CD C -0.595 7.357 -0.667 1.00 . A A . 7 PRO CD 1 1
1 55 1 1 5 PRO CG C -1.860 7.724 0.105 1.00 . A A . 7 PRO CG 1 1
1 56 1 1 5 PRO HA H 0.311 6.666 2.405 1.00 . A A . 7 PRO HA 1 1
1 57 1 1 5 PRO HB2 H -2.283 7.561 2.264 1.00 . A A . 7 PRO HB2 1 1
1 58 1 1 5 PRO HB3 H -0.889 8.568 1.855 1.00 . A A . 7 PRO HB3 1 1
1 59 1 1 5 PRO HD2 H -0.826 6.841 -1.619 1.00 . A A . 7 PRO HD2 1 1
1 60 1 1 5 PRO HD3 H -0.001 8.260 -0.915 1.00 . A A . 7 PRO HD3 1 1
1 61 1 1 5 PRO HG2 H -2.662 6.990 -0.099 1.00 . A A . 7 PRO HG2 1 1
1 62 1 1 5 PRO HG3 H -2.252 8.722 -0.169 1.00 . A A . 7 PRO HG3 1 1
1 63 1 1 5 PRO N N 0.152 6.493 0.271 1.00 . A A . 7 PRO N 1 1
1 64 1 1 5 PRO O O -1.649 5.081 3.255 1.00 . A A . 7 PRO O 1 1
1 65 1 1 6 . C C -2.457 2.049 0.461 1.00 . A A . 8 DPN C 1 1
1 66 1 1 6 . CA C -1.796 2.741 1.692 1.00 . A A . 8 DPN CA 1 1
1 67 1 1 6 . CB C -0.698 1.876 2.391 1.00 . A A . 8 DPN CB 1 1
1 68 1 1 6 . CD1 C -1.630 0.776 4.486 1.00 . A A . 8 DPN CD1 1 1
1 69 1 1 6 . CD2 C -1.375 -0.583 2.505 1.00 . A A . 8 DPN CD2 1 1
1 70 1 1 6 . CE1 C -2.157 -0.319 5.168 1.00 . A A . 8 DPN CE1 1 1
1 71 1 1 6 . CE2 C -1.911 -1.674 3.186 1.00 . A A . 8 DPN CE2 1 1
1 72 1 1 6 . CG C -1.239 0.652 3.149 1.00 . A A . 8 DPN CG 1 1
1 73 1 1 6 . CZ C -2.299 -1.541 4.516 1.00 . A A . 8 DPN CZ 1 1
1 74 1 1 6 . H H -0.677 4.189 0.438 1.00 . A A . 8 DPN H 1 1
1 75 1 1 6 . HA H -2.613 2.909 2.422 1.00 . A A . 8 DPN HA 1 1
1 76 1 1 6 . HB2 H -0.121 2.509 3.085 1.00 . A A . 8 DPN HB2 1 1
1 77 1 1 6 . HB3 H 0.072 1.558 1.661 1.00 . A A . 8 DPN HB3 1 1
1 78 1 1 6 . HD1 H -1.535 1.724 4.999 1.00 . A A . 8 DPN HD1 1 1
1 79 1 1 6 . HD2 H -1.073 -0.700 1.475 1.00 . A A . 8 DPN HD2 1 1
1 80 1 1 6 . HE1 H -2.457 -0.217 6.201 1.00 . A A . 8 DPN HE1 1 1
1 81 1 1 6 . HE2 H -2.017 -2.626 2.688 1.00 . A A . 8 DPN HE2 1 1
1 82 1 1 6 . HZ H -2.709 -2.390 5.046 1.00 . A A . 8 DPN HZ 1 1
1 83 1 1 6 . N N -1.224 4.059 1.299 1.00 . A A . 8 DPN N 1 1
1 84 1 1 6 . O O -3.683 1.904 0.409 1.00 . A A . 8 DPN O 1 1
1 85 1 1 7 ARG C C -1.320 -0.661 -1.431 1.00 . A A . 9 ARG C 1 1
1 86 1 1 7 ARG CA C -2.067 0.698 -1.607 1.00 . A A . 9 ARG CA 1 1
1 87 1 1 7 ARG CB C -1.762 1.330 -2.990 1.00 . A A . 9 ARG CB 1 1
1 88 1 1 7 ARG CD C -3.958 2.719 -3.524 1.00 . A A . 9 ARG CD 1 1
1 89 1 1 7 ARG CG C -2.422 2.691 -3.361 1.00 . A A . 9 ARG CG 1 1
1 90 1 1 7 ARG CZ C -5.929 2.737 -1.964 1.00 . A A . 9 ARG CZ 1 1
1 91 1 1 7 ARG H H -0.660 1.883 -0.391 1.00 . A A . 9 ARG H 1 1
1 92 1 1 7 ARG HA H -3.158 0.506 -1.558 1.00 . A A . 9 ARG HA 1 1
1 93 1 1 7 ARG HB2 H -0.665 1.443 -3.074 1.00 . A A . 9 ARG HB2 1 1
1 94 1 1 7 ARG HB3 H -2.019 0.589 -3.767 1.00 . A A . 9 ARG HB3 1 1
1 95 1 1 7 ARG HD2 H -4.240 3.645 -4.066 1.00 . A A . 9 ARG HD2 1 1
1 96 1 1 7 ARG HD3 H -4.289 1.873 -4.163 1.00 . A A . 9 ARG HD3 1 1
1 97 1 1 7 ARG HE H -4.072 2.514 -1.336 1.00 . A A . 9 ARG HE 1 1
1 98 1 1 7 ARG HG2 H -2.097 3.474 -2.647 1.00 . A A . 9 ARG HG2 1 1
1 99 1 1 7 ARG HG3 H -1.979 3.017 -4.322 1.00 . A A . 9 ARG HG3 1 1
1 100 1 1 7 ARG HH11 H -6.436 3.045 -3.834 1.00 . A A . 9 ARG HH11 1 1
1 101 1 1 7 ARG HH12 H -7.811 2.959 -2.627 1.00 . A A . 9 ARG HH12 1 1
1 102 1 1 7 ARG HH21 H -5.577 2.398 -0.051 1.00 . A A . 9 ARG HH21 1 1
1 103 1 1 7 ARG HH22 H -7.329 2.618 -0.545 1.00 . A A . 9 ARG HH22 1 1
1 104 1 1 7 ARG N N -1.648 1.618 -0.522 1.00 . A A . 9 ARG N 1 1
1 105 1 1 7 ARG NE N -4.623 2.685 -2.194 1.00 . A A . 9 ARG NE 1 1
1 106 1 1 7 ARG NH1 N -6.826 2.930 -2.897 1.00 . A A . 9 ARG NH1 1 1
1 107 1 1 7 ARG NH2 N -6.326 2.582 -0.735 1.00 . A A . 9 ARG NH2 1 1
1 108 1 1 7 ARG O O -0.092 -0.708 -1.275 1.00 . A A . 9 ARG O 1 1
1 109 1 1 8 TRP C C -1.173 -3.838 -2.559 1.00 . A A . 10 TRP C 1 1
1 110 1 1 8 TRP CA C -1.528 -3.125 -1.218 1.00 . A A . 10 TRP CA 1 1
1 111 1 1 8 TRP CB C -2.561 -3.913 -0.375 1.00 . A A . 10 TRP CB 1 1
1 112 1 1 8 TRP CD1 C -2.732 -6.484 -0.699 1.00 . A A . 10 TRP CD1 1 1
1 113 1 1 8 TRP CD2 C -1.219 -5.859 0.801 1.00 . A A . 10 TRP CD2 1 1
1 114 1 1 8 TRP CE2 C -1.195 -7.270 0.663 1.00 . A A . 10 TRP CE2 1 1
1 115 1 1 8 TRP CE3 C -0.295 -5.204 1.648 1.00 . A A . 10 TRP CE3 1 1
1 116 1 1 8 TRP CG C -2.189 -5.363 -0.048 1.00 . A A . 10 TRP CG 1 1
1 117 1 1 8 TRP CH2 C 0.653 -7.374 2.221 1.00 . A A . 10 TRP CH2 1 1
1 118 1 1 8 TRP CZ2 C -0.247 -8.035 1.380 1.00 . A A . 10 TRP CZ2 1 1
1 119 1 1 8 TRP CZ3 C 0.628 -5.980 2.351 1.00 . A A . 10 TRP CZ3 1 1
1 120 1 1 8 TRP H H -3.033 -1.634 -1.783 1.00 . A A . 10 TRP H 1 1
1 121 1 1 8 TRP HA H -0.622 -3.043 -0.581 1.00 . A A . 10 TRP HA 1 1
1 122 1 1 8 TRP HB2 H -2.738 -3.386 0.576 1.00 . A A . 10 TRP HB2 1 1
1 123 1 1 8 TRP HB3 H -3.531 -3.907 -0.901 1.00 . A A . 10 TRP HB3 1 1
1 124 1 1 8 TRP HD1 H -3.461 -6.395 -1.491 1.00 . A A . 10 TRP HD1 1 1
1 125 1 1 8 TRP HE1 H -2.348 -8.647 -0.558 1.00 . A A . 10 TRP HE1 1 1
1 126 1 1 8 TRP HE3 H -0.293 -4.127 1.722 1.00 . A A . 10 TRP HE3 1 1
1 127 1 1 8 TRP HH2 H 1.384 -7.947 2.772 1.00 . A A . 10 TRP HH2 1 1
1 128 1 1 8 TRP HZ2 H -0.212 -9.109 1.272 1.00 . A A . 10 TRP HZ2 1 1
1 129 1 1 8 TRP HZ3 H 1.344 -5.498 3.001 1.00 . A A . 10 TRP HZ3 1 1
1 130 1 1 8 TRP N N -2.077 -1.767 -1.443 1.00 . A A . 10 TRP N 1 1
1 131 1 1 8 TRP NE1 N -2.138 -7.686 -0.266 1.00 . A A . 10 TRP NE1 1 1
1 132 1 1 8 TRP O O -1.968 -3.917 -3.501 1.00 . A A . 10 TRP O 1 1
1 133 1 1 9 LYS C C 1.202 -6.560 -3.109 1.00 . A A . 11 LYS C 1 1
1 134 1 1 9 LYS CA C 0.546 -5.258 -3.671 1.00 . A A . 11 LYS CA 1 1
1 135 1 1 9 LYS CB C 1.448 -4.377 -4.576 1.00 . A A . 11 LYS CB 1 1
1 136 1 1 9 LYS CD C 3.334 -2.658 -4.919 1.00 . A A . 11 LYS CD 1 1
1 137 1 1 9 LYS CE C 4.181 -1.557 -4.250 1.00 . A A . 11 LYS CE 1 1
1 138 1 1 9 LYS CG C 2.639 -3.626 -3.934 1.00 . A A . 11 LYS CG 1 1
1 139 1 1 9 LYS H H 0.625 -4.132 -1.780 1.00 . A A . 11 LYS H 1 1
1 140 1 1 9 LYS HA H -0.288 -5.599 -4.316 1.00 . A A . 11 LYS HA 1 1
1 141 1 1 9 LYS HB2 H 1.833 -5.008 -5.391 1.00 . A A . 11 LYS HB2 1 1
1 142 1 1 9 LYS HB3 H 0.790 -3.630 -5.057 1.00 . A A . 11 LYS HB3 1 1
1 143 1 1 9 LYS HD2 H 3.978 -3.247 -5.599 1.00 . A A . 11 LYS HD2 1 1
1 144 1 1 9 LYS HD3 H 2.593 -2.176 -5.586 1.00 . A A . 11 LYS HD3 1 1
1 145 1 1 9 LYS HE2 H 4.897 -1.998 -3.528 1.00 . A A . 11 LYS HE2 1 1
1 146 1 1 9 LYS HE3 H 4.801 -1.055 -5.019 1.00 . A A . 11 LYS HE3 1 1
1 147 1 1 9 LYS HG2 H 2.265 -3.060 -3.061 1.00 . A A . 11 LYS HG2 1 1
1 148 1 1 9 LYS HG3 H 3.369 -4.348 -3.522 1.00 . A A . 11 LYS HG3 1 1
1 149 1 1 9 LYS HZ1 H 2.344 -0.789 -3.296 1.00 . A A . 11 LYS HZ1 1 1
1 150 1 1 9 LYS N N 0.023 -4.424 -2.562 1.00 . A A . 11 LYS N 1 1
1 151 1 1 9 LYS NZ N 3.307 -0.573 -3.572 1.00 . A A . 11 LYS NZ 1 1
1 152 1 1 9 LYS O O 2.416 -6.743 -3.055 1.00 . A A . 11 LYS O 1 1
1 153 1 1 10 NH2 HN1 H 0.948 -8.271 -2.192 1.00 . A A . 12 NH2 HN1 1 1
1 154 1 1 10 NH2 HN2 H -0.554 -7.273 -2.494 1.00 . A A . 12 NH2 HN2 1 1
1 155 1 1 10 NH2 N N 0.425 -7.528 -2.661 1.00 . A A . 12 NH2 N 1 1
2 156 1 1 1 ACE C C 2.999 -4.311 0.240 1.00 . A A . 3 ACE C 1 1
2 157 1 1 1 ACE CH3 C 4.015 -5.436 0.181 1.00 . A A . 3 ACE CH3 1 1
2 158 1 1 1 ACE H1 H 4.701 -5.308 -0.675 1.00 . A A . 3 ACE H1 1 1
2 159 1 1 1 ACE H2 H 4.619 -5.497 1.105 1.00 . A A . 3 ACE H2 1 1
2 160 1 1 1 ACE H3 H 3.511 -6.411 0.063 1.00 . A A . 3 ACE H3 1 1
2 161 1 1 1 ACE O O 1.825 -4.506 -0.076 1.00 . A A . 3 ACE O 1 1
2 162 1 1 2 NLE C C 3.290 -0.651 0.273 1.00 . A A . 4 NLE C 1 1
2 163 1 1 2 NLE CA C 2.638 -1.935 0.872 1.00 . A A . 4 NLE CA 1 1
2 164 1 1 2 NLE CB C 2.428 -1.798 2.401 1.00 . A A . 4 NLE CB 1 1
2 165 1 1 2 NLE CD C 1.129 -0.740 4.372 1.00 . A A . 4 NLE CD 1 1
2 166 1 1 2 NLE CE C 2.267 -0.079 5.165 1.00 . A A . 4 NLE CE 1 1
2 167 1 1 2 NLE CG C 1.362 -0.773 2.849 1.00 . A A . 4 NLE CG 1 1
2 168 1 1 2 NLE H H 4.496 -3.129 0.806 1.00 . A A . 4 NLE H 1 1
2 169 1 1 2 NLE HA H 1.641 -2.087 0.408 1.00 . A A . 4 NLE HA 1 1
2 170 1 1 2 NLE HB2 H 3.396 -1.560 2.878 1.00 . A A . 4 NLE HB2 1 1
2 171 1 1 2 NLE HB3 H 2.131 -2.781 2.800 1.00 . A A . 4 NLE HB3 1 1
2 172 1 1 2 NLE HD2 H 0.940 -1.761 4.755 1.00 . A A . 4 NLE HD2 1 1
2 173 1 1 2 NLE HD3 H 0.195 -0.185 4.582 1.00 . A A . 4 NLE HD3 1 1
2 174 1 1 2 NLE HE1 H 2.031 -0.034 6.244 1.00 . A A . 4 NLE HE1 1 1
2 175 1 1 2 NLE HE2 H 3.219 -0.632 5.067 1.00 . A A . 4 NLE HE2 1 1
2 176 1 1 2 NLE HE3 H 2.451 0.959 4.830 1.00 . A A . 4 NLE HE3 1 1
2 177 1 1 2 NLE HG2 H 0.405 -1.020 2.352 1.00 . A A . 4 NLE HG2 1 1
2 178 1 1 2 NLE HG3 H 1.619 0.244 2.490 1.00 . A A . 4 NLE HG3 1 1
2 179 1 1 2 NLE N N 3.487 -3.135 0.631 1.00 . A A . 4 NLE N 1 1
2 180 1 1 2 NLE O O 4.482 -0.379 0.446 1.00 . A A . 4 NLE O 1 1
2 181 1 1 3 ASP C C 2.119 2.632 -0.204 1.00 . A A . 5 ASP C 1 1
2 182 1 1 3 ASP CA C 2.856 1.466 -0.962 1.00 . A A . 5 ASP CA 1 1
2 183 1 1 3 ASP CB C 2.486 1.490 -2.464 1.00 . A A . 5 ASP CB 1 1
2 184 1 1 3 ASP CG C 3.321 0.608 -3.400 1.00 . A A . 5 ASP CG 1 1
2 185 1 1 3 ASP H H 1.492 -0.186 -0.465 1.00 . A A . 5 ASP H 1 1
2 186 1 1 3 ASP HA H 3.953 1.607 -0.913 1.00 . A A . 5 ASP HA 1 1
2 187 1 1 3 ASP HB2 H 1.407 1.292 -2.586 1.00 . A A . 5 ASP HB2 1 1
2 188 1 1 3 ASP HB3 H 2.618 2.525 -2.817 1.00 . A A . 5 ASP HB3 1 1
2 189 1 1 3 ASP N N 2.457 0.161 -0.384 1.00 . A A . 5 ASP N 1 1
2 190 1 1 3 ASP O O 0.887 2.712 -0.304 1.00 . A A . 5 ASP O 1 1
2 191 1 1 3 ASP OD1 O 4.391 1.025 -3.843 1.00 . A A . 5 ASP OD1 1 1
2 192 1 1 4 PRO C C 1.472 5.770 0.054 1.00 . A A . 6 PRO C 1 1
2 193 1 1 4 PRO CA C 2.157 4.793 1.085 1.00 . A A . 6 PRO CA 1 1
2 194 1 1 4 PRO CB C 3.334 5.471 1.819 1.00 . A A . 6 PRO CB 1 1
2 195 1 1 4 PRO CD C 4.224 3.446 0.872 1.00 . A A . 6 PRO CD 1 1
2 196 1 1 4 PRO CG C 4.344 4.355 2.093 1.00 . A A . 6 PRO CG 1 1
2 197 1 1 4 PRO HA H 1.421 4.446 1.834 1.00 . A A . 6 PRO HA 1 1
2 198 1 1 4 PRO HB2 H 3.813 6.242 1.182 1.00 . A A . 6 PRO HB2 1 1
2 199 1 1 4 PRO HB3 H 3.013 5.985 2.744 1.00 . A A . 6 PRO HB3 1 1
2 200 1 1 4 PRO HD2 H 4.852 3.793 0.025 1.00 . A A . 6 PRO HD2 1 1
2 201 1 1 4 PRO HD3 H 4.518 2.405 1.112 1.00 . A A . 6 PRO HD3 1 1
2 202 1 1 4 PRO HG2 H 5.373 4.734 2.240 1.00 . A A . 6 PRO HG2 1 1
2 203 1 1 4 PRO HG3 H 4.067 3.801 3.011 1.00 . A A . 6 PRO HG3 1 1
2 204 1 1 4 PRO N N 2.801 3.572 0.514 1.00 . A A . 6 PRO N 1 1
2 205 1 1 4 PRO O O 2.017 5.927 -1.046 1.00 . A A . 6 PRO O 1 1
2 206 1 1 5 PRO C C -1.269 5.204 2.055 1.00 . A A . 7 PRO C 1 1
2 207 1 1 5 PRO CA C -0.387 6.437 1.651 1.00 . A A . 7 PRO CA 1 1
2 208 1 1 5 PRO CB C -1.214 7.737 1.546 1.00 . A A . 7 PRO CB 1 1
2 209 1 1 5 PRO CD C -0.278 7.392 -0.640 1.00 . A A . 7 PRO CD 1 1
2 210 1 1 5 PRO CG C -1.543 7.887 0.060 1.00 . A A . 7 PRO CG 1 1
2 211 1 1 5 PRO HA H 0.348 6.572 2.469 1.00 . A A . 7 PRO HA 1 1
2 212 1 1 5 PRO HB2 H -2.121 7.740 2.183 1.00 . A A . 7 PRO HB2 1 1
2 213 1 1 5 PRO HB3 H -0.606 8.599 1.884 1.00 . A A . 7 PRO HB3 1 1
2 214 1 1 5 PRO HD2 H -0.503 6.913 -1.613 1.00 . A A . 7 PRO HD2 1 1
2 215 1 1 5 PRO HD3 H 0.423 8.229 -0.838 1.00 . A A . 7 PRO HD3 1 1
2 216 1 1 5 PRO HG2 H -2.405 7.247 -0.210 1.00 . A A . 7 PRO HG2 1 1
2 217 1 1 5 PRO HG3 H -1.807 8.924 -0.220 1.00 . A A . 7 PRO HG3 1 1
2 218 1 1 5 PRO N N 0.312 6.443 0.328 1.00 . A A . 7 PRO N 1 1
2 219 1 1 5 PRO O O -1.732 5.156 3.198 1.00 . A A . 7 PRO O 1 1
2 220 1 1 6 . C C -2.770 2.236 0.240 1.00 . A A . 8 DPN C 1 1
2 221 1 1 6 . CA C -2.209 2.953 1.509 1.00 . A A . 8 DPN CA 1 1
2 222 1 1 6 . CB C -1.303 2.005 2.359 1.00 . A A . 8 DPN CB 1 1
2 223 1 1 6 . CD1 C -2.474 1.226 4.475 1.00 . A A . 8 DPN CD1 1 1
2 224 1 1 6 . CD2 C -2.316 -0.324 2.629 1.00 . A A . 8 DPN CD2 1 1
2 225 1 1 6 . CE1 C -3.123 0.254 5.234 1.00 . A A . 8 DPN CE1 1 1
2 226 1 1 6 . CE2 C -2.962 -1.295 3.390 1.00 . A A . 8 DPN CE2 1 1
2 227 1 1 6 . CG C -2.062 0.942 3.168 1.00 . A A . 8 DPN CG 1 1
2 228 1 1 6 . CZ C -3.364 -1.006 4.692 1.00 . A A . 8 DPN CZ 1 1
2 229 1 1 6 . H H -0.965 4.344 0.293 1.00 . A A . 8 DPN H 1 1
2 230 1 1 6 . HA H -3.094 3.230 2.119 1.00 . A A . 8 DPN HA 1 1
2 231 1 1 6 . HB2 H -0.683 2.604 3.048 1.00 . A A . 8 DPN HB2 1 1
2 232 1 1 6 . HB3 H -0.539 1.524 1.719 1.00 . A A . 8 DPN HB3 1 1
2 233 1 1 6 . HD1 H -2.287 2.200 4.907 1.00 . A A . 8 DPN HD1 1 1
2 234 1 1 6 . HD2 H -2.004 -0.560 1.621 1.00 . A A . 8 DPN HD2 1 1
2 235 1 1 6 . HE1 H -3.436 0.477 6.244 1.00 . A A . 8 DPN HE1 1 1
2 236 1 1 6 . HE2 H -3.151 -2.275 2.977 1.00 . A A . 8 DPN HE2 1 1
2 237 1 1 6 . HZ H -3.864 -1.760 5.282 1.00 . A A . 8 DPN HZ 1 1
2 238 1 1 6 . N N -1.475 4.209 1.174 1.00 . A A . 8 DPN N 1 1
2 239 1 1 6 . O O -3.973 1.986 0.147 1.00 . A A . 8 DPN O 1 1
2 240 1 1 7 ARG C C -1.390 -0.485 -1.382 1.00 . A A . 9 ARG C 1 1
2 241 1 1 7 ARG CA C -2.190 0.805 -1.718 1.00 . A A . 9 ARG CA 1 1
2 242 1 1 7 ARG CB C -1.861 1.383 -3.112 1.00 . A A . 9 ARG CB 1 1
2 243 1 1 7 ARG CD C -3.465 -0.008 -4.670 1.00 . A A . 9 ARG CD 1 1
2 244 1 1 7 ARG CG C -2.032 0.488 -4.369 1.00 . A A . 9 ARG CG 1 1
2 245 1 1 7 ARG CZ C -4.793 -2.096 -4.240 1.00 . A A . 9 ARG CZ 1 1
2 246 1 1 7 ARG H H -0.912 2.087 -0.439 1.00 . A A . 9 ARG H 1 1
2 247 1 1 7 ARG HA H -3.278 0.585 -1.723 1.00 . A A . 9 ARG HA 1 1
2 248 1 1 7 ARG HB2 H -2.480 2.287 -3.245 1.00 . A A . 9 ARG HB2 1 1
2 249 1 1 7 ARG HB3 H -0.816 1.734 -3.093 1.00 . A A . 9 ARG HB3 1 1
2 250 1 1 7 ARG HD2 H -4.211 0.673 -4.209 1.00 . A A . 9 ARG HD2 1 1
2 251 1 1 7 ARG HD3 H -3.644 0.054 -5.764 1.00 . A A . 9 ARG HD3 1 1
2 252 1 1 7 ARG HE H -2.842 -2.011 -3.971 1.00 . A A . 9 ARG HE 1 1
2 253 1 1 7 ARG HG2 H -1.697 1.095 -5.232 1.00 . A A . 9 ARG HG2 1 1
2 254 1 1 7 ARG HG3 H -1.299 -0.345 -4.351 1.00 . A A . 9 ARG HG3 1 1
2 255 1 1 7 ARG HH11 H -5.902 -0.586 -4.834 1.00 . A A . 9 ARG HH11 1 1
2 256 1 1 7 ARG HH12 H -6.775 -2.169 -4.555 1.00 . A A . 9 ARG HH12 1 1
2 257 1 1 7 ARG HH21 H -3.818 -3.715 -3.672 1.00 . A A . 9 ARG HH21 1 1
2 258 1 1 7 ARG HH22 H -5.629 -3.881 -3.924 1.00 . A A . 9 ARG HH22 1 1
2 259 1 1 7 ARG N N -1.883 1.831 -0.689 1.00 . A A . 9 ARG N 1 1
2 260 1 1 7 ARG NE N -3.647 -1.419 -4.226 1.00 . A A . 9 ARG NE 1 1
2 261 1 1 7 ARG NH1 N -5.947 -1.572 -4.573 1.00 . A A . 9 ARG NH1 1 1
2 262 1 1 7 ARG NH2 N -4.756 -3.350 -3.901 1.00 . A A . 9 ARG NH2 1 1
2 263 1 1 7 ARG O O -0.160 -0.499 -1.276 1.00 . A A . 9 ARG O 1 1
2 264 1 1 8 TRP C C -1.218 -3.657 -2.321 1.00 . A A . 10 TRP C 1 1
2 265 1 1 8 TRP CA C -1.544 -2.921 -0.982 1.00 . A A . 10 TRP CA 1 1
2 266 1 1 8 TRP CB C -2.536 -3.687 -0.074 1.00 . A A . 10 TRP CB 1 1
2 267 1 1 8 TRP CD1 C -2.241 -6.256 -0.211 1.00 . A A . 10 TRP CD1 1 1
2 268 1 1 8 TRP CD2 C -1.131 -5.299 1.458 1.00 . A A . 10 TRP CD2 1 1
2 269 1 1 8 TRP CE2 C -0.836 -6.686 1.426 1.00 . A A . 10 TRP CE2 1 1
2 270 1 1 8 TRP CE3 C -0.513 -4.452 2.411 1.00 . A A . 10 TRP CE3 1 1
2 271 1 1 8 TRP CG C -2.008 -5.029 0.427 1.00 . A A . 10 TRP CG 1 1
2 272 1 1 8 TRP CH2 C 0.675 -6.390 3.291 1.00 . A A . 10 TRP CH2 1 1
2 273 1 1 8 TRP CZ2 C 0.082 -7.235 2.350 1.00 . A A . 10 TRP CZ2 1 1
2 274 1 1 8 TRP CZ3 C 0.378 -5.021 3.323 1.00 . A A . 10 TRP CZ3 1 1
2 275 1 1 8 TRP H H -3.090 -1.446 -1.557 1.00 . A A . 10 TRP H 1 1
2 276 1 1 8 TRP HA H -0.612 -2.793 -0.388 1.00 . A A . 10 TRP HA 1 1
2 277 1 1 8 TRP HB2 H -2.781 -3.077 0.809 1.00 . A A . 10 TRP HB2 1 1
2 278 1 1 8 TRP HB3 H -3.495 -3.839 -0.599 1.00 . A A . 10 TRP HB3 1 1
2 279 1 1 8 TRP HD1 H -2.845 -6.327 -1.105 1.00 . A A . 10 TRP HD1 1 1
2 280 1 1 8 TRP HE1 H -1.480 -8.294 0.116 1.00 . A A . 10 TRP HE1 1 1
2 281 1 1 8 TRP HE3 H -0.722 -3.392 2.425 1.00 . A A . 10 TRP HE3 1 1
2 282 1 1 8 TRP HH2 H 1.376 -6.797 4.005 1.00 . A A . 10 TRP HH2 1 1
2 283 1 1 8 TRP HZ2 H 0.321 -8.288 2.327 1.00 . A A . 10 TRP HZ2 1 1
2 284 1 1 8 TRP HZ3 H 0.852 -4.393 4.065 1.00 . A A . 10 TRP HZ3 1 1
2 285 1 1 8 TRP N N -2.129 -1.585 -1.240 1.00 . A A . 10 TRP N 1 1
2 286 1 1 8 TRP NE1 N -1.523 -7.307 0.393 1.00 . A A . 10 TRP NE1 1 1
2 287 1 1 8 TRP O O -2.004 -3.666 -3.276 1.00 . A A . 10 TRP O 1 1
2 288 1 1 9 LYS C C 0.944 -6.483 -3.224 1.00 . A A . 11 LYS C 1 1
2 289 1 1 9 LYS CA C 0.513 -5.008 -3.512 1.00 . A A . 11 LYS CA 1 1
2 290 1 1 9 LYS CB C 1.615 -4.130 -4.162 1.00 . A A . 11 LYS CB 1 1
2 291 1 1 9 LYS CD C 3.884 -2.844 -4.026 1.00 . A A . 11 LYS CD 1 1
2 292 1 1 9 LYS CE C 3.431 -1.516 -4.673 1.00 . A A . 11 LYS CE 1 1
2 293 1 1 9 LYS CG C 2.824 -3.700 -3.297 1.00 . A A . 11 LYS CG 1 1
2 294 1 1 9 LYS H H 0.517 -4.154 -1.487 1.00 . A A . 11 LYS H 1 1
2 295 1 1 9 LYS HA H -0.270 -5.109 -4.286 1.00 . A A . 11 LYS HA 1 1
2 296 1 1 9 LYS HB2 H 1.991 -4.660 -5.050 1.00 . A A . 11 LYS HB2 1 1
2 297 1 1 9 LYS HB3 H 1.125 -3.216 -4.545 1.00 . A A . 11 LYS HB3 1 1
2 298 1 1 9 LYS HD2 H 4.701 -2.622 -3.313 1.00 . A A . 11 LYS HD2 1 1
2 299 1 1 9 LYS HD3 H 4.359 -3.467 -4.809 1.00 . A A . 11 LYS HD3 1 1
2 300 1 1 9 LYS HE2 H 4.299 -1.054 -5.187 1.00 . A A . 11 LYS HE2 1 1
2 301 1 1 9 LYS HE3 H 2.714 -1.724 -5.490 1.00 . A A . 11 LYS HE3 1 1
2 302 1 1 9 LYS HG2 H 2.463 -3.138 -2.415 1.00 . A A . 11 LYS HG2 1 1
2 303 1 1 9 LYS HG3 H 3.315 -4.604 -2.889 1.00 . A A . 11 LYS HG3 1 1
2 304 1 1 9 LYS HZ1 H 1.962 -0.821 -3.170 1.00 . A A . 11 LYS HZ1 1 1
2 305 1 1 9 LYS N N -0.042 -4.282 -2.339 1.00 . A A . 11 LYS N 1 1
2 306 1 1 9 LYS NZ N 2.799 -0.583 -3.710 1.00 . A A . 11 LYS NZ 1 1
2 307 1 1 9 LYS O O 0.729 -7.369 -4.047 1.00 . A A . 11 LYS O 1 1
2 308 1 1 10 NH2 HN1 H 1.615 -6.133 -1.365 1.00 . A A . 12 NH2 HN1 1 1
2 309 1 1 10 NH2 HN2 H 1.709 -7.852 -2.032 1.00 . A A . 12 NH2 HN2 1 1
2 310 1 1 10 NH2 N N 1.552 -6.844 -2.106 1.00 . A A . 12 NH2 N 1 1
3 311 1 1 1 ACE C C 2.989 -3.821 0.394 1.00 . A A . 3 ACE C 1 1
3 312 1 1 1 ACE CH3 C 4.463 -3.439 0.455 1.00 . A A . 3 ACE CH3 1 1
3 313 1 1 1 ACE H1 H 4.713 -2.700 -0.327 1.00 . A A . 3 ACE H1 1 1
3 314 1 1 1 ACE H2 H 4.733 -3.010 1.435 1.00 . A A . 3 ACE H2 1 1
3 315 1 1 1 ACE H3 H 5.104 -4.324 0.293 1.00 . A A . 3 ACE H3 1 1
3 316 1 1 1 ACE O O 2.672 -4.954 0.048 1.00 . A A . 3 ACE O 1 1
3 317 1 1 2 NLE C C 2.915 -0.555 0.479 1.00 . A A . 4 NLE C 1 1
3 318 1 1 2 NLE CA C 2.050 -1.627 1.232 1.00 . A A . 4 NLE CA 1 1
3 319 1 1 2 NLE CB C 2.327 -1.607 2.757 1.00 . A A . 4 NLE CB 1 1
3 320 1 1 2 NLE CD C 1.819 -2.321 5.168 1.00 . A A . 4 NLE CD 1 1
3 321 1 1 2 NLE CE C 1.088 -3.329 6.065 1.00 . A A . 4 NLE CE 1 1
3 322 1 1 2 NLE CG C 1.554 -2.579 3.676 1.00 . A A . 4 NLE CG 1 1
3 323 1 1 2 NLE H H 1.172 -3.583 0.938 1.00 . A A . 4 NLE H 1 1
3 324 1 1 2 NLE HA H 1.003 -1.276 1.150 1.00 . A A . 4 NLE HA 1 1
3 325 1 1 2 NLE HB2 H 2.124 -0.579 3.098 1.00 . A A . 4 NLE HB2 1 1
3 326 1 1 2 NLE HB3 H 3.408 -1.761 2.895 1.00 . A A . 4 NLE HB3 1 1
3 327 1 1 2 NLE HD2 H 1.504 -1.294 5.436 1.00 . A A . 4 NLE HD2 1 1
3 328 1 1 2 NLE HD3 H 2.907 -2.364 5.376 1.00 . A A . 4 NLE HD3 1 1
3 329 1 1 2 NLE HE1 H 1.426 -4.366 5.880 1.00 . A A . 4 NLE HE1 1 1
3 330 1 1 2 NLE HE2 H 1.269 -3.116 7.135 1.00 . A A . 4 NLE HE2 1 1
3 331 1 1 2 NLE HE3 H -0.006 -3.301 5.909 1.00 . A A . 4 NLE HE3 1 1
3 332 1 1 2 NLE HG2 H 1.842 -3.617 3.425 1.00 . A A . 4 NLE HG2 1 1
3 333 1 1 2 NLE HG3 H 0.469 -2.506 3.475 1.00 . A A . 4 NLE HG3 1 1
3 334 1 1 2 NLE N N 1.972 -3.008 0.677 1.00 . A A . 4 NLE N 1 1
3 335 1 1 2 NLE O O 4.075 -0.299 0.819 1.00 . A A . 4 NLE O 1 1
3 336 1 1 3 ASP C C 2.191 2.619 -0.394 1.00 . A A . 5 ASP C 1 1
3 337 1 1 3 ASP CA C 2.853 1.373 -1.093 1.00 . A A . 5 ASP CA 1 1
3 338 1 1 3 ASP CB C 2.552 1.395 -2.612 1.00 . A A . 5 ASP CB 1 1
3 339 1 1 3 ASP CG C 3.495 0.607 -3.532 1.00 . A A . 5 ASP CG 1 1
3 340 1 1 3 ASP H H 1.334 -0.164 -0.661 1.00 . A A . 5 ASP H 1 1
3 341 1 1 3 ASP HA H 3.954 1.404 -0.986 1.00 . A A . 5 ASP HA 1 1
3 342 1 1 3 ASP HB2 H 1.503 1.106 -2.808 1.00 . A A . 5 ASP HB2 1 1
3 343 1 1 3 ASP HB3 H 2.608 2.443 -2.956 1.00 . A A . 5 ASP HB3 1 1
3 344 1 1 3 ASP N N 2.312 0.121 -0.502 1.00 . A A . 5 ASP N 1 1
3 345 1 1 3 ASP O O 0.956 2.710 -0.421 1.00 . A A . 5 ASP O 1 1
3 346 1 1 3 ASP OD1 O 4.258 1.206 -4.288 1.00 . A A . 5 ASP OD1 1 1
3 347 1 1 4 PRO C C 1.446 5.732 -0.215 1.00 . A A . 6 PRO C 1 1
3 348 1 1 4 PRO CA C 2.320 4.853 0.763 1.00 . A A . 6 PRO CA 1 1
3 349 1 1 4 PRO CB C 3.563 5.625 1.253 1.00 . A A . 6 PRO CB 1 1
3 350 1 1 4 PRO CD C 4.380 3.523 0.416 1.00 . A A . 6 PRO CD 1 1
3 351 1 1 4 PRO CG C 4.626 4.559 1.512 1.00 . A A . 6 PRO CG 1 1
3 352 1 1 4 PRO HA H 1.738 4.544 1.650 1.00 . A A . 6 PRO HA 1 1
3 353 1 1 4 PRO HB2 H 3.935 6.324 0.475 1.00 . A A . 6 PRO HB2 1 1
3 354 1 1 4 PRO HB3 H 3.353 6.239 2.150 1.00 . A A . 6 PRO HB3 1 1
3 355 1 1 4 PRO HD2 H 4.915 3.774 -0.523 1.00 . A A . 6 PRO HD2 1 1
3 356 1 1 4 PRO HD3 H 4.711 2.517 0.743 1.00 . A A . 6 PRO HD3 1 1
3 357 1 1 4 PRO HG2 H 5.655 4.963 1.488 1.00 . A A . 6 PRO HG2 1 1
3 358 1 1 4 PRO HG3 H 4.480 4.102 2.510 1.00 . A A . 6 PRO HG3 1 1
3 359 1 1 4 PRO N N 2.924 3.609 0.198 1.00 . A A . 6 PRO N 1 1
3 360 1 1 4 PRO O O 1.878 5.910 -1.361 1.00 . A A . 6 PRO O 1 1
3 361 1 1 5 PRO C C -1.319 5.062 1.804 1.00 . A A . 7 PRO C 1 1
3 362 1 1 5 PRO CA C -0.339 6.259 1.517 1.00 . A A . 7 PRO CA 1 1
3 363 1 1 5 PRO CB C -1.005 7.653 1.557 1.00 . A A . 7 PRO CB 1 1
3 364 1 1 5 PRO CD C -0.432 7.267 -0.747 1.00 . A A . 7 PRO CD 1 1
3 365 1 1 5 PRO CG C -1.514 7.891 0.133 1.00 . A A . 7 PRO CG 1 1
3 366 1 1 5 PRO HA H 0.439 6.246 2.303 1.00 . A A . 7 PRO HA 1 1
3 367 1 1 5 PRO HB2 H -1.807 7.735 2.315 1.00 . A A . 7 PRO HB2 1 1
3 368 1 1 5 PRO HB3 H -0.256 8.424 1.822 1.00 . A A . 7 PRO HB3 1 1
3 369 1 1 5 PRO HD2 H -0.853 6.769 -1.641 1.00 . A A . 7 PRO HD2 1 1
3 370 1 1 5 PRO HD3 H 0.277 8.041 -1.105 1.00 . A A . 7 PRO HD3 1 1
3 371 1 1 5 PRO HG2 H -2.478 7.370 -0.018 1.00 . A A . 7 PRO HG2 1 1
3 372 1 1 5 PRO HG3 H -1.681 8.961 -0.089 1.00 . A A . 7 PRO HG3 1 1
3 373 1 1 5 PRO N N 0.255 6.307 0.145 1.00 . A A . 7 PRO N 1 1
3 374 1 1 5 PRO O O -2.462 5.246 2.235 1.00 . A A . 7 PRO O 1 1
3 375 1 1 6 . C C -2.464 2.081 0.707 1.00 . A A . 8 DPN C 1 1
3 376 1 1 6 . CA C -1.604 2.582 1.912 1.00 . A A . 8 DPN CA 1 1
3 377 1 1 6 . CB C -0.568 1.524 2.408 1.00 . A A . 8 DPN CB 1 1
3 378 1 1 6 . CD1 C -1.164 0.418 4.616 1.00 . A A . 8 DPN CD1 1 1
3 379 1 1 6 . CD2 C -1.747 -0.734 2.574 1.00 . A A . 8 DPN CD2 1 1
3 380 1 1 6 . CE1 C -1.734 -0.614 5.358 1.00 . A A . 8 DPN CE1 1 1
3 381 1 1 6 . CE2 C -2.327 -1.757 3.318 1.00 . A A . 8 DPN CE2 1 1
3 382 1 1 6 . CG C -1.170 0.367 3.219 1.00 . A A . 8 DPN CG 1 1
3 383 1 1 6 . CZ C -2.318 -1.699 4.709 1.00 . A A . 8 DPN CZ 1 1
3 384 1 1 6 . H H 0.001 3.794 1.018 1.00 . A A . 8 DPN H 1 1
3 385 1 1 6 . HA H -2.303 2.783 2.750 1.00 . A A . 8 DPN HA 1 1
3 386 1 1 6 . HB2 H 0.217 2.016 3.009 1.00 . A A . 8 DPN HB2 1 1
3 387 1 1 6 . HB3 H 0.010 1.117 1.555 1.00 . A A . 8 DPN HB3 1 1
3 388 1 1 6 . HD1 H -0.725 1.258 5.133 1.00 . A A . 8 DPN HD1 1 1
3 389 1 1 6 . HD2 H -1.763 -0.792 1.498 1.00 . A A . 8 DPN HD2 1 1
3 390 1 1 6 . HE1 H -1.722 -0.564 6.438 1.00 . A A . 8 DPN HE1 1 1
3 391 1 1 6 . HE2 H -2.786 -2.594 2.813 1.00 . A A . 8 DPN HE2 1 1
3 392 1 1 6 . HZ H -2.765 -2.496 5.286 1.00 . A A . 8 DPN HZ 1 1
3 393 1 1 6 . N N -0.846 3.825 1.603 1.00 . A A . 8 DPN N 1 1
3 394 1 1 6 . O O -3.692 1.997 0.802 1.00 . A A . 8 DPN O 1 1
3 395 1 1 7 ARG C C -1.536 -0.527 -1.309 1.00 . A A . 9 ARG C 1 1
3 396 1 1 7 ARG CA C -2.363 0.795 -1.430 1.00 . A A . 9 ARG CA 1 1
3 397 1 1 7 ARG CB C -2.259 1.392 -2.862 1.00 . A A . 9 ARG CB 1 1
3 398 1 1 7 ARG CD C -3.557 3.718 -2.895 1.00 . A A . 9 ARG CD 1 1
3 399 1 1 7 ARG CG C -3.440 2.258 -3.385 1.00 . A A . 9 ARG CG 1 1
3 400 1 1 7 ARG CZ C -4.584 4.847 -0.899 1.00 . A A . 9 ARG CZ 1 1
3 401 1 1 7 ARG H H -0.810 1.936 -0.373 1.00 . A A . 9 ARG H 1 1
3 402 1 1 7 ARG HA H -3.428 0.564 -1.223 1.00 . A A . 9 ARG HA 1 1
3 403 1 1 7 ARG HB2 H -1.295 1.919 -2.986 1.00 . A A . 9 ARG HB2 1 1
3 404 1 1 7 ARG HB3 H -2.176 0.545 -3.570 1.00 . A A . 9 ARG HB3 1 1
3 405 1 1 7 ARG HD2 H -2.565 4.214 -2.927 1.00 . A A . 9 ARG HD2 1 1
3 406 1 1 7 ARG HD3 H -4.201 4.271 -3.609 1.00 . A A . 9 ARG HD3 1 1
3 407 1 1 7 ARG HE H -4.026 2.956 -0.897 1.00 . A A . 9 ARG HE 1 1
3 408 1 1 7 ARG HG2 H -3.334 2.304 -4.487 1.00 . A A . 9 ARG HG2 1 1
3 409 1 1 7 ARG HG3 H -4.402 1.724 -3.245 1.00 . A A . 9 ARG HG3 1 1
3 410 1 1 7 ARG HH11 H -4.477 6.030 -2.461 1.00 . A A . 9 ARG HH11 1 1
3 411 1 1 7 ARG HH12 H -5.119 6.779 -0.917 1.00 . A A . 9 ARG HH12 1 1
3 412 1 1 7 ARG HH21 H -4.697 3.810 0.777 1.00 . A A . 9 ARG HH21 1 1
3 413 1 1 7 ARG HH22 H -5.184 5.566 0.863 1.00 . A A . 9 ARG HH22 1 1
3 414 1 1 7 ARG N N -1.825 1.753 -0.427 1.00 . A A . 9 ARG N 1 1
3 415 1 1 7 ARG NE N -4.130 3.768 -1.525 1.00 . A A . 9 ARG NE 1 1
3 416 1 1 7 ARG NH1 N -4.733 6.014 -1.472 1.00 . A A . 9 ARG NH1 1 1
3 417 1 1 7 ARG NH2 N -4.900 4.726 0.356 1.00 . A A . 9 ARG NH2 1 1
3 418 1 1 7 ARG O O -0.311 -0.513 -1.147 1.00 . A A . 9 ARG O 1 1
3 419 1 1 8 TRP C C -1.012 -3.574 -2.543 1.00 . A A . 10 TRP C 1 1
3 420 1 1 8 TRP CA C -1.549 -3.001 -1.193 1.00 . A A . 10 TRP CA 1 1
3 421 1 1 8 TRP CB C -2.559 -3.940 -0.490 1.00 . A A . 10 TRP CB 1 1
3 422 1 1 8 TRP CD1 C -2.207 -6.444 -1.057 1.00 . A A . 10 TRP CD1 1 1
3 423 1 1 8 TRP CD2 C -1.266 -5.810 0.852 1.00 . A A . 10 TRP CD2 1 1
3 424 1 1 8 TRP CE2 C -0.968 -7.175 0.605 1.00 . A A . 10 TRP CE2 1 1
3 425 1 1 8 TRP CE3 C -0.754 -5.158 1.999 1.00 . A A . 10 TRP CE3 1 1
3 426 1 1 8 TRP CG C -2.043 -5.351 -0.191 1.00 . A A . 10 TRP CG 1 1
3 427 1 1 8 TRP CH2 C 0.334 -7.241 2.641 1.00 . A A . 10 TRP CH2 1 1
3 428 1 1 8 TRP CZ2 C -0.153 -7.896 1.508 1.00 . A A . 10 TRP CZ2 1 1
3 429 1 1 8 TRP CZ3 C 0.033 -5.895 2.885 1.00 . A A . 10 TRP CZ3 1 1
3 430 1 1 8 TRP H H -3.145 -1.609 -1.777 1.00 . A A . 10 TRP H 1 1
3 431 1 1 8 TRP HA H -0.707 -2.882 -0.479 1.00 . A A . 10 TRP HA 1 1
3 432 1 1 8 TRP HB2 H -2.885 -3.488 0.461 1.00 . A A . 10 TRP HB2 1 1
3 433 1 1 8 TRP HB3 H -3.471 -4.020 -1.107 1.00 . A A . 10 TRP HB3 1 1
3 434 1 1 8 TRP HD1 H -2.711 -6.353 -2.008 1.00 . A A . 10 TRP HD1 1 1
3 435 1 1 8 TRP HE1 H -1.463 -8.512 -1.035 1.00 . A A . 10 TRP HE1 1 1
3 436 1 1 8 TRP HE3 H -0.972 -4.117 2.182 1.00 . A A . 10 TRP HE3 1 1
3 437 1 1 8 TRP HH2 H 0.952 -7.784 3.343 1.00 . A A . 10 TRP HH2 1 1
3 438 1 1 8 TRP HZ2 H 0.085 -8.933 1.324 1.00 . A A . 10 TRP HZ2 1 1
3 439 1 1 8 TRP HZ3 H 0.415 -5.425 3.779 1.00 . A A . 10 TRP HZ3 1 1
3 440 1 1 8 TRP N N -2.209 -1.683 -1.372 1.00 . A A . 10 TRP N 1 1
3 441 1 1 8 TRP NE1 N -1.550 -7.595 -0.581 1.00 . A A . 10 TRP NE1 1 1
3 442 1 1 8 TRP O O -1.728 -3.659 -3.546 1.00 . A A . 10 TRP O 1 1
3 443 1 1 9 LYS C C 1.104 -6.348 -3.211 1.00 . A A . 11 LYS C 1 1
3 444 1 1 9 LYS CA C 0.867 -4.846 -3.580 1.00 . A A . 11 LYS CA 1 1
3 445 1 1 9 LYS CB C 2.104 -4.092 -4.131 1.00 . A A . 11 LYS CB 1 1
3 446 1 1 9 LYS CD C 4.447 -2.997 -3.780 1.00 . A A . 11 LYS CD 1 1
3 447 1 1 9 LYS CE C 4.147 -1.614 -4.401 1.00 . A A . 11 LYS CE 1 1
3 448 1 1 9 LYS CG C 3.274 -3.797 -3.168 1.00 . A A . 11 LYS CG 1 1
3 449 1 1 9 LYS H H 0.722 -3.832 -1.620 1.00 . A A . 11 LYS H 1 1
3 450 1 1 9 LYS HA H 0.176 -4.896 -4.444 1.00 . A A . 11 LYS HA 1 1
3 451 1 1 9 LYS HB2 H 2.493 -4.658 -4.990 1.00 . A A . 11 LYS HB2 1 1
3 452 1 1 9 LYS HB3 H 1.744 -3.133 -4.548 1.00 . A A . 11 LYS HB3 1 1
3 453 1 1 9 LYS HD2 H 5.216 -2.864 -2.994 1.00 . A A . 11 LYS HD2 1 1
3 454 1 1 9 LYS HD3 H 4.939 -3.624 -4.547 1.00 . A A . 11 LYS HD3 1 1
3 455 1 1 9 LYS HE2 H 5.103 -1.154 -4.723 1.00 . A A . 11 LYS HE2 1 1
3 456 1 1 9 LYS HE3 H 3.562 -1.738 -5.333 1.00 . A A . 11 LYS HE3 1 1
3 457 1 1 9 LYS HG2 H 2.886 -3.240 -2.299 1.00 . A A . 11 LYS HG2 1 1
3 458 1 1 9 LYS HG3 H 3.664 -4.748 -2.760 1.00 . A A . 11 LYS HG3 1 1
3 459 1 1 9 LYS HZ1 H 2.772 -1.070 -2.754 1.00 . A A . 11 LYS HZ1 1 1
3 460 1 1 9 LYS N N 0.239 -4.040 -2.497 1.00 . A A . 11 LYS N 1 1
3 461 1 1 9 LYS NZ N 3.407 -0.722 -3.480 1.00 . A A . 11 LYS NZ 1 1
3 462 1 1 9 LYS O O 0.720 -7.245 -3.957 1.00 . A A . 11 LYS O 1 1
3 463 1 1 10 NH2 HN1 H 1.966 -6.001 -1.413 1.00 . A A . 12 NH2 HN1 1 1
3 464 1 1 10 NH2 HN2 H 1.746 -7.740 -1.978 1.00 . A A . 12 NH2 HN2 1 1
3 465 1 1 10 NH2 N N 1.719 -6.725 -2.104 1.00 . A A . 12 NH2 N 1 1
4 466 1 1 1 ACE C C 2.912 -3.671 0.125 1.00 . A A . 3 ACE C 1 1
4 467 1 1 1 ACE CH3 C 3.728 -4.945 0.033 1.00 . A A . 3 ACE CH3 1 1
4 468 1 1 1 ACE H1 H 3.425 -5.535 -0.852 1.00 . A A . 3 ACE H1 1 1
4 469 1 1 1 ACE H2 H 4.807 -4.727 -0.067 1.00 . A A . 3 ACE H2 1 1
4 470 1 1 1 ACE H3 H 3.578 -5.587 0.919 1.00 . A A . 3 ACE H3 1 1
4 471 1 1 1 ACE O O 2.071 -3.401 -0.728 1.00 . A A . 3 ACE O 1 1
4 472 1 1 2 NLE C C 3.183 -0.373 0.975 1.00 . A A . 4 NLE C 1 1
4 473 1 1 2 NLE CA C 2.416 -1.644 1.458 1.00 . A A . 4 NLE CA 1 1
4 474 1 1 2 NLE CB C 2.014 -1.588 2.957 1.00 . A A . 4 NLE CB 1 1
4 475 1 1 2 NLE CD C 3.199 -3.241 4.558 1.00 . A A . 4 NLE CD 1 1
4 476 1 1 2 NLE CE C 4.218 -3.388 5.692 1.00 . A A . 4 NLE CE 1 1
4 477 1 1 2 NLE CG C 3.071 -1.782 4.075 1.00 . A A . 4 NLE CG 1 1
4 478 1 1 2 NLE H H 3.829 -3.262 1.855 1.00 . A A . 4 NLE H 1 1
4 479 1 1 2 NLE HA H 1.443 -1.678 0.921 1.00 . A A . 4 NLE HA 1 1
4 480 1 1 2 NLE HB2 H 1.180 -2.294 3.104 1.00 . A A . 4 NLE HB2 1 1
4 481 1 1 2 NLE HB3 H 1.548 -0.603 3.124 1.00 . A A . 4 NLE HB3 1 1
4 482 1 1 2 NLE HD2 H 3.490 -3.907 3.726 1.00 . A A . 4 NLE HD2 1 1
4 483 1 1 2 NLE HD3 H 2.215 -3.609 4.906 1.00 . A A . 4 NLE HD3 1 1
4 484 1 1 2 NLE HE1 H 3.938 -2.782 6.574 1.00 . A A . 4 NLE HE1 1 1
4 485 1 1 2 NLE HE2 H 4.292 -4.439 6.026 1.00 . A A . 4 NLE HE2 1 1
4 486 1 1 2 NLE HE3 H 5.230 -3.072 5.376 1.00 . A A . 4 NLE HE3 1 1
4 487 1 1 2 NLE HG2 H 2.786 -1.154 4.941 1.00 . A A . 4 NLE HG2 1 1
4 488 1 1 2 NLE HG3 H 4.054 -1.388 3.752 1.00 . A A . 4 NLE HG3 1 1
4 489 1 1 2 NLE N N 3.158 -2.897 1.178 1.00 . A A . 4 NLE N 1 1
4 490 1 1 2 NLE O O 4.180 0.050 1.567 1.00 . A A . 4 NLE O 1 1
4 491 1 1 3 ASP C C 2.340 2.766 -0.072 1.00 . A A . 5 ASP C 1 1
4 492 1 1 3 ASP CA C 3.180 1.550 -0.610 1.00 . A A . 5 ASP CA 1 1
4 493 1 1 3 ASP CB C 3.104 1.500 -2.157 1.00 . A A . 5 ASP CB 1 1
4 494 1 1 3 ASP CG C 4.247 0.756 -2.858 1.00 . A A . 5 ASP CG 1 1
4 495 1 1 3 ASP H H 1.819 -0.186 -0.477 1.00 . A A . 5 ASP H 1 1
4 496 1 1 3 ASP HA H 4.239 1.684 -0.310 1.00 . A A . 5 ASP HA 1 1
4 497 1 1 3 ASP HB2 H 2.118 1.147 -2.498 1.00 . A A . 5 ASP HB2 1 1
4 498 1 1 3 ASP HB3 H 3.173 2.519 -2.565 1.00 . A A . 5 ASP HB3 1 1
4 499 1 1 3 ASP N N 2.671 0.250 -0.094 1.00 . A A . 5 ASP N 1 1
4 500 1 1 3 ASP O O 1.122 2.624 0.072 1.00 . A A . 5 ASP O 1 1
4 501 1 1 3 ASP OD1 O 5.359 1.270 -2.876 1.00 . A A . 5 ASP OD1 1 1
4 502 1 1 4 PRO C C 1.114 5.761 -0.464 1.00 . A A . 6 PRO C 1 1
4 503 1 1 4 PRO CA C 2.066 5.153 0.644 1.00 . A A . 6 PRO CA 1 1
4 504 1 1 4 PRO CB C 3.162 6.131 1.110 1.00 . A A . 6 PRO CB 1 1
4 505 1 1 4 PRO CD C 4.324 4.296 0.048 1.00 . A A . 6 PRO CD 1 1
4 506 1 1 4 PRO CG C 4.384 5.811 0.244 1.00 . A A . 6 PRO CG 1 1
4 507 1 1 4 PRO HA H 1.484 4.841 1.532 1.00 . A A . 6 PRO HA 1 1
4 508 1 1 4 PRO HB2 H 2.863 7.195 1.040 1.00 . A A . 6 PRO HB2 1 1
4 509 1 1 4 PRO HB3 H 3.403 5.949 2.176 1.00 . A A . 6 PRO HB3 1 1
4 510 1 1 4 PRO HD2 H 4.724 4.003 -0.943 1.00 . A A . 6 PRO HD2 1 1
4 511 1 1 4 PRO HD3 H 4.914 3.768 0.823 1.00 . A A . 6 PRO HD3 1 1
4 512 1 1 4 PRO HG2 H 4.298 6.322 -0.736 1.00 . A A . 6 PRO HG2 1 1
4 513 1 1 4 PRO HG3 H 5.336 6.145 0.700 1.00 . A A . 6 PRO HG3 1 1
4 514 1 1 4 PRO N N 2.886 3.989 0.195 1.00 . A A . 6 PRO N 1 1
4 515 1 1 4 PRO O O 1.549 5.832 -1.621 1.00 . A A . 6 PRO O 1 1
4 516 1 1 5 PRO C C -1.666 5.035 1.508 1.00 . A A . 7 PRO C 1 1
4 517 1 1 5 PRO CA C -0.791 6.287 1.143 1.00 . A A . 7 PRO CA 1 1
4 518 1 1 5 PRO CB C -1.594 7.598 0.996 1.00 . A A . 7 PRO CB 1 1
4 519 1 1 5 PRO CD C -0.909 6.984 -1.226 1.00 . A A . 7 PRO CD 1 1
4 520 1 1 5 PRO CG C -2.073 7.607 -0.458 1.00 . A A . 7 PRO CG 1 1
4 521 1 1 5 PRO HA H -0.048 6.444 1.949 1.00 . A A . 7 PRO HA 1 1
4 522 1 1 5 PRO HB2 H -2.428 7.682 1.718 1.00 . A A . 7 PRO HB2 1 1
4 523 1 1 5 PRO HB3 H -0.937 8.471 1.183 1.00 . A A . 7 PRO HB3 1 1
4 524 1 1 5 PRO HD2 H -1.253 6.335 -2.054 1.00 . A A . 7 PRO HD2 1 1
4 525 1 1 5 PRO HD3 H -0.268 7.770 -1.670 1.00 . A A . 7 PRO HD3 1 1
4 526 1 1 5 PRO HG2 H -2.981 6.981 -0.565 1.00 . A A . 7 PRO HG2 1 1
4 527 1 1 5 PRO HG3 H -2.331 8.622 -0.819 1.00 . A A . 7 PRO HG3 1 1
4 528 1 1 5 PRO N N -0.152 6.224 -0.207 1.00 . A A . 7 PRO N 1 1
4 529 1 1 5 PRO O O -2.900 5.076 1.549 1.00 . A A . 7 PRO O 1 1
4 530 1 1 6 . C C -2.281 1.953 0.783 1.00 . A A . 8 DPN C 1 1
4 531 1 1 6 . CA C -1.663 2.605 2.064 1.00 . A A . 8 DPN CA 1 1
4 532 1 1 6 . CB C -0.603 1.713 2.779 1.00 . A A . 8 DPN CB 1 1
4 533 1 1 6 . CD1 C -1.393 0.527 4.878 1.00 . A A . 8 DPN CD1 1 1
4 534 1 1 6 . CD2 C -1.394 -0.711 2.804 1.00 . A A . 8 DPN CD2 1 1
4 535 1 1 6 . CE1 C -1.847 -0.604 5.552 1.00 . A A . 8 DPN CE1 1 1
4 536 1 1 6 . CE2 C -1.849 -1.840 3.479 1.00 . A A . 8 DPN CE2 1 1
4 537 1 1 6 . CG C -1.161 0.480 3.501 1.00 . A A . 8 DPN CG 1 1
4 538 1 1 6 . CZ C -2.074 -1.787 4.853 1.00 . A A . 8 DPN CZ 1 1
4 539 1 1 6 . H H -0.036 3.925 1.416 1.00 . A A . 8 DPN H 1 1
4 540 1 1 6 . HA H -2.494 2.783 2.777 1.00 . A A . 8 DPN HA 1 1
4 541 1 1 6 . HB2 H -0.025 2.322 3.495 1.00 . A A . 8 DPN HB2 1 1
4 542 1 1 6 . HB3 H 0.176 1.387 2.064 1.00 . A A . 8 DPN HB3 1 1
4 543 1 1 6 . HD1 H -1.212 1.436 5.436 1.00 . A A . 8 DPN HD1 1 1
4 544 1 1 6 . HD2 H -1.208 -0.771 1.741 1.00 . A A . 8 DPN HD2 1 1
4 545 1 1 6 . HE1 H -2.013 -0.554 6.618 1.00 . A A . 8 DPN HE1 1 1
4 546 1 1 6 . HE2 H -2.018 -2.757 2.937 1.00 . A A . 8 DPN HE2 1 1
4 547 1 1 6 . HZ H -2.422 -2.666 5.377 1.00 . A A . 8 DPN HZ 1 1
4 548 1 1 6 . N N -0.998 3.905 1.771 1.00 . A A . 8 DPN N 1 1
4 549 1 1 6 . O O -3.503 1.825 0.671 1.00 . A A . 8 DPN O 1 1
4 550 1 1 7 ARG C C -1.109 -0.530 -1.351 1.00 . A A . 9 ARG C 1 1
4 551 1 1 7 ARG CA C -1.808 0.863 -1.422 1.00 . A A . 9 ARG CA 1 1
4 552 1 1 7 ARG CB C -1.342 1.642 -2.681 1.00 . A A . 9 ARG CB 1 1
4 553 1 1 7 ARG CD C -3.190 3.523 -3.026 1.00 . A A . 9 ARG CD 1 1
4 554 1 1 7 ARG CG C -1.701 3.147 -2.858 1.00 . A A . 9 ARG CG 1 1
4 555 1 1 7 ARG CZ C -4.992 4.127 -1.375 1.00 . A A . 9 ARG CZ 1 1
4 556 1 1 7 ARG H H -0.454 1.882 -0.016 1.00 . A A . 9 ARG H 1 1
4 557 1 1 7 ARG HA H -2.909 0.734 -1.487 1.00 . A A . 9 ARG HA 1 1
4 558 1 1 7 ARG HB2 H -0.239 1.565 -2.729 1.00 . A A . 9 ARG HB2 1 1
4 559 1 1 7 ARG HB3 H -1.691 1.082 -3.567 1.00 . A A . 9 ARG HB3 1 1
4 560 1 1 7 ARG HD2 H -3.237 4.539 -3.470 1.00 . A A . 9 ARG HD2 1 1
4 561 1 1 7 ARG HD3 H -3.683 2.846 -3.754 1.00 . A A . 9 ARG HD3 1 1
4 562 1 1 7 ARG HE H -3.495 2.920 -0.935 1.00 . A A . 9 ARG HE 1 1
4 563 1 1 7 ARG HG2 H -1.245 3.739 -2.038 1.00 . A A . 9 ARG HG2 1 1
4 564 1 1 7 ARG HG3 H -1.164 3.504 -3.759 1.00 . A A . 9 ARG HG3 1 1
4 565 1 1 7 ARG HH11 H -5.300 4.907 -3.150 1.00 . A A . 9 ARG HH11 1 1
4 566 1 1 7 ARG HH12 H -6.529 5.322 -1.856 1.00 . A A . 9 ARG HH12 1 1
4 567 1 1 7 ARG HH21 H -4.830 3.412 0.458 1.00 . A A . 9 ARG HH21 1 1
4 568 1 1 7 ARG HH22 H -6.256 4.506 0.122 1.00 . A A . 9 ARG HH22 1 1
4 569 1 1 7 ARG N N -1.433 1.597 -0.193 1.00 . A A . 9 ARG N 1 1
4 570 1 1 7 ARG NE N -3.880 3.482 -1.710 1.00 . A A . 9 ARG NE 1 1
4 571 1 1 7 ARG NH1 N -5.679 4.874 -2.202 1.00 . A A . 9 ARG NH1 1 1
4 572 1 1 7 ARG NH2 N -5.416 3.996 -0.154 1.00 . A A . 9 ARG NH2 1 1
4 573 1 1 7 ARG O O 0.122 -0.624 -1.244 1.00 . A A . 9 ARG O 1 1
4 574 1 1 8 TRP C C -1.083 -3.727 -2.489 1.00 . A A . 10 TRP C 1 1
4 575 1 1 8 TRP CA C -1.383 -2.981 -1.150 1.00 . A A . 10 TRP CA 1 1
4 576 1 1 8 TRP CB C -2.402 -3.711 -0.245 1.00 . A A . 10 TRP CB 1 1
4 577 1 1 8 TRP CD1 C -2.618 -6.280 -0.477 1.00 . A A . 10 TRP CD1 1 1
4 578 1 1 8 TRP CD2 C -1.044 -5.632 0.954 1.00 . A A . 10 TRP CD2 1 1
4 579 1 1 8 TRP CE2 C -1.035 -7.046 0.843 1.00 . A A . 10 TRP CE2 1 1
4 580 1 1 8 TRP CE3 C -0.100 -4.968 1.776 1.00 . A A . 10 TRP CE3 1 1
4 581 1 1 8 TRP CG C -2.037 -5.151 0.123 1.00 . A A . 10 TRP CG 1 1
4 582 1 1 8 TRP CH2 C 0.843 -7.137 2.365 1.00 . A A . 10 TRP CH2 1 1
4 583 1 1 8 TRP CZ2 C -0.077 -7.806 1.553 1.00 . A A . 10 TRP CZ2 1 1
4 584 1 1 8 TRP CZ3 C 0.828 -5.742 2.476 1.00 . A A . 10 TRP CZ3 1 1
4 585 1 1 8 TRP H H -2.863 -1.437 -1.664 1.00 . A A . 10 TRP H 1 1
4 586 1 1 8 TRP HA H -0.454 -2.919 -0.544 1.00 . A A . 10 TRP HA 1 1
4 587 1 1 8 TRP HB2 H -2.536 -3.144 0.690 1.00 . A A . 10 TRP HB2 1 1
4 588 1 1 8 TRP HB3 H -3.389 -3.705 -0.738 1.00 . A A . 10 TRP HB3 1 1
4 589 1 1 8 TRP HD1 H -3.391 -6.198 -1.228 1.00 . A A . 10 TRP HD1 1 1
4 590 1 1 8 TRP HE1 H -2.227 -8.440 -0.319 1.00 . A A . 10 TRP HE1 1 1
4 591 1 1 8 TRP HE3 H -0.083 -3.891 1.851 1.00 . A A . 10 TRP HE3 1 1
4 592 1 1 8 TRP HH2 H 1.580 -7.707 2.912 1.00 . A A . 10 TRP HH2 1 1
4 593 1 1 8 TRP HZ2 H -0.053 -8.881 1.461 1.00 . A A . 10 TRP HZ2 1 1
4 594 1 1 8 TRP HZ3 H 1.558 -5.253 3.105 1.00 . A A . 10 TRP HZ3 1 1
4 595 1 1 8 TRP N N -1.897 -1.609 -1.378 1.00 . A A . 10 TRP N 1 1
4 596 1 1 8 TRP NE1 N -2.015 -7.475 -0.039 1.00 . A A . 10 TRP NE1 1 1
4 597 1 1 8 TRP O O -1.924 -3.857 -3.383 1.00 . A A . 10 TRP O 1 1
4 598 1 1 9 LYS C C 0.822 -6.551 -3.225 1.00 . A A . 11 LYS C 1 1
4 599 1 1 9 LYS CA C 0.647 -5.070 -3.685 1.00 . A A . 11 LYS CA 1 1
4 600 1 1 9 LYS CB C 1.981 -4.409 -4.134 1.00 . A A . 11 LYS CB 1 1
4 601 1 1 9 LYS CD C 3.013 -2.133 -4.819 1.00 . A A . 11 LYS CD 1 1
4 602 1 1 9 LYS CE C 2.905 -1.225 -3.578 1.00 . A A . 11 LYS CE 1 1
4 603 1 1 9 LYS CG C 1.826 -3.104 -4.952 1.00 . A A . 11 LYS CG 1 1
4 604 1 1 9 LYS H H 0.738 -3.985 -1.759 1.00 . A A . 11 LYS H 1 1
4 605 1 1 9 LYS HA H -0.051 -5.054 -4.548 1.00 . A A . 11 LYS HA 1 1
4 606 1 1 9 LYS HB2 H 2.628 -4.240 -3.250 1.00 . A A . 11 LYS HB2 1 1
4 607 1 1 9 LYS HB3 H 2.558 -5.122 -4.750 1.00 . A A . 11 LYS HB3 1 1
4 608 1 1 9 LYS HD2 H 3.966 -2.698 -4.824 1.00 . A A . 11 LYS HD2 1 1
4 609 1 1 9 LYS HD3 H 3.049 -1.494 -5.723 1.00 . A A . 11 LYS HD3 1 1
4 610 1 1 9 LYS HE2 H 1.977 -0.627 -3.650 1.00 . A A . 11 LYS HE2 1 1
4 611 1 1 9 LYS HE3 H 2.819 -1.826 -2.651 1.00 . A A . 11 LYS HE3 1 1
4 612 1 1 9 LYS HG2 H 1.703 -3.372 -6.016 1.00 . A A . 11 LYS HG2 1 1
4 613 1 1 9 LYS HG3 H 0.893 -2.573 -4.680 1.00 . A A . 11 LYS HG3 1 1
4 614 1 1 9 LYS HZ1 H 4.951 -0.587 -4.069 1.00 . A A . 11 LYS HZ1 1 1
4 615 1 1 9 LYS N N 0.134 -4.266 -2.548 1.00 . A A . 11 LYS N 1 1
4 616 1 1 9 LYS NZ N 4.117 -0.389 -3.521 1.00 . A A . 11 LYS NZ 1 1
4 617 1 1 9 LYS O O 1.847 -6.975 -2.696 1.00 . A A . 11 LYS O 1 1
4 618 1 1 10 NH2 HN1 H -1.079 -7.002 -3.647 1.00 . A A . 12 NH2 HN1 1 1
4 619 1 1 10 NH2 HN2 H 0.013 -8.316 -2.971 1.00 . A A . 12 NH2 HN2 1 1
4 620 1 1 10 NH2 N N -0.172 -7.402 -3.393 1.00 . A A . 12 NH2 N 1 1
5 621 1 1 1 ACE C C 3.238 -4.044 0.036 1.00 . A A . 3 ACE C 1 1
5 622 1 1 1 ACE CH3 C 4.208 -5.147 -0.342 1.00 . A A . 3 ACE CH3 1 1
5 623 1 1 1 ACE H1 H 4.636 -5.633 0.553 1.00 . A A . 3 ACE H1 1 1
5 624 1 1 1 ACE H2 H 3.691 -5.931 -0.926 1.00 . A A . 3 ACE H2 1 1
5 625 1 1 1 ACE H3 H 5.035 -4.760 -0.965 1.00 . A A . 3 ACE H3 1 1
5 626 1 1 1 ACE O O 2.067 -4.089 -0.334 1.00 . A A . 3 ACE O 1 1
5 627 1 1 2 NLE C C 3.474 -0.576 0.595 1.00 . A A . 4 NLE C 1 1
5 628 1 1 2 NLE CA C 2.932 -1.892 1.229 1.00 . A A . 4 NLE CA 1 1
5 629 1 1 2 NLE CB C 2.966 -1.846 2.776 1.00 . A A . 4 NLE CB 1 1
5 630 1 1 2 NLE CD C 0.554 -1.058 3.430 1.00 . A A . 4 NLE CD 1 1
5 631 1 1 2 NLE CE C 0.089 -2.204 4.342 1.00 . A A . 4 NLE CE 1 1
5 632 1 1 2 NLE CG C 2.071 -0.792 3.478 1.00 . A A . 4 NLE CG 1 1
5 633 1 1 2 NLE H H 4.748 -3.127 0.942 1.00 . A A . 4 NLE H 1 1
5 634 1 1 2 NLE HA H 1.870 -2.033 0.938 1.00 . A A . 4 NLE HA 1 1
5 635 1 1 2 NLE HB2 H 4.010 -1.671 3.091 1.00 . A A . 4 NLE HB2 1 1
5 636 1 1 2 NLE HB3 H 2.701 -2.843 3.165 1.00 . A A . 4 NLE HB3 1 1
5 637 1 1 2 NLE HD2 H 0.219 -1.234 2.390 1.00 . A A . 4 NLE HD2 1 1
5 638 1 1 2 NLE HD3 H 0.031 -0.135 3.743 1.00 . A A . 4 NLE HD3 1 1
5 639 1 1 2 NLE HE1 H 0.327 -2.002 5.403 1.00 . A A . 4 NLE HE1 1 1
5 640 1 1 2 NLE HE2 H -1.005 -2.347 4.280 1.00 . A A . 4 NLE HE2 1 1
5 641 1 1 2 NLE HE3 H 0.559 -3.168 4.081 1.00 . A A . 4 NLE HE3 1 1
5 642 1 1 2 NLE HG2 H 2.276 0.207 3.050 1.00 . A A . 4 NLE HG2 1 1
5 643 1 1 2 NLE HG3 H 2.384 -0.700 4.536 1.00 . A A . 4 NLE HG3 1 1
5 644 1 1 2 NLE N N 3.740 -3.060 0.778 1.00 . A A . 4 NLE N 1 1
5 645 1 1 2 NLE O O 4.647 -0.219 0.742 1.00 . A A . 4 NLE O 1 1
5 646 1 1 3 ASP C C 2.118 2.636 0.021 1.00 . A A . 5 ASP C 1 1
5 647 1 1 3 ASP CA C 2.884 1.466 -0.697 1.00 . A A . 5 ASP CA 1 1
5 648 1 1 3 ASP CB C 2.478 1.416 -2.191 1.00 . A A . 5 ASP CB 1 1
5 649 1 1 3 ASP CG C 3.355 0.564 -3.122 1.00 . A A . 5 ASP CG 1 1
5 650 1 1 3 ASP H H 1.631 -0.254 -0.079 1.00 . A A . 5 ASP H 1 1
5 651 1 1 3 ASP HA H 3.974 1.653 -0.668 1.00 . A A . 5 ASP HA 1 1
5 652 1 1 3 ASP HB2 H 1.416 1.115 -2.255 1.00 . A A . 5 ASP HB2 1 1
5 653 1 1 3 ASP HB3 H 2.512 2.443 -2.589 1.00 . A A . 5 ASP HB3 1 1
5 654 1 1 3 ASP N N 2.576 0.157 -0.067 1.00 . A A . 5 ASP N 1 1
5 655 1 1 3 ASP O O 0.886 2.558 0.117 1.00 . A A . 5 ASP O 1 1
5 656 1 1 3 ASP OD1 O 4.562 0.431 -2.916 1.00 . A A . 5 ASP OD1 1 1
5 657 1 1 4 PRO C C 1.393 5.866 -0.092 1.00 . A A . 6 PRO C 1 1
5 658 1 1 4 PRO CA C 2.028 4.937 1.018 1.00 . A A . 6 PRO CA 1 1
5 659 1 1 4 PRO CB C 3.148 5.623 1.823 1.00 . A A . 6 PRO CB 1 1
5 660 1 1 4 PRO CD C 4.224 3.924 0.471 1.00 . A A . 6 PRO CD 1 1
5 661 1 1 4 PRO CG C 4.440 5.322 1.055 1.00 . A A . 6 PRO CG 1 1
5 662 1 1 4 PRO HA H 1.242 4.591 1.718 1.00 . A A . 6 PRO HA 1 1
5 663 1 1 4 PRO HB2 H 2.985 6.707 1.967 1.00 . A A . 6 PRO HB2 1 1
5 664 1 1 4 PRO HB3 H 3.206 5.180 2.837 1.00 . A A . 6 PRO HB3 1 1
5 665 1 1 4 PRO HD2 H 4.637 3.852 -0.556 1.00 . A A . 6 PRO HD2 1 1
5 666 1 1 4 PRO HD3 H 4.708 3.144 1.090 1.00 . A A . 6 PRO HD3 1 1
5 667 1 1 4 PRO HG2 H 4.570 6.055 0.236 1.00 . A A . 6 PRO HG2 1 1
5 668 1 1 4 PRO HG3 H 5.343 5.384 1.691 1.00 . A A . 6 PRO HG3 1 1
5 669 1 1 4 PRO N N 2.758 3.753 0.482 1.00 . A A . 6 PRO N 1 1
5 670 1 1 4 PRO O O 1.959 5.949 -1.190 1.00 . A A . 6 PRO O 1 1
5 671 1 1 5 PRO C C -1.440 5.495 1.849 1.00 . A A . 7 PRO C 1 1
5 672 1 1 5 PRO CA C -0.484 6.664 1.422 1.00 . A A . 7 PRO CA 1 1
5 673 1 1 5 PRO CB C -1.239 7.999 1.238 1.00 . A A . 7 PRO CB 1 1
5 674 1 1 5 PRO CD C -0.295 7.496 -0.913 1.00 . A A . 7 PRO CD 1 1
5 675 1 1 5 PRO CG C -1.543 8.088 -0.259 1.00 . A A . 7 PRO CG 1 1
5 676 1 1 5 PRO HA H 0.234 6.796 2.254 1.00 . A A . 7 PRO HA 1 1
5 677 1 1 5 PRO HB2 H -2.151 8.083 1.860 1.00 . A A . 7 PRO HB2 1 1
5 678 1 1 5 PRO HB3 H -0.588 8.844 1.540 1.00 . A A . 7 PRO HB3 1 1
5 679 1 1 5 PRO HD2 H -0.533 6.969 -1.858 1.00 . A A . 7 PRO HD2 1 1
5 680 1 1 5 PRO HD3 H 0.443 8.286 -1.152 1.00 . A A . 7 PRO HD3 1 1
5 681 1 1 5 PRO HG2 H -2.433 7.478 -0.508 1.00 . A A . 7 PRO HG2 1 1
5 682 1 1 5 PRO HG3 H -1.751 9.121 -0.596 1.00 . A A . 7 PRO HG3 1 1
5 683 1 1 5 PRO N N 0.244 6.580 0.116 1.00 . A A . 7 PRO N 1 1
5 684 1 1 5 PRO O O -2.037 5.580 2.925 1.00 . A A . 7 PRO O 1 1
5 685 1 1 6 . C C -2.796 2.378 0.195 1.00 . A A . 8 DPN C 1 1
5 686 1 1 6 . CA C -2.374 3.212 1.446 1.00 . A A . 8 DPN CA 1 1
5 687 1 1 6 . CB C -1.625 2.355 2.519 1.00 . A A . 8 DPN CB 1 1
5 688 1 1 6 . CD1 C -2.729 0.073 2.792 1.00 . A A . 8 DPN CD1 1 1
5 689 1 1 6 . CD2 C -3.117 1.748 4.487 1.00 . A A . 8 DPN CD2 1 1
5 690 1 1 6 . CE1 C -3.533 -0.823 3.492 1.00 . A A . 8 DPN CE1 1 1
5 691 1 1 6 . CE2 C -3.919 0.850 5.188 1.00 . A A . 8 DPN CE2 1 1
5 692 1 1 6 . CG C -2.515 1.365 3.285 1.00 . A A . 8 DPN CG 1 1
5 693 1 1 6 . CZ C -4.126 -0.434 4.690 1.00 . A A . 8 DPN CZ 1 1
5 694 1 1 6 . H H -0.974 4.439 0.226 1.00 . A A . 8 DPN H 1 1
5 695 1 1 6 . HA H -3.319 3.576 1.899 1.00 . A A . 8 DPN HA 1 1
5 696 1 1 6 . HB2 H -1.124 3.023 3.240 1.00 . A A . 8 DPN HB2 1 1
5 697 1 1 6 . HB3 H -0.770 1.820 2.061 1.00 . A A . 8 DPN HB3 1 1
5 698 1 1 6 . HD1 H -2.267 -0.243 1.869 1.00 . A A . 8 DPN HD1 1 1
5 699 1 1 6 . HD2 H -2.966 2.743 4.881 1.00 . A A . 8 DPN HD2 1 1
5 700 1 1 6 . HE1 H -3.687 -1.820 3.106 1.00 . A A . 8 DPN HE1 1 1
5 701 1 1 6 . HE2 H -4.378 1.153 6.118 1.00 . A A . 8 DPN HE2 1 1
5 702 1 1 6 . HZ H -4.748 -1.131 5.235 1.00 . A A . 8 DPN HZ 1 1
5 703 1 1 6 . N N -1.560 4.404 1.069 1.00 . A A . 8 DPN N 1 1
5 704 1 1 6 . O O -3.989 2.246 -0.091 1.00 . A A . 8 DPN O 1 1
5 705 1 1 7 ARG C C -1.314 -0.682 -0.852 1.00 . A A . 9 ARG C 1 1
5 706 1 1 7 ARG CA C -2.077 0.579 -1.368 1.00 . A A . 9 ARG CA 1 1
5 707 1 1 7 ARG CB C -1.670 0.900 -2.835 1.00 . A A . 9 ARG CB 1 1
5 708 1 1 7 ARG CD C -4.051 0.462 -3.946 1.00 . A A . 9 ARG CD 1 1
5 709 1 1 7 ARG CG C -2.805 1.369 -3.784 1.00 . A A . 9 ARG CG 1 1
5 710 1 1 7 ARG CZ C -4.601 -1.934 -4.465 1.00 . A A . 9 ARG CZ 1 1
5 711 1 1 7 ARG H H -0.880 1.953 -0.128 1.00 . A A . 9 ARG H 1 1
5 712 1 1 7 ARG HA H -3.158 0.332 -1.343 1.00 . A A . 9 ARG HA 1 1
5 713 1 1 7 ARG HB2 H -0.854 1.643 -2.843 1.00 . A A . 9 ARG HB2 1 1
5 714 1 1 7 ARG HB3 H -1.199 0.013 -3.300 1.00 . A A . 9 ARG HB3 1 1
5 715 1 1 7 ARG HD2 H -4.679 0.543 -3.035 1.00 . A A . 9 ARG HD2 1 1
5 716 1 1 7 ARG HD3 H -4.673 0.881 -4.764 1.00 . A A . 9 ARG HD3 1 1
5 717 1 1 7 ARG HE H -2.749 -1.306 -4.165 1.00 . A A . 9 ARG HE 1 1
5 718 1 1 7 ARG HG2 H -3.143 2.372 -3.454 1.00 . A A . 9 ARG HG2 1 1
5 719 1 1 7 ARG HG3 H -2.366 1.547 -4.785 1.00 . A A . 9 ARG HG3 1 1
5 720 1 1 7 ARG HH11 H -6.153 -0.733 -4.576 1.00 . A A . 9 ARG HH11 1 1
5 721 1 1 7 ARG HH12 H -6.491 -2.513 -4.835 1.00 . A A . 9 ARG HH12 1 1
5 722 1 1 7 ARG HH21 H -3.186 -3.326 -4.273 1.00 . A A . 9 ARG HH21 1 1
5 723 1 1 7 ARG HH22 H -4.865 -3.886 -4.725 1.00 . A A . 9 ARG HH22 1 1
5 724 1 1 7 ARG N N -1.825 1.748 -0.491 1.00 . A A . 9 ARG N 1 1
5 725 1 1 7 ARG NE N -3.717 -0.969 -4.215 1.00 . A A . 9 ARG NE 1 1
5 726 1 1 7 ARG NH1 N -5.881 -1.717 -4.641 1.00 . A A . 9 ARG NH1 1 1
5 727 1 1 7 ARG NH2 N -4.173 -3.160 -4.536 1.00 . A A . 9 ARG NH2 1 1
5 728 1 1 7 ARG O O -0.185 -0.622 -0.355 1.00 . A A . 9 ARG O 1 1
5 729 1 1 8 TRP C C -0.943 -3.763 -2.323 1.00 . A A . 10 TRP C 1 1
5 730 1 1 8 TRP CA C -1.292 -3.166 -0.915 1.00 . A A . 10 TRP CA 1 1
5 731 1 1 8 TRP CB C -2.257 -4.038 -0.070 1.00 . A A . 10 TRP CB 1 1
5 732 1 1 8 TRP CD1 C -2.279 -6.590 -0.529 1.00 . A A . 10 TRP CD1 1 1
5 733 1 1 8 TRP CD2 C -0.765 -5.943 0.963 1.00 . A A . 10 TRP CD2 1 1
5 734 1 1 8 TRP CE2 C -0.623 -7.331 0.715 1.00 . A A . 10 TRP CE2 1 1
5 735 1 1 8 TRP CE3 C 0.126 -5.272 1.835 1.00 . A A . 10 TRP CE3 1 1
5 736 1 1 8 TRP CG C -1.796 -5.475 0.174 1.00 . A A . 10 TRP CG 1 1
5 737 1 1 8 TRP CH2 C 1.295 -7.379 2.189 1.00 . A A . 10 TRP CH2 1 1
5 738 1 1 8 TRP CZ2 C 0.425 -8.055 1.328 1.00 . A A . 10 TRP CZ2 1 1
5 739 1 1 8 TRP CZ3 C 1.145 -6.008 2.440 1.00 . A A . 10 TRP CZ3 1 1
5 740 1 1 8 TRP H H -2.841 -1.754 -1.547 1.00 . A A . 10 TRP H 1 1
5 741 1 1 8 TRP HA H -0.357 -3.061 -0.324 1.00 . A A . 10 TRP HA 1 1
5 742 1 1 8 TRP HB2 H -2.413 -3.563 0.915 1.00 . A A . 10 TRP HB2 1 1
5 743 1 1 8 TRP HB3 H -3.254 -4.060 -0.544 1.00 . A A . 10 TRP HB3 1 1
5 744 1 1 8 TRP HD1 H -3.054 -6.510 -1.278 1.00 . A A . 10 TRP HD1 1 1
5 745 1 1 8 TRP HE1 H -1.686 -8.711 -0.578 1.00 . A A . 10 TRP HE1 1 1
5 746 1 1 8 TRP HE3 H 0.036 -4.208 1.997 1.00 . A A . 10 TRP HE3 1 1
5 747 1 1 8 TRP HH2 H 2.103 -7.920 2.660 1.00 . A A . 10 TRP HH2 1 1
5 748 1 1 8 TRP HZ2 H 0.557 -9.106 1.119 1.00 . A A . 10 TRP HZ2 1 1
5 749 1 1 8 TRP HZ3 H 1.843 -5.508 3.095 1.00 . A A . 10 TRP HZ3 1 1
5 750 1 1 8 TRP N N -1.943 -1.844 -1.066 1.00 . A A . 10 TRP N 1 1
5 751 1 1 8 TRP NE1 N -1.568 -7.763 -0.203 1.00 . A A . 10 TRP NE1 1 1
5 752 1 1 8 TRP O O -1.699 -3.656 -3.299 1.00 . A A . 10 TRP O 1 1
5 753 1 1 9 LYS C C 0.886 -6.635 -3.273 1.00 . A A . 11 LYS C 1 1
5 754 1 1 9 LYS CA C 0.742 -5.112 -3.581 1.00 . A A . 11 LYS CA 1 1
5 755 1 1 9 LYS CB C 2.103 -4.458 -3.952 1.00 . A A . 11 LYS CB 1 1
5 756 1 1 9 LYS CD C 3.413 -2.361 -4.647 1.00 . A A . 11 LYS CD 1 1
5 757 1 1 9 LYS CE C 3.395 -0.893 -5.124 1.00 . A A . 11 LYS CE 1 1
5 758 1 1 9 LYS CG C 2.024 -3.024 -4.516 1.00 . A A . 11 LYS CG 1 1
5 759 1 1 9 LYS H H 0.788 -4.331 -1.518 1.00 . A A . 11 LYS H 1 1
5 760 1 1 9 LYS HA H 0.063 -4.995 -4.450 1.00 . A A . 11 LYS HA 1 1
5 761 1 1 9 LYS HB2 H 2.767 -4.471 -3.064 1.00 . A A . 11 LYS HB2 1 1
5 762 1 1 9 LYS HB3 H 2.619 -5.091 -4.695 1.00 . A A . 11 LYS HB3 1 1
5 763 1 1 9 LYS HD2 H 3.947 -2.411 -3.677 1.00 . A A . 11 LYS HD2 1 1
5 764 1 1 9 LYS HD3 H 4.035 -2.954 -5.344 1.00 . A A . 11 LYS HD3 1 1
5 765 1 1 9 LYS HE2 H 4.434 -0.553 -5.318 1.00 . A A . 11 LYS HE2 1 1
5 766 1 1 9 LYS HE3 H 2.892 -0.825 -6.107 1.00 . A A . 11 LYS HE3 1 1
5 767 1 1 9 LYS HG2 H 1.508 -3.033 -5.494 1.00 . A A . 11 LYS HG2 1 1
5 768 1 1 9 LYS HG3 H 1.396 -2.407 -3.846 1.00 . A A . 11 LYS HG3 1 1
5 769 1 1 9 LYS HZ1 H 1.721 0.217 -4.201 1.00 . A A . 11 LYS HZ1 1 1
5 770 1 1 9 LYS N N 0.214 -4.423 -2.375 1.00 . A A . 11 LYS N 1 1
5 771 1 1 9 LYS NZ N 2.723 0.016 -4.165 1.00 . A A . 11 LYS NZ 1 1
5 772 1 1 9 LYS O O 1.877 -7.120 -2.730 1.00 . A A . 11 LYS O 1 1
5 773 1 1 10 NH2 HN1 H -0.986 -7.045 -3.850 1.00 . A A . 12 NH2 HN1 1 1
5 774 1 1 10 NH2 HN2 H 0.088 -8.419 -3.272 1.00 . A A . 12 NH2 HN2 1 1
5 775 1 1 10 NH2 N N -0.088 -7.463 -3.594 1.00 . A A . 12 NH2 N 1 1
6 776 1 1 1 ACE C C 2.820 -4.262 0.164 1.00 . A A . 3 ACE C 1 1
6 777 1 1 1 ACE CH3 C 3.734 -5.465 0.027 1.00 . A A . 3 ACE CH3 1 1
6 778 1 1 1 ACE H1 H 4.755 -5.156 -0.259 1.00 . A A . 3 ACE H1 1 1
6 779 1 1 1 ACE H2 H 3.796 -6.050 0.963 1.00 . A A . 3 ACE H2 1 1
6 780 1 1 1 ACE H3 H 3.361 -6.152 -0.753 1.00 . A A . 3 ACE H3 1 1
6 781 1 1 1 ACE O O 1.994 -4.000 -0.710 1.00 . A A . 3 ACE O 1 1
6 782 1 1 2 NLE C C 3.048 -1.045 1.278 1.00 . A A . 4 NLE C 1 1
6 783 1 1 2 NLE CA C 2.220 -2.325 1.609 1.00 . A A . 4 NLE CA 1 1
6 784 1 1 2 NLE CB C 1.882 -2.334 3.122 1.00 . A A . 4 NLE CB 1 1
6 785 1 1 2 NLE CD C 0.747 -3.454 5.133 1.00 . A A . 4 NLE CD 1 1
6 786 1 1 2 NLE CE C -0.297 -4.484 5.584 1.00 . A A . 4 NLE CE 1 1
6 787 1 1 2 NLE CG C 0.901 -3.427 3.602 1.00 . A A . 4 NLE CG 1 1
6 788 1 1 2 NLE H H 3.748 -3.876 1.887 1.00 . A A . 4 NLE H 1 1
6 789 1 1 2 NLE HA H 1.263 -2.315 1.048 1.00 . A A . 4 NLE HA 1 1
6 790 1 1 2 NLE HB2 H 1.454 -1.353 3.399 1.00 . A A . 4 NLE HB2 1 1
6 791 1 1 2 NLE HB3 H 2.828 -2.385 3.690 1.00 . A A . 4 NLE HB3 1 1
6 792 1 1 2 NLE HD2 H 0.466 -2.452 5.513 1.00 . A A . 4 NLE HD2 1 1
6 793 1 1 2 NLE HD3 H 1.721 -3.684 5.606 1.00 . A A . 4 NLE HD3 1 1
6 794 1 1 2 NLE HE1 H -0.394 -4.502 6.684 1.00 . A A . 4 NLE HE1 1 1
6 795 1 1 2 NLE HE2 H -1.300 -4.261 5.174 1.00 . A A . 4 NLE HE2 1 1
6 796 1 1 2 NLE HE3 H -0.030 -5.509 5.264 1.00 . A A . 4 NLE HE3 1 1
6 797 1 1 2 NLE HG2 H 1.252 -4.418 3.262 1.00 . A A . 4 NLE HG2 1 1
6 798 1 1 2 NLE HG3 H -0.084 -3.273 3.121 1.00 . A A . 4 NLE HG3 1 1
6 799 1 1 2 NLE N N 2.998 -3.549 1.276 1.00 . A A . 4 NLE N 1 1
6 800 1 1 2 NLE O O 4.191 -0.890 1.724 1.00 . A A . 4 NLE O 1 1
6 801 1 1 3 ASP C C 2.296 2.391 -0.051 1.00 . A A . 5 ASP C 1 1
6 802 1 1 3 ASP CA C 3.170 1.076 -0.017 1.00 . A A . 5 ASP CA 1 1
6 803 1 1 3 ASP CB C 3.838 0.695 -1.367 1.00 . A A . 5 ASP CB 1 1
6 804 1 1 3 ASP CG C 3.004 0.237 -2.577 1.00 . A A . 5 ASP CG 1 1
6 805 1 1 3 ASP H H 1.606 -0.446 0.045 1.00 . A A . 5 ASP H 1 1
6 806 1 1 3 ASP HA H 3.996 1.300 0.685 1.00 . A A . 5 ASP HA 1 1
6 807 1 1 3 ASP HB2 H 4.445 1.554 -1.677 1.00 . A A . 5 ASP HB2 1 1
6 808 1 1 3 ASP HB3 H 4.563 -0.114 -1.158 1.00 . A A . 5 ASP HB3 1 1
6 809 1 1 3 ASP N N 2.460 -0.121 0.507 1.00 . A A . 5 ASP N 1 1
6 810 1 1 3 ASP O O 1.069 2.297 -0.193 1.00 . A A . 5 ASP O 1 1
6 811 1 1 3 ASP OD1 O 1.823 -0.095 -2.480 1.00 . A A . 5 ASP OD1 1 1
6 812 1 1 4 PRO C C 1.243 5.354 -1.030 1.00 . A A . 6 PRO C 1 1
6 813 1 1 4 PRO CA C 2.065 4.885 0.231 1.00 . A A . 6 PRO CA 1 1
6 814 1 1 4 PRO CB C 3.126 5.912 0.682 1.00 . A A . 6 PRO CB 1 1
6 815 1 1 4 PRO CD C 4.317 3.872 0.261 1.00 . A A . 6 PRO CD 1 1
6 816 1 1 4 PRO CG C 4.451 5.386 0.135 1.00 . A A . 6 PRO CG 1 1
6 817 1 1 4 PRO HA H 1.369 4.734 1.073 1.00 . A A . 6 PRO HA 1 1
6 818 1 1 4 PRO HB2 H 2.916 6.946 0.347 1.00 . A A . 6 PRO HB2 1 1
6 819 1 1 4 PRO HB3 H 3.166 5.950 1.789 1.00 . A A . 6 PRO HB3 1 1
6 820 1 1 4 PRO HD2 H 4.940 3.363 -0.498 1.00 . A A . 6 PRO HD2 1 1
6 821 1 1 4 PRO HD3 H 4.652 3.529 1.260 1.00 . A A . 6 PRO HD3 1 1
6 822 1 1 4 PRO HG2 H 4.564 5.673 -0.930 1.00 . A A . 6 PRO HG2 1 1
6 823 1 1 4 PRO HG3 H 5.329 5.786 0.674 1.00 . A A . 6 PRO HG3 1 1
6 824 1 1 4 PRO N N 2.866 3.635 0.089 1.00 . A A . 6 PRO N 1 1
6 825 1 1 4 PRO O O 1.642 5.033 -2.155 1.00 . A A . 6 PRO O 1 1
6 826 1 1 5 PRO C C -1.116 5.691 1.423 1.00 . A A . 7 PRO C 1 1
6 827 1 1 5 PRO CA C -0.430 6.650 0.388 1.00 . A A . 7 PRO CA 1 1
6 828 1 1 5 PRO CB C -1.388 7.745 -0.126 1.00 . A A . 7 PRO CB 1 1
6 829 1 1 5 PRO CD C -0.660 6.557 -2.088 1.00 . A A . 7 PRO CD 1 1
6 830 1 1 5 PRO CG C -1.884 7.246 -1.485 1.00 . A A . 7 PRO CG 1 1
6 831 1 1 5 PRO HA H 0.391 7.145 0.940 1.00 . A A . 7 PRO HA 1 1
6 832 1 1 5 PRO HB2 H -2.219 7.973 0.570 1.00 . A A . 7 PRO HB2 1 1
6 833 1 1 5 PRO HB3 H -0.833 8.696 -0.256 1.00 . A A . 7 PRO HB3 1 1
6 834 1 1 5 PRO HD2 H -0.943 5.721 -2.756 1.00 . A A . 7 PRO HD2 1 1
6 835 1 1 5 PRO HD3 H -0.052 7.267 -2.682 1.00 . A A . 7 PRO HD3 1 1
6 836 1 1 5 PRO HG2 H -2.706 6.518 -1.348 1.00 . A A . 7 PRO HG2 1 1
6 837 1 1 5 PRO HG3 H -2.273 8.060 -2.125 1.00 . A A . 7 PRO HG3 1 1
6 838 1 1 5 PRO N N 0.099 6.099 -0.906 1.00 . A A . 7 PRO N 1 1
6 839 1 1 5 PRO O O -1.354 6.098 2.562 1.00 . A A . 7 PRO O 1 1
6 840 1 1 6 . C C -2.619 2.279 1.178 1.00 . A A . 8 DPN C 1 1
6 841 1 1 6 . CA C -1.853 3.367 1.992 1.00 . A A . 8 DPN CA 1 1
6 842 1 1 6 . CB C -0.658 2.811 2.833 1.00 . A A . 8 DPN CB 1 1
6 843 1 1 6 . CD1 C -1.080 0.453 3.701 1.00 . A A . 8 DPN CD1 1 1
6 844 1 1 6 . CD2 C -1.401 2.307 5.218 1.00 . A A . 8 DPN CD2 1 1
6 845 1 1 6 . CE1 C -1.485 -0.432 4.696 1.00 . A A . 8 DPN CE1 1 1
6 846 1 1 6 . CE2 C -1.792 1.417 6.217 1.00 . A A . 8 DPN CE2 1 1
6 847 1 1 6 . CG C -1.047 1.831 3.952 1.00 . A A . 8 DPN CG 1 1
6 848 1 1 6 . CZ C -1.836 0.049 5.955 1.00 . A A . 8 DPN CZ 1 1
6 849 1 1 6 . H H -1.085 4.226 0.095 1.00 . A A . 8 DPN H 1 1
6 850 1 1 6 . HA H -2.592 3.812 2.690 1.00 . A A . 8 DPN HA 1 1
6 851 1 1 6 . HB2 H -0.097 3.655 3.264 1.00 . A A . 8 DPN HB2 1 1
6 852 1 1 6 . HB3 H 0.089 2.337 2.170 1.00 . A A . 8 DPN HB3 1 1
6 853 1 1 6 . HD1 H -0.814 0.067 2.726 1.00 . A A . 8 DPN HD1 1 1
6 854 1 1 6 . HD2 H -1.386 3.366 5.427 1.00 . A A . 8 DPN HD2 1 1
6 855 1 1 6 . HE1 H -1.532 -1.490 4.489 1.00 . A A . 8 DPN HE1 1 1
6 856 1 1 6 . HE2 H -2.069 1.789 7.193 1.00 . A A . 8 DPN HE2 1 1
6 857 1 1 6 . HZ H -2.147 -0.639 6.728 1.00 . A A . 8 DPN HZ 1 1
6 858 1 1 6 . N N -1.372 4.425 1.061 1.00 . A A . 8 DPN N 1 1
6 859 1 1 6 . O O -3.836 2.137 1.313 1.00 . A A . 8 DPN O 1 1
6 860 1 1 7 ARG C C -1.574 -0.868 -0.409 1.00 . A A . 9 ARG C 1 1
6 861 1 1 7 ARG CA C -2.446 0.429 -0.487 1.00 . A A . 9 ARG CA 1 1
6 862 1 1 7 ARG CB C -2.591 0.976 -1.936 1.00 . A A . 9 ARG CB 1 1
6 863 1 1 7 ARG CD C -1.390 1.226 -4.250 1.00 . A A . 9 ARG CD 1 1
6 864 1 1 7 ARG CG C -1.285 1.316 -2.716 1.00 . A A . 9 ARG CG 1 1
6 865 1 1 7 ARG CZ C -1.782 -0.624 -5.904 1.00 . A A . 9 ARG CZ 1 1
6 866 1 1 7 ARG H H -0.899 1.772 0.285 1.00 . A A . 9 ARG H 1 1
6 867 1 1 7 ARG HA H -3.460 0.163 -0.119 1.00 . A A . 9 ARG HA 1 1
6 868 1 1 7 ARG HB2 H -3.169 0.223 -2.493 1.00 . A A . 9 ARG HB2 1 1
6 869 1 1 7 ARG HB3 H -3.246 1.868 -1.922 1.00 . A A . 9 ARG HB3 1 1
6 870 1 1 7 ARG HD2 H -2.234 1.854 -4.604 1.00 . A A . 9 ARG HD2 1 1
6 871 1 1 7 ARG HD3 H -0.469 1.655 -4.696 1.00 . A A . 9 ARG HD3 1 1
6 872 1 1 7 ARG HE H -1.554 -0.952 -3.967 1.00 . A A . 9 ARG HE 1 1
6 873 1 1 7 ARG HG2 H -0.950 2.332 -2.427 1.00 . A A . 9 ARG HG2 1 1
6 874 1 1 7 ARG HG3 H -0.453 0.672 -2.379 1.00 . A A . 9 ARG HG3 1 1
6 875 1 1 7 ARG HH11 H -1.603 1.140 -6.741 1.00 . A A . 9 ARG HH11 1 1
6 876 1 1 7 ARG HH12 H -1.985 -0.254 -7.867 1.00 . A A . 9 ARG HH12 1 1
6 877 1 1 7 ARG HH21 H -2.025 -2.453 -5.201 1.00 . A A . 9 ARG HH21 1 1
6 878 1 1 7 ARG HH22 H -2.210 -2.226 -7.015 1.00 . A A . 9 ARG HH22 1 1
6 879 1 1 7 ARG N N -1.891 1.515 0.346 1.00 . A A . 9 ARG N 1 1
6 880 1 1 7 ARG NE N -1.548 -0.197 -4.667 1.00 . A A . 9 ARG NE 1 1
6 881 1 1 7 ARG NH1 N -1.795 0.159 -6.953 1.00 . A A . 9 ARG NH1 1 1
6 882 1 1 7 ARG NH2 N -2.011 -1.893 -6.070 1.00 . A A . 9 ARG NH2 1 1
6 883 1 1 7 ARG O O -0.367 -0.829 -0.145 1.00 . A A . 9 ARG O 1 1
6 884 1 1 8 TRP C C -1.080 -3.302 -2.589 1.00 . A A . 10 TRP C 1 1
6 885 1 1 8 TRP CA C -1.422 -3.252 -1.063 1.00 . A A . 10 TRP CA 1 1
6 886 1 1 8 TRP CB C -2.275 -4.459 -0.594 1.00 . A A . 10 TRP CB 1 1
6 887 1 1 8 TRP CD1 C -1.841 -6.632 -1.953 1.00 . A A . 10 TRP CD1 1 1
6 888 1 1 8 TRP CD2 C -0.714 -6.512 -0.044 1.00 . A A . 10 TRP CD2 1 1
6 889 1 1 8 TRP CE2 C -0.361 -7.702 -0.729 1.00 . A A . 10 TRP CE2 1 1
6 890 1 1 8 TRP CE3 C -0.111 -6.187 1.193 1.00 . A A . 10 TRP CE3 1 1
6 891 1 1 8 TRP CG C -1.640 -5.837 -0.812 1.00 . A A . 10 TRP CG 1 1
6 892 1 1 8 TRP CH2 C 1.188 -8.245 1.048 1.00 . A A . 10 TRP CH2 1 1
6 893 1 1 8 TRP CZ2 C 0.605 -8.576 -0.179 1.00 . A A . 10 TRP CZ2 1 1
6 894 1 1 8 TRP CZ3 C 0.833 -7.069 1.725 1.00 . A A . 10 TRP CZ3 1 1
6 895 1 1 8 TRP H H -3.167 -1.943 -0.991 1.00 . A A . 10 TRP H 1 1
6 896 1 1 8 TRP HA H -0.485 -3.277 -0.466 1.00 . A A . 10 TRP HA 1 1
6 897 1 1 8 TRP HB2 H -2.495 -4.357 0.481 1.00 . A A . 10 TRP HB2 1 1
6 898 1 1 8 TRP HB3 H -3.257 -4.437 -1.099 1.00 . A A . 10 TRP HB3 1 1
6 899 1 1 8 TRP HD1 H -2.471 -6.315 -2.770 1.00 . A A . 10 TRP HD1 1 1
6 900 1 1 8 TRP HE1 H -0.974 -8.531 -2.641 1.00 . A A . 10 TRP HE1 1 1
6 901 1 1 8 TRP HE3 H -0.374 -5.273 1.703 1.00 . A A . 10 TRP HE3 1 1
6 902 1 1 8 TRP HH2 H 1.924 -8.905 1.482 1.00 . A A . 10 TRP HH2 1 1
6 903 1 1 8 TRP HZ2 H 0.886 -9.482 -0.696 1.00 . A A . 10 TRP HZ2 1 1
6 904 1 1 8 TRP HZ3 H 1.302 -6.839 2.670 1.00 . A A . 10 TRP HZ3 1 1
6 905 1 1 8 TRP N N -2.180 -2.020 -0.737 1.00 . A A . 10 TRP N 1 1
6 906 1 1 8 TRP NE1 N -1.056 -7.801 -1.925 1.00 . A A . 10 TRP NE1 1 1
6 907 1 1 8 TRP O O -1.895 -2.993 -3.467 1.00 . A A . 10 TRP O 1 1
6 908 1 1 9 LYS C C 1.117 -5.702 -4.240 1.00 . A A . 11 LYS C 1 1
6 909 1 1 9 LYS CA C 0.541 -4.248 -4.226 1.00 . A A . 11 LYS CA 1 1
6 910 1 1 9 LYS CB C 1.409 -3.173 -4.920 1.00 . A A . 11 LYS CB 1 1
6 911 1 1 9 LYS CD C 3.592 -1.834 -5.213 1.00 . A A . 11 LYS CD 1 1
6 912 1 1 9 LYS CE C 3.141 -0.374 -4.975 1.00 . A A . 11 LYS CE 1 1
6 913 1 1 9 LYS CG C 2.842 -2.918 -4.402 1.00 . A A . 11 LYS CG 1 1
6 914 1 1 9 LYS H H 0.759 -3.835 -2.067 1.00 . A A . 11 LYS H 1 1
6 915 1 1 9 LYS HA H -0.364 -4.339 -4.858 1.00 . A A . 11 LYS HA 1 1
6 916 1 1 9 LYS HB2 H 1.474 -3.453 -5.980 1.00 . A A . 11 LYS HB2 1 1
6 917 1 1 9 LYS HB3 H 0.851 -2.219 -4.896 1.00 . A A . 11 LYS HB3 1 1
6 918 1 1 9 LYS HD2 H 4.678 -1.921 -5.011 1.00 . A A . 11 LYS HD2 1 1
6 919 1 1 9 LYS HD3 H 3.502 -2.066 -6.291 1.00 . A A . 11 LYS HD3 1 1
6 920 1 1 9 LYS HE2 H 3.509 0.253 -5.809 1.00 . A A . 11 LYS HE2 1 1
6 921 1 1 9 LYS HE3 H 2.039 -0.274 -5.020 1.00 . A A . 11 LYS HE3 1 1
6 922 1 1 9 LYS HG2 H 2.815 -2.649 -3.328 1.00 . A A . 11 LYS HG2 1 1
6 923 1 1 9 LYS HG3 H 3.415 -3.862 -4.457 1.00 . A A . 11 LYS HG3 1 1
6 924 1 1 9 LYS HZ1 H 4.684 0.428 -3.619 1.00 . A A . 11 LYS HZ1 1 1
6 925 1 1 9 LYS N N 0.136 -3.765 -2.881 1.00 . A A . 11 LYS N 1 1
6 926 1 1 9 LYS NZ N 3.698 0.174 -3.718 1.00 . A A . 11 LYS NZ 1 1
6 927 1 1 9 LYS O O 0.757 -6.512 -5.088 1.00 . A A . 11 LYS O 1 1
6 928 1 1 10 NH2 HN1 H 2.161 -7.129 -3.394 1.00 . A A . 12 NH2 HN1 1 1
6 929 1 1 10 NH2 HN2 H 2.176 -5.490 -2.557 1.00 . A A . 12 NH2 HN2 1 1
6 930 1 1 10 NH2 N N 1.995 -6.121 -3.346 1.00 . A A . 12 NH2 N 1 1
7 931 1 1 1 ACE C C 2.730 -3.958 0.685 1.00 . A A . 3 ACE C 1 1
7 932 1 1 1 ACE CH3 C 3.682 -5.134 0.772 1.00 . A A . 3 ACE CH3 1 1
7 933 1 1 1 ACE H1 H 3.227 -6.034 0.321 1.00 . A A . 3 ACE H1 1 1
7 934 1 1 1 ACE H2 H 4.623 -4.931 0.232 1.00 . A A . 3 ACE H2 1 1
7 935 1 1 1 ACE H3 H 3.926 -5.384 1.821 1.00 . A A . 3 ACE H3 1 1
7 936 1 1 1 ACE O O 1.649 -4.070 0.109 1.00 . A A . 3 ACE O 1 1
7 937 1 1 2 NLE C C 3.108 -0.380 0.769 1.00 . A A . 4 NLE C 1 1
7 938 1 1 2 NLE CA C 2.331 -1.601 1.354 1.00 . A A . 4 NLE CA 1 1
7 939 1 1 2 NLE CB C 1.966 -1.335 2.836 1.00 . A A . 4 NLE CB 1 1
7 940 1 1 2 NLE CD C 0.593 -1.957 4.911 1.00 . A A . 4 NLE CD 1 1
7 941 1 1 2 NLE CE C -0.502 -2.872 5.478 1.00 . A A . 4 NLE CE 1 1
7 942 1 1 2 NLE CG C 0.892 -2.268 3.436 1.00 . A A . 4 NLE CG 1 1
7 943 1 1 2 NLE H H 4.045 -2.912 1.762 1.00 . A A . 4 NLE H 1 1
7 944 1 1 2 NLE HA H 1.378 -1.725 0.797 1.00 . A A . 4 NLE HA 1 1
7 945 1 1 2 NLE HB2 H 1.608 -0.298 2.936 1.00 . A A . 4 NLE HB2 1 1
7 946 1 1 2 NLE HB3 H 2.889 -1.355 3.440 1.00 . A A . 4 NLE HB3 1 1
7 947 1 1 2 NLE HD2 H 0.284 -0.900 5.025 1.00 . A A . 4 NLE HD2 1 1
7 948 1 1 2 NLE HD3 H 1.514 -2.063 5.517 1.00 . A A . 4 NLE HD3 1 1
7 949 1 1 2 NLE HE1 H -0.214 -3.939 5.430 1.00 . A A . 4 NLE HE1 1 1
7 950 1 1 2 NLE HE2 H -0.709 -2.639 6.539 1.00 . A A . 4 NLE HE2 1 1
7 951 1 1 2 NLE HE3 H -1.456 -2.762 4.929 1.00 . A A . 4 NLE HE3 1 1
7 952 1 1 2 NLE HG2 H 1.218 -3.321 3.339 1.00 . A A . 4 NLE HG2 1 1
7 953 1 1 2 NLE HG3 H -0.038 -2.185 2.841 1.00 . A A . 4 NLE HG3 1 1
7 954 1 1 2 NLE N N 3.154 -2.837 1.267 1.00 . A A . 4 NLE N 1 1
7 955 1 1 2 NLE O O 4.182 -0.005 1.250 1.00 . A A . 4 NLE O 1 1
7 956 1 1 3 ASP C C 2.269 2.786 -0.224 1.00 . A A . 5 ASP C 1 1
7 957 1 1 3 ASP CA C 3.027 1.541 -0.817 1.00 . A A . 5 ASP CA 1 1
7 958 1 1 3 ASP CB C 2.826 1.497 -2.354 1.00 . A A . 5 ASP CB 1 1
7 959 1 1 3 ASP CG C 3.805 0.597 -3.115 1.00 . A A . 5 ASP CG 1 1
7 960 1 1 3 ASP H H 1.607 -0.130 -0.521 1.00 . A A . 5 ASP H 1 1
7 961 1 1 3 ASP HA H 4.111 1.635 -0.612 1.00 . A A . 5 ASP HA 1 1
7 962 1 1 3 ASP HB2 H 1.775 1.255 -2.602 1.00 . A A . 5 ASP HB2 1 1
7 963 1 1 3 ASP HB3 H 2.972 2.511 -2.761 1.00 . A A . 5 ASP HB3 1 1
7 964 1 1 3 ASP N N 2.513 0.269 -0.238 1.00 . A A . 5 ASP N 1 1
7 965 1 1 3 ASP O O 1.040 2.718 -0.109 1.00 . A A . 5 ASP O 1 1
7 966 1 1 3 ASP OD1 O 4.958 0.980 -3.321 1.00 . A A . 5 ASP OD1 1 1
7 967 1 1 4 PRO C C 1.239 5.877 -0.360 1.00 . A A . 6 PRO C 1 1
7 968 1 1 4 PRO CA C 2.176 5.130 0.669 1.00 . A A . 6 PRO CA 1 1
7 969 1 1 4 PRO CB C 3.347 5.999 1.172 1.00 . A A . 6 PRO CB 1 1
7 970 1 1 4 PRO CD C 4.355 4.162 -0.032 1.00 . A A . 6 PRO CD 1 1
7 971 1 1 4 PRO CG C 4.529 5.653 0.261 1.00 . A A . 6 PRO CG 1 1
7 972 1 1 4 PRO HA H 1.602 4.808 1.552 1.00 . A A . 6 PRO HA 1 1
7 973 1 1 4 PRO HB2 H 3.121 7.083 1.176 1.00 . A A . 6 PRO HB2 1 1
7 974 1 1 4 PRO HB3 H 3.593 5.732 2.218 1.00 . A A . 6 PRO HB3 1 1
7 975 1 1 4 PRO HD2 H 4.717 3.911 -1.049 1.00 . A A . 6 PRO HD2 1 1
7 976 1 1 4 PRO HD3 H 4.918 3.542 0.693 1.00 . A A . 6 PRO HD3 1 1
7 977 1 1 4 PRO HG2 H 4.462 6.233 -0.679 1.00 . A A . 6 PRO HG2 1 1
7 978 1 1 4 PRO HG3 H 5.508 5.887 0.718 1.00 . A A . 6 PRO HG3 1 1
7 979 1 1 4 PRO N N 2.902 3.946 0.121 1.00 . A A . 6 PRO N 1 1
7 980 1 1 4 PRO O O 1.669 6.052 -1.508 1.00 . A A . 6 PRO O 1 1
7 981 1 1 5 PRO C C -1.554 5.039 1.548 1.00 . A A . 7 PRO C 1 1
7 982 1 1 5 PRO CA C -0.634 6.289 1.314 1.00 . A A . 7 PRO CA 1 1
7 983 1 1 5 PRO CB C -1.384 7.640 1.330 1.00 . A A . 7 PRO CB 1 1
7 984 1 1 5 PRO CD C -0.730 7.265 -0.957 1.00 . A A . 7 PRO CD 1 1
7 985 1 1 5 PRO CG C -1.858 7.853 -0.110 1.00 . A A . 7 PRO CG 1 1
7 986 1 1 5 PRO HA H 0.116 6.327 2.126 1.00 . A A . 7 PRO HA 1 1
7 987 1 1 5 PRO HB2 H -2.214 7.672 2.060 1.00 . A A . 7 PRO HB2 1 1
7 988 1 1 5 PRO HB3 H -0.690 8.455 1.621 1.00 . A A . 7 PRO HB3 1 1
7 989 1 1 5 PRO HD2 H -1.109 6.736 -1.852 1.00 . A A . 7 PRO HD2 1 1
7 990 1 1 5 PRO HD3 H -0.052 8.064 -1.311 1.00 . A A . 7 PRO HD3 1 1
7 991 1 1 5 PRO HG2 H -2.801 7.302 -0.290 1.00 . A A . 7 PRO HG2 1 1
7 992 1 1 5 PRO HG3 H -2.056 8.916 -0.343 1.00 . A A . 7 PRO HG3 1 1
7 993 1 1 5 PRO N N -0.009 6.353 -0.041 1.00 . A A . 7 PRO N 1 1
7 994 1 1 5 PRO O O -2.787 5.120 1.589 1.00 . A A . 7 PRO O 1 1
7 995 1 1 6 . C C -2.345 1.921 0.758 1.00 . A A . 8 DPN C 1 1
7 996 1 1 6 . CA C -1.640 2.581 1.990 1.00 . A A . 8 DPN CA 1 1
7 997 1 1 6 . CB C -0.609 1.599 2.624 1.00 . A A . 8 DPN CB 1 1
7 998 1 1 6 . CD1 C 1.342 2.472 4.004 1.00 . A A . 8 DPN CD1 1 1
7 999 1 1 6 . CD2 C -0.699 1.889 5.157 1.00 . A A . 8 DPN CD2 1 1
7 1000 1 1 6 . CE1 C 1.927 2.823 5.218 1.00 . A A . 8 DPN CE1 1 1
7 1001 1 1 6 . CE2 C -0.111 2.240 6.371 1.00 . A A . 8 DPN CE2 1 1
7 1002 1 1 6 . CG C 0.024 2.004 3.966 1.00 . A A . 8 DPN CG 1 1
7 1003 1 1 6 . CZ C 1.201 2.705 6.401 1.00 . A A . 8 DPN CZ 1 1
7 1004 1 1 6 . H H 0.033 3.846 1.357 1.00 . A A . 8 DPN H 1 1
7 1005 1 1 6 . HA H -2.431 2.769 2.744 1.00 . A A . 8 DPN HA 1 1
7 1006 1 1 6 . HB2 H 0.190 1.376 1.891 1.00 . A A . 8 DPN HB2 1 1
7 1007 1 1 6 . HB3 H -1.096 0.618 2.750 1.00 . A A . 8 DPN HB3 1 1
7 1008 1 1 6 . HD1 H 1.920 2.561 3.094 1.00 . A A . 8 DPN HD1 1 1
7 1009 1 1 6 . HD2 H -1.717 1.523 5.147 1.00 . A A . 8 DPN HD2 1 1
7 1010 1 1 6 . HE1 H 2.947 3.181 5.243 1.00 . A A . 8 DPN HE1 1 1
7 1011 1 1 6 . HE2 H -0.673 2.147 7.291 1.00 . A A . 8 DPN HE2 1 1
7 1012 1 1 6 . HZ H 1.657 2.975 7.343 1.00 . A A . 8 DPN HZ 1 1
7 1013 1 1 6 . N N -0.939 3.860 1.683 1.00 . A A . 8 DPN N 1 1
7 1014 1 1 6 . O O -3.543 1.641 0.811 1.00 . A A . 8 DPN O 1 1
7 1015 1 1 7 ARG C C -1.267 -0.598 -1.264 1.00 . A A . 9 ARG C 1 1
7 1016 1 1 7 ARG CA C -2.024 0.761 -1.429 1.00 . A A . 9 ARG CA 1 1
7 1017 1 1 7 ARG CB C -1.692 1.394 -2.807 1.00 . A A . 9 ARG CB 1 1
7 1018 1 1 7 ARG CD C -2.362 3.957 -2.839 1.00 . A A . 9 ARG CD 1 1
7 1019 1 1 7 ARG CG C -2.615 2.518 -3.352 1.00 . A A . 9 ARG CG 1 1
7 1020 1 1 7 ARG CZ C -4.368 4.647 -1.475 1.00 . A A . 9 ARG CZ 1 1
7 1021 1 1 7 ARG H H -0.610 1.932 -0.226 1.00 . A A . 9 ARG H 1 1
7 1022 1 1 7 ARG HA H -3.119 0.586 -1.389 1.00 . A A . 9 ARG HA 1 1
7 1023 1 1 7 ARG HB2 H -0.633 1.710 -2.829 1.00 . A A . 9 ARG HB2 1 1
7 1024 1 1 7 ARG HB3 H -1.734 0.577 -3.554 1.00 . A A . 9 ARG HB3 1 1
7 1025 1 1 7 ARG HD2 H -1.273 4.105 -2.677 1.00 . A A . 9 ARG HD2 1 1
7 1026 1 1 7 ARG HD3 H -2.602 4.695 -3.630 1.00 . A A . 9 ARG HD3 1 1
7 1027 1 1 7 ARG HE H -2.624 4.190 -0.667 1.00 . A A . 9 ARG HE 1 1
7 1028 1 1 7 ARG HG2 H -2.469 2.543 -4.450 1.00 . A A . 9 ARG HG2 1 1
7 1029 1 1 7 ARG HG3 H -3.678 2.230 -3.234 1.00 . A A . 9 ARG HG3 1 1
7 1030 1 1 7 ARG HH11 H -4.738 4.521 -3.394 1.00 . A A . 9 ARG HH11 1 1
7 1031 1 1 7 ARG HH12 H -6.144 5.029 -2.332 1.00 . A A . 9 ARG HH12 1 1
7 1032 1 1 7 ARG HH21 H -4.157 4.874 0.487 1.00 . A A . 9 ARG HH21 1 1
7 1033 1 1 7 ARG HH22 H -5.821 5.173 -0.217 1.00 . A A . 9 ARG HH22 1 1
7 1034 1 1 7 ARG N N -1.600 1.662 -0.331 1.00 . A A . 9 ARG N 1 1
7 1035 1 1 7 ARG NE N -3.088 4.287 -1.578 1.00 . A A . 9 ARG NE 1 1
7 1036 1 1 7 ARG NH1 N -5.175 4.753 -2.500 1.00 . A A . 9 ARG NH1 1 1
7 1037 1 1 7 ARG NH2 N -4.838 4.907 -0.292 1.00 . A A . 9 ARG NH2 1 1
7 1038 1 1 7 ARG O O -0.046 -0.641 -1.075 1.00 . A A . 9 ARG O 1 1
7 1039 1 1 8 TRP C C -0.864 -3.650 -2.515 1.00 . A A . 10 TRP C 1 1
7 1040 1 1 8 TRP CA C -1.443 -3.071 -1.180 1.00 . A A . 10 TRP CA 1 1
7 1041 1 1 8 TRP CB C -2.582 -3.924 -0.564 1.00 . A A . 10 TRP CB 1 1
7 1042 1 1 8 TRP CD1 C -2.673 -6.471 -1.048 1.00 . A A . 10 TRP CD1 1 1
7 1043 1 1 8 TRP CD2 C -1.467 -5.930 0.737 1.00 . A A . 10 TRP CD2 1 1
7 1044 1 1 8 TRP CE2 C -1.422 -7.334 0.544 1.00 . A A . 10 TRP CE2 1 1
7 1045 1 1 8 TRP CE3 C -0.763 -5.327 1.806 1.00 . A A . 10 TRP CE3 1 1
7 1046 1 1 8 TRP CG C -2.246 -5.387 -0.265 1.00 . A A . 10 TRP CG 1 1
7 1047 1 1 8 TRP CH2 C 0.036 -7.532 2.465 1.00 . A A . 10 TRP CH2 1 1
7 1048 1 1 8 TRP CZ2 C -0.660 -8.143 1.418 1.00 . A A . 10 TRP CZ2 1 1
7 1049 1 1 8 TRP CZ3 C -0.016 -6.146 2.656 1.00 . A A . 10 TRP CZ3 1 1
7 1050 1 1 8 TRP H H -2.936 -1.572 -1.756 1.00 . A A . 10 TRP H 1 1
7 1051 1 1 8 TRP HA H -0.636 -3.026 -0.419 1.00 . A A . 10 TRP HA 1 1
7 1052 1 1 8 TRP HB2 H -2.918 -3.465 0.383 1.00 . A A . 10 TRP HB2 1 1
7 1053 1 1 8 TRP HB3 H -3.463 -3.895 -1.229 1.00 . A A . 10 TRP HB3 1 1
7 1054 1 1 8 TRP HD1 H -3.286 -6.342 -1.929 1.00 . A A . 10 TRP HD1 1 1
7 1055 1 1 8 TRP HE1 H -2.346 -8.645 -0.920 1.00 . A A . 10 TRP HE1 1 1
7 1056 1 1 8 TRP HE3 H -0.795 -4.258 1.947 1.00 . A A . 10 TRP HE3 1 1
7 1057 1 1 8 TRP HH2 H 0.622 -8.141 3.139 1.00 . A A . 10 TRP HH2 1 1
7 1058 1 1 8 TRP HZ2 H -0.614 -9.213 1.276 1.00 . A A . 10 TRP HZ2 1 1
7 1059 1 1 8 TRP HZ3 H 0.532 -5.702 3.474 1.00 . A A . 10 TRP HZ3 1 1
7 1060 1 1 8 TRP N N -2.005 -1.710 -1.358 1.00 . A A . 10 TRP N 1 1
7 1061 1 1 8 TRP NE1 N -2.174 -7.698 -0.562 1.00 . A A . 10 TRP NE1 1 1
7 1062 1 1 8 TRP O O -1.450 -3.528 -3.594 1.00 . A A . 10 TRP O 1 1
7 1063 1 1 9 LYS C C 0.425 -6.377 -3.912 1.00 . A A . 11 LYS C 1 1
7 1064 1 1 9 LYS CA C 0.992 -4.972 -3.531 1.00 . A A . 11 LYS CA 1 1
7 1065 1 1 9 LYS CB C 2.515 -5.037 -3.206 1.00 . A A . 11 LYS CB 1 1
7 1066 1 1 9 LYS CD C 3.435 -2.909 -4.388 1.00 . A A . 11 LYS CD 1 1
7 1067 1 1 9 LYS CE C 4.171 -1.565 -4.238 1.00 . A A . 11 LYS CE 1 1
7 1068 1 1 9 LYS CG C 3.280 -3.700 -3.067 1.00 . A A . 11 LYS CG 1 1
7 1069 1 1 9 LYS H H 0.672 -4.311 -1.435 1.00 . A A . 11 LYS H 1 1
7 1070 1 1 9 LYS HA H 0.869 -4.347 -4.437 1.00 . A A . 11 LYS HA 1 1
7 1071 1 1 9 LYS HB2 H 2.657 -5.614 -2.271 1.00 . A A . 11 LYS HB2 1 1
7 1072 1 1 9 LYS HB3 H 3.024 -5.644 -3.978 1.00 . A A . 11 LYS HB3 1 1
7 1073 1 1 9 LYS HD2 H 3.990 -3.533 -5.113 1.00 . A A . 11 LYS HD2 1 1
7 1074 1 1 9 LYS HD3 H 2.449 -2.737 -4.860 1.00 . A A . 11 LYS HD3 1 1
7 1075 1 1 9 LYS HE2 H 5.140 -1.711 -3.717 1.00 . A A . 11 LYS HE2 1 1
7 1076 1 1 9 LYS HE3 H 4.430 -1.168 -5.239 1.00 . A A . 11 LYS HE3 1 1
7 1077 1 1 9 LYS HG2 H 2.787 -3.073 -2.299 1.00 . A A . 11 LYS HG2 1 1
7 1078 1 1 9 LYS HG3 H 4.285 -3.909 -2.654 1.00 . A A . 11 LYS HG3 1 1
7 1079 1 1 9 LYS HZ1 H 2.378 -0.789 -3.213 1.00 . A A . 11 LYS HZ1 1 1
7 1080 1 1 9 LYS N N 0.286 -4.320 -2.391 1.00 . A A . 11 LYS N 1 1
7 1081 1 1 9 LYS NZ N 3.331 -0.580 -3.525 1.00 . A A . 11 LYS NZ 1 1
7 1082 1 1 9 LYS O O 0.129 -6.651 -5.070 1.00 . A A . 11 LYS O 1 1
7 1083 1 1 10 NH2 HN1 H -0.220 -8.144 -3.376 1.00 . A A . 12 NH2 HN1 1 1
7 1084 1 1 10 NH2 HN2 H 0.309 -7.021 -2.029 1.00 . A A . 12 NH2 HN2 1 1
7 1085 1 1 10 NH2 N N 0.265 -7.326 -3.007 1.00 . A A . 12 NH2 N 1 1
8 1086 1 1 1 ACE C C 2.862 -3.848 0.614 1.00 . A A . 3 ACE C 1 1
8 1087 1 1 1 ACE CH3 C 3.818 -5.022 0.668 1.00 . A A . 3 ACE CH3 1 1
8 1088 1 1 1 ACE H1 H 4.744 -4.813 0.103 1.00 . A A . 3 ACE H1 1 1
8 1089 1 1 1 ACE H2 H 4.091 -5.276 1.709 1.00 . A A . 3 ACE H2 1 1
8 1090 1 1 1 ACE H3 H 3.353 -5.920 0.225 1.00 . A A . 3 ACE H3 1 1
8 1091 1 1 1 ACE O O 1.774 -3.952 0.050 1.00 . A A . 3 ACE O 1 1
8 1092 1 1 2 NLE C C 3.147 -0.308 0.629 1.00 . A A . 4 NLE C 1 1
8 1093 1 1 2 NLE CA C 2.455 -1.511 1.343 1.00 . A A . 4 NLE CA 1 1
8 1094 1 1 2 NLE CB C 2.262 -1.176 2.844 1.00 . A A . 4 NLE CB 1 1
8 1095 1 1 2 NLE CD C 1.321 -1.765 5.161 1.00 . A A . 4 NLE CD 1 1
8 1096 1 1 2 NLE CE C 0.632 -2.843 6.008 1.00 . A A . 4 NLE CE 1 1
8 1097 1 1 2 NLE CG C 1.536 -2.229 3.710 1.00 . A A . 4 NLE CG 1 1
8 1098 1 1 2 NLE H H 4.187 -2.811 1.691 1.00 . A A . 4 NLE H 1 1
8 1099 1 1 2 NLE HA H 1.445 -1.672 0.906 1.00 . A A . 4 NLE HA 1 1
8 1100 1 1 2 NLE HB2 H 1.705 -0.225 2.916 1.00 . A A . 4 NLE HB2 1 1
8 1101 1 1 2 NLE HB3 H 3.251 -0.948 3.282 1.00 . A A . 4 NLE HB3 1 1
8 1102 1 1 2 NLE HD2 H 0.711 -0.841 5.176 1.00 . A A . 4 NLE HD2 1 1
8 1103 1 1 2 NLE HD3 H 2.290 -1.494 5.624 1.00 . A A . 4 NLE HD3 1 1
8 1104 1 1 2 NLE HE1 H 1.237 -3.768 6.072 1.00 . A A . 4 NLE HE1 1 1
8 1105 1 1 2 NLE HE2 H 0.463 -2.493 7.043 1.00 . A A . 4 NLE HE2 1 1
8 1106 1 1 2 NLE HE3 H -0.355 -3.122 5.596 1.00 . A A . 4 NLE HE3 1 1
8 1107 1 1 2 NLE HG2 H 2.111 -3.175 3.704 1.00 . A A . 4 NLE HG2 1 1
8 1108 1 1 2 NLE HG3 H 0.560 -2.471 3.254 1.00 . A A . 4 NLE HG3 1 1
8 1109 1 1 2 NLE N N 3.289 -2.735 1.207 1.00 . A A . 4 NLE N 1 1
8 1110 1 1 2 NLE O O 4.248 0.110 1.000 1.00 . A A . 4 NLE O 1 1
8 1111 1 1 3 ASP C C 2.175 2.776 -0.353 1.00 . A A . 5 ASP C 1 1
8 1112 1 1 3 ASP CA C 2.903 1.547 -1.009 1.00 . A A . 5 ASP CA 1 1
8 1113 1 1 3 ASP CB C 2.591 1.480 -2.523 1.00 . A A . 5 ASP CB 1 1
8 1114 1 1 3 ASP CG C 3.534 0.600 -3.351 1.00 . A A . 5 ASP CG 1 1
8 1115 1 1 3 ASP H H 1.559 -0.151 -0.583 1.00 . A A . 5 ASP H 1 1
8 1116 1 1 3 ASP HA H 4.000 1.656 -0.907 1.00 . A A . 5 ASP HA 1 1
8 1117 1 1 3 ASP HB2 H 1.533 1.208 -2.688 1.00 . A A . 5 ASP HB2 1 1
8 1118 1 1 3 ASP HB3 H 2.681 2.496 -2.941 1.00 . A A . 5 ASP HB3 1 1
8 1119 1 1 3 ASP N N 2.467 0.280 -0.362 1.00 . A A . 5 ASP N 1 1
8 1120 1 1 3 ASP O O 0.938 2.758 -0.300 1.00 . A A . 5 ASP O 1 1
8 1121 1 1 3 ASP OD1 O 4.637 1.032 -3.687 1.00 . A A . 5 ASP OD1 1 1
8 1122 1 1 4 PRO C C 1.326 5.939 -0.096 1.00 . A A . 6 PRO C 1 1
8 1123 1 1 4 PRO CA C 2.172 4.986 0.834 1.00 . A A . 6 PRO CA 1 1
8 1124 1 1 4 PRO CB C 3.366 5.689 1.511 1.00 . A A . 6 PRO CB 1 1
8 1125 1 1 4 PRO CD C 4.318 4.012 0.055 1.00 . A A . 6 PRO CD 1 1
8 1126 1 1 4 PRO CG C 4.563 5.421 0.594 1.00 . A A . 6 PRO CG 1 1
8 1127 1 1 4 PRO HA H 1.526 4.561 1.625 1.00 . A A . 6 PRO HA 1 1
8 1128 1 1 4 PRO HB2 H 3.200 6.770 1.686 1.00 . A A . 6 PRO HB2 1 1
8 1129 1 1 4 PRO HB3 H 3.551 5.239 2.506 1.00 . A A . 6 PRO HB3 1 1
8 1130 1 1 4 PRO HD2 H 4.691 3.908 -0.984 1.00 . A A . 6 PRO HD2 1 1
8 1131 1 1 4 PRO HD3 H 4.819 3.245 0.677 1.00 . A A . 6 PRO HD3 1 1
8 1132 1 1 4 PRO HG2 H 4.568 6.150 -0.241 1.00 . A A . 6 PRO HG2 1 1
8 1133 1 1 4 PRO HG3 H 5.535 5.516 1.115 1.00 . A A . 6 PRO HG3 1 1
8 1134 1 1 4 PRO N N 2.852 3.859 0.134 1.00 . A A . 6 PRO N 1 1
8 1135 1 1 4 PRO O O 1.747 6.177 -1.235 1.00 . A A . 6 PRO O 1 1
8 1136 1 1 5 PRO C C -1.171 5.109 2.150 1.00 . A A . 7 PRO C 1 1
8 1137 1 1 5 PRO CA C -0.411 6.407 1.700 1.00 . A A . 7 PRO CA 1 1
8 1138 1 1 5 PRO CB C -1.323 7.654 1.725 1.00 . A A . 7 PRO CB 1 1
8 1139 1 1 5 PRO CD C -0.605 7.435 -0.555 1.00 . A A . 7 PRO CD 1 1
8 1140 1 1 5 PRO CG C -1.818 7.821 0.287 1.00 . A A . 7 PRO CG 1 1
8 1141 1 1 5 PRO HA H 0.393 6.565 2.444 1.00 . A A . 7 PRO HA 1 1
8 1142 1 1 5 PRO HB2 H -2.153 7.584 2.454 1.00 . A A . 7 PRO HB2 1 1
8 1143 1 1 5 PRO HB3 H -0.734 8.545 2.023 1.00 . A A . 7 PRO HB3 1 1
8 1144 1 1 5 PRO HD2 H -0.896 6.968 -1.517 1.00 . A A . 7 PRO HD2 1 1
8 1145 1 1 5 PRO HD3 H 0.015 8.322 -0.793 1.00 . A A . 7 PRO HD3 1 1
8 1146 1 1 5 PRO HG2 H -2.660 7.129 0.089 1.00 . A A . 7 PRO HG2 1 1
8 1147 1 1 5 PRO HG3 H -2.179 8.845 0.073 1.00 . A A . 7 PRO HG3 1 1
8 1148 1 1 5 PRO N N 0.146 6.501 0.312 1.00 . A A . 7 PRO N 1 1
8 1149 1 1 5 PRO O O -1.610 5.045 3.301 1.00 . A A . 7 PRO O 1 1
8 1150 1 1 6 . C C -2.540 2.062 0.432 1.00 . A A . 8 DPN C 1 1
8 1151 1 1 6 . CA C -1.912 2.769 1.675 1.00 . A A . 8 DPN CA 1 1
8 1152 1 1 6 . CB C -0.870 1.883 2.433 1.00 . A A . 8 DPN CB 1 1
8 1153 1 1 6 . CD1 C -1.907 0.843 4.508 1.00 . A A . 8 DPN CD1 1 1
8 1154 1 1 6 . CD2 C -1.631 -0.550 2.554 1.00 . A A . 8 DPN CD2 1 1
8 1155 1 1 6 . CE1 C -2.493 -0.224 5.184 1.00 . A A . 8 DPN CE1 1 1
8 1156 1 1 6 . CE2 C -2.227 -1.613 3.228 1.00 . A A . 8 DPN CE2 1 1
8 1157 1 1 6 . CG C -1.475 0.688 3.187 1.00 . A A . 8 DPN CG 1 1
8 1158 1 1 6 . CZ C -2.656 -1.450 4.543 1.00 . A A . 8 DPN CZ 1 1
8 1159 1 1 6 . H H -0.790 4.214 0.417 1.00 . A A . 8 DPN H 1 1
8 1160 1 1 6 . HA H -2.757 2.968 2.365 1.00 . A A . 8 DPN HA 1 1
8 1161 1 1 6 . HB2 H -0.301 2.509 3.139 1.00 . A A . 8 DPN HB2 1 1
8 1162 1 1 6 . HB3 H -0.082 1.529 1.740 1.00 . A A . 8 DPN HB3 1 1
8 1163 1 1 6 . HD1 H -1.800 1.794 5.011 1.00 . A A . 8 DPN HD1 1 1
8 1164 1 1 6 . HD2 H -1.300 -0.690 1.535 1.00 . A A . 8 DPN HD2 1 1
8 1165 1 1 6 . HE1 H -2.825 -0.097 6.204 1.00 . A A . 8 DPN HE1 1 1
8 1166 1 1 6 . HE2 H -2.355 -2.563 2.734 1.00 . A A . 8 DPN HE2 1 1
8 1167 1 1 6 . HZ H -3.115 -2.277 5.067 1.00 . A A . 8 DPN HZ 1 1
8 1168 1 1 6 . N N -1.298 4.076 1.298 1.00 . A A . 8 DPN N 1 1
8 1169 1 1 6 . O O -3.760 1.887 0.363 1.00 . A A . 8 DPN O 1 1
8 1170 1 1 7 ARG C C -1.293 -0.664 -1.399 1.00 . A A . 9 ARG C 1 1
8 1171 1 1 7 ARG CA C -2.092 0.664 -1.586 1.00 . A A . 9 ARG CA 1 1
8 1172 1 1 7 ARG CB C -1.827 1.291 -2.981 1.00 . A A . 9 ARG CB 1 1
8 1173 1 1 7 ARG CD C -4.059 2.613 -3.229 1.00 . A A . 9 ARG CD 1 1
8 1174 1 1 7 ARG CG C -2.522 2.633 -3.335 1.00 . A A . 9 ARG CG 1 1
8 1175 1 1 7 ARG CZ C -5.847 4.365 -3.387 1.00 . A A . 9 ARG CZ 1 1
8 1176 1 1 7 ARG H H -0.714 1.874 -0.358 1.00 . A A . 9 ARG H 1 1
8 1177 1 1 7 ARG HA H -3.176 0.439 -1.522 1.00 . A A . 9 ARG HA 1 1
8 1178 1 1 7 ARG HB2 H -0.736 1.422 -3.098 1.00 . A A . 9 ARG HB2 1 1
8 1179 1 1 7 ARG HB3 H -2.095 0.537 -3.742 1.00 . A A . 9 ARG HB3 1 1
8 1180 1 1 7 ARG HD2 H -4.477 1.811 -3.871 1.00 . A A . 9 ARG HD2 1 1
8 1181 1 1 7 ARG HD3 H -4.343 2.365 -2.185 1.00 . A A . 9 ARG HD3 1 1
8 1182 1 1 7 ARG HE H -4.020 4.613 -4.128 1.00 . A A . 9 ARG HE 1 1
8 1183 1 1 7 ARG HG2 H -2.115 3.427 -2.677 1.00 . A A . 9 ARG HG2 1 1
8 1184 1 1 7 ARG HG3 H -2.216 2.923 -4.359 1.00 . A A . 9 ARG HG3 1 1
8 1185 1 1 7 ARG HH11 H -6.420 2.740 -2.447 1.00 . A A . 9 ARG HH11 1 1
8 1186 1 1 7 ARG HH12 H -7.676 4.060 -2.606 1.00 . A A . 9 ARG HH12 1 1
8 1187 1 1 7 ARG HH21 H -5.467 6.091 -4.296 1.00 . A A . 9 ARG HH21 1 1
8 1188 1 1 7 ARG HH22 H -7.137 5.861 -3.611 1.00 . A A . 9 ARG HH22 1 1
8 1189 1 1 7 ARG N N -1.699 1.614 -0.516 1.00 . A A . 9 ARG N 1 1
8 1190 1 1 7 ARG NE N -4.606 3.940 -3.627 1.00 . A A . 9 ARG NE 1 1
8 1191 1 1 7 ARG NH1 N -6.749 3.656 -2.755 1.00 . A A . 9 ARG NH1 1 1
8 1192 1 1 7 ARG NH2 N -6.181 5.553 -3.802 1.00 . A A . 9 ARG NH2 1 1
8 1193 1 1 7 ARG O O -0.066 -0.667 -1.245 1.00 . A A . 9 ARG O 1 1
8 1194 1 1 8 TRP C C -0.880 -3.800 -2.459 1.00 . A A . 10 TRP C 1 1
8 1195 1 1 8 TRP CA C -1.401 -3.131 -1.145 1.00 . A A . 10 TRP CA 1 1
8 1196 1 1 8 TRP CB C -2.487 -3.958 -0.412 1.00 . A A . 10 TRP CB 1 1
8 1197 1 1 8 TRP CD1 C -2.503 -6.539 -0.675 1.00 . A A . 10 TRP CD1 1 1
8 1198 1 1 8 TRP CD2 C -1.248 -5.805 1.004 1.00 . A A . 10 TRP CD2 1 1
8 1199 1 1 8 TRP CE2 C -1.159 -7.217 0.931 1.00 . A A . 10 TRP CE2 1 1
8 1200 1 1 8 TRP CE3 C -0.522 -5.088 1.985 1.00 . A A . 10 TRP CE3 1 1
8 1201 1 1 8 TRP CG C -2.086 -5.378 -0.005 1.00 . A A . 10 TRP CG 1 1
8 1202 1 1 8 TRP CH2 C 0.373 -7.201 2.803 1.00 . A A . 10 TRP CH2 1 1
8 1203 1 1 8 TRP CZ2 C -0.337 -7.923 1.840 1.00 . A A . 10 TRP CZ2 1 1
8 1204 1 1 8 TRP CZ3 C 0.281 -5.805 2.874 1.00 . A A . 10 TRP CZ3 1 1
8 1205 1 1 8 TRP H H -2.961 -1.714 -1.743 1.00 . A A . 10 TRP H 1 1
8 1206 1 1 8 TRP HA H -0.558 -3.012 -0.431 1.00 . A A . 10 TRP HA 1 1
8 1207 1 1 8 TRP HB2 H -2.802 -3.428 0.504 1.00 . A A . 10 TRP HB2 1 1
8 1208 1 1 8 TRP HB3 H -3.392 -4.014 -1.042 1.00 . A A . 10 TRP HB3 1 1
8 1209 1 1 8 TRP HD1 H -3.153 -6.505 -1.537 1.00 . A A . 10 TRP HD1 1 1
8 1210 1 1 8 TRP HE1 H -2.088 -8.681 -0.380 1.00 . A A . 10 TRP HE1 1 1
8 1211 1 1 8 TRP HE3 H -0.577 -4.012 2.024 1.00 . A A . 10 TRP HE3 1 1
8 1212 1 1 8 TRP HH2 H 1.005 -7.728 3.503 1.00 . A A . 10 TRP HH2 1 1
8 1213 1 1 8 TRP HZ2 H -0.259 -8.999 1.789 1.00 . A A . 10 TRP HZ2 1 1
8 1214 1 1 8 TRP HZ3 H 0.844 -5.274 3.628 1.00 . A A . 10 TRP HZ3 1 1
8 1215 1 1 8 TRP N N -2.003 -1.799 -1.398 1.00 . A A . 10 TRP N 1 1
8 1216 1 1 8 TRP NE1 N -1.937 -7.702 -0.110 1.00 . A A . 10 TRP NE1 1 1
8 1217 1 1 8 TRP O O -1.531 -3.782 -3.508 1.00 . A A . 10 TRP O 1 1
8 1218 1 1 9 LYS C C 0.443 -6.563 -3.782 1.00 . A A . 11 LYS C 1 1
8 1219 1 1 9 LYS CA C 0.968 -5.120 -3.484 1.00 . A A . 11 LYS CA 1 1
8 1220 1 1 9 LYS CB C 2.505 -5.109 -3.236 1.00 . A A . 11 LYS CB 1 1
8 1221 1 1 9 LYS CD C 3.227 -2.956 -4.512 1.00 . A A . 11 LYS CD 1 1
8 1222 1 1 9 LYS CE C 3.910 -1.577 -4.437 1.00 . A A . 11 LYS CE 1 1
8 1223 1 1 9 LYS CG C 3.217 -3.736 -3.177 1.00 . A A . 11 LYS CG 1 1
8 1224 1 1 9 LYS H H 0.748 -4.288 -1.431 1.00 . A A . 11 LYS H 1 1
8 1225 1 1 9 LYS HA H 0.780 -4.548 -4.414 1.00 . A A . 11 LYS HA 1 1
8 1226 1 1 9 LYS HB2 H 2.719 -5.649 -2.292 1.00 . A A . 11 LYS HB2 1 1
8 1227 1 1 9 LYS HB3 H 3.001 -5.717 -4.014 1.00 . A A . 11 LYS HB3 1 1
8 1228 1 1 9 LYS HD2 H 3.748 -3.565 -5.275 1.00 . A A . 11 LYS HD2 1 1
8 1229 1 1 9 LYS HD3 H 2.198 -2.833 -4.902 1.00 . A A . 11 LYS HD3 1 1
8 1230 1 1 9 LYS HE2 H 4.923 -1.672 -3.995 1.00 . A A . 11 LYS HE2 1 1
8 1231 1 1 9 LYS HE3 H 4.069 -1.186 -5.462 1.00 . A A . 11 LYS HE3 1 1
8 1232 1 1 9 LYS HG2 H 2.761 -3.118 -2.379 1.00 . A A . 11 LYS HG2 1 1
8 1233 1 1 9 LYS HG3 H 4.262 -3.893 -2.844 1.00 . A A . 11 LYS HG3 1 1
8 1234 1 1 9 LYS HZ1 H 2.187 -0.864 -3.253 1.00 . A A . 11 LYS HZ1 1 1
8 1235 1 1 9 LYS N N 0.294 -4.428 -2.348 1.00 . A A . 11 LYS N 1 1
8 1236 1 1 9 LYS NZ N 3.089 -0.616 -3.670 1.00 . A A . 11 LYS NZ 1 1
8 1237 1 1 9 LYS O O 0.176 -6.915 -4.927 1.00 . A A . 11 LYS O 1 1
8 1238 1 1 10 NH2 HN1 H 0.317 -7.111 -1.866 1.00 . A A . 12 NH2 HN1 1 1
8 1239 1 1 10 NH2 HN2 H -0.125 -8.337 -3.164 1.00 . A A . 12 NH2 HN2 1 1
8 1240 1 1 10 NH2 N N 0.295 -7.465 -2.828 1.00 . A A . 12 NH2 N 1 1
9 1241 1 1 1 ACE C C 2.719 -3.755 0.126 1.00 . A A . 3 ACE C 1 1
9 1242 1 1 1 ACE CH3 C 3.379 -5.119 0.097 1.00 . A A . 3 ACE CH3 1 1
9 1243 1 1 1 ACE H1 H 2.837 -5.837 0.739 1.00 . A A . 3 ACE H1 1 1
9 1244 1 1 1 ACE H2 H 3.378 -5.528 -0.928 1.00 . A A . 3 ACE H2 1 1
9 1245 1 1 1 ACE H3 H 4.432 -5.073 0.432 1.00 . A A . 3 ACE H3 1 1
9 1246 1 1 1 ACE O O 2.141 -3.313 -0.865 1.00 . A A . 3 ACE O 1 1
9 1247 1 1 2 NLE C C 2.996 -0.577 0.932 1.00 . A A . 4 NLE C 1 1
9 1248 1 1 2 NLE CA C 2.167 -1.771 1.497 1.00 . A A . 4 NLE CA 1 1
9 1249 1 1 2 NLE CB C 1.805 -1.601 2.992 1.00 . A A . 4 NLE CB 1 1
9 1250 1 1 2 NLE CD C 2.405 -1.535 5.504 1.00 . A A . 4 NLE CD 1 1
9 1251 1 1 2 NLE CE C 1.937 -0.121 5.880 1.00 . A A . 4 NLE CE 1 1
9 1252 1 1 2 NLE CG C 2.927 -1.666 4.061 1.00 . A A . 4 NLE CG 1 1
9 1253 1 1 2 NLE H H 3.273 -3.588 2.038 1.00 . A A . 4 NLE H 1 1
9 1254 1 1 2 NLE HA H 1.183 -1.786 0.982 1.00 . A A . 4 NLE HA 1 1
9 1255 1 1 2 NLE HB2 H 1.029 -2.346 3.232 1.00 . A A . 4 NLE HB2 1 1
9 1256 1 1 2 NLE HB3 H 1.291 -0.633 3.098 1.00 . A A . 4 NLE HB3 1 1
9 1257 1 1 2 NLE HD2 H 3.212 -1.835 6.197 1.00 . A A . 4 NLE HD2 1 1
9 1258 1 1 2 NLE HD3 H 1.586 -2.260 5.676 1.00 . A A . 4 NLE HD3 1 1
9 1259 1 1 2 NLE HE1 H 2.741 0.627 5.746 1.00 . A A . 4 NLE HE1 1 1
9 1260 1 1 2 NLE HE2 H 1.075 0.206 5.272 1.00 . A A . 4 NLE HE2 1 1
9 1261 1 1 2 NLE HE3 H 1.618 -0.072 6.938 1.00 . A A . 4 NLE HE3 1 1
9 1262 1 1 2 NLE HG2 H 3.692 -0.890 3.867 1.00 . A A . 4 NLE HG2 1 1
9 1263 1 1 2 NLE HG3 H 3.466 -2.627 3.971 1.00 . A A . 4 NLE HG3 1 1
9 1264 1 1 2 NLE N N 2.800 -3.095 1.280 1.00 . A A . 4 NLE N 1 1
9 1265 1 1 2 NLE O O 4.093 -0.265 1.406 1.00 . A A . 4 NLE O 1 1
9 1266 1 1 3 ASP C C 2.270 2.629 -0.264 1.00 . A A . 5 ASP C 1 1
9 1267 1 1 3 ASP CA C 3.025 1.311 -0.691 1.00 . A A . 5 ASP CA 1 1
9 1268 1 1 3 ASP CB C 3.166 1.064 -2.215 1.00 . A A . 5 ASP CB 1 1
9 1269 1 1 3 ASP CG C 1.921 1.017 -3.122 1.00 . A A . 5 ASP CG 1 1
9 1270 1 1 3 ASP H H 1.549 -0.302 -0.421 1.00 . A A . 5 ASP H 1 1
9 1271 1 1 3 ASP HA H 4.068 1.399 -0.332 1.00 . A A . 5 ASP HA 1 1
9 1272 1 1 3 ASP HB2 H 3.786 1.878 -2.614 1.00 . A A . 5 ASP HB2 1 1
9 1273 1 1 3 ASP HB3 H 3.784 0.156 -2.357 1.00 . A A . 5 ASP HB3 1 1
9 1274 1 1 3 ASP N N 2.433 0.097 -0.078 1.00 . A A . 5 ASP N 1 1
9 1275 1 1 3 ASP O O 1.032 2.614 -0.232 1.00 . A A . 5 ASP O 1 1
9 1276 1 1 3 ASP OD1 O 1.125 1.956 -3.141 1.00 . A A . 5 ASP OD1 1 1
9 1277 1 1 4 PRO C C 1.399 5.796 -0.452 1.00 . A A . 6 PRO C 1 1
9 1278 1 1 4 PRO CA C 2.241 4.985 0.606 1.00 . A A . 6 PRO CA 1 1
9 1279 1 1 4 PRO CB C 3.413 5.793 1.199 1.00 . A A . 6 PRO CB 1 1
9 1280 1 1 4 PRO CD C 4.408 3.916 0.065 1.00 . A A . 6 PRO CD 1 1
9 1281 1 1 4 PRO CG C 4.632 5.398 0.362 1.00 . A A . 6 PRO CG 1 1
9 1282 1 1 4 PRO HA H 1.586 4.667 1.438 1.00 . A A . 6 PRO HA 1 1
9 1283 1 1 4 PRO HB2 H 3.239 6.886 1.203 1.00 . A A . 6 PRO HB2 1 1
9 1284 1 1 4 PRO HB3 H 3.574 5.502 2.256 1.00 . A A . 6 PRO HB3 1 1
9 1285 1 1 4 PRO HD2 H 4.853 3.632 -0.909 1.00 . A A . 6 PRO HD2 1 1
9 1286 1 1 4 PRO HD3 H 4.870 3.284 0.851 1.00 . A A . 6 PRO HD3 1 1
9 1287 1 1 4 PRO HG2 H 4.646 5.977 -0.583 1.00 . A A . 6 PRO HG2 1 1
9 1288 1 1 4 PRO HG3 H 5.590 5.592 0.878 1.00 . A A . 6 PRO HG3 1 1
9 1289 1 1 4 PRO N N 2.937 3.774 0.082 1.00 . A A . 6 PRO N 1 1
9 1290 1 1 4 PRO O O 1.824 5.872 -1.612 1.00 . A A . 6 PRO O 1 1
9 1291 1 1 5 PRO C C -1.053 5.315 1.928 1.00 . A A . 7 PRO C 1 1
9 1292 1 1 5 PRO CA C -0.323 6.538 1.265 1.00 . A A . 7 PRO CA 1 1
9 1293 1 1 5 PRO CB C -1.257 7.757 1.103 1.00 . A A . 7 PRO CB 1 1
9 1294 1 1 5 PRO CD C -0.539 7.198 -1.122 1.00 . A A . 7 PRO CD 1 1
9 1295 1 1 5 PRO CG C -1.757 7.691 -0.342 1.00 . A A . 7 PRO CG 1 1
9 1296 1 1 5 PRO HA H 0.486 6.826 1.965 1.00 . A A . 7 PRO HA 1 1
9 1297 1 1 5 PRO HB2 H -2.086 7.783 1.836 1.00 . A A . 7 PRO HB2 1 1
9 1298 1 1 5 PRO HB3 H -0.686 8.693 1.259 1.00 . A A . 7 PRO HB3 1 1
9 1299 1 1 5 PRO HD2 H -0.828 6.588 -1.999 1.00 . A A . 7 PRO HD2 1 1
9 1300 1 1 5 PRO HD3 H 0.068 8.047 -1.494 1.00 . A A . 7 PRO HD3 1 1
9 1301 1 1 5 PRO HG2 H -2.588 6.964 -0.428 1.00 . A A . 7 PRO HG2 1 1
9 1302 1 1 5 PRO HG3 H -2.134 8.663 -0.711 1.00 . A A . 7 PRO HG3 1 1
9 1303 1 1 5 PRO N N 0.223 6.417 -0.125 1.00 . A A . 7 PRO N 1 1
9 1304 1 1 5 PRO O O -1.413 5.404 3.105 1.00 . A A . 7 PRO O 1 1
9 1305 1 1 6 . C C -2.592 2.149 0.666 1.00 . A A . 8 DPN C 1 1
9 1306 1 1 6 . CA C -1.860 2.955 1.784 1.00 . A A . 8 DPN CA 1 1
9 1307 1 1 6 . CB C -0.790 2.120 2.558 1.00 . A A . 8 DPN CB 1 1
9 1308 1 1 6 . CD1 C -1.490 -0.313 2.868 1.00 . A A . 8 DPN CD1 1 1
9 1309 1 1 6 . CD2 C -1.686 1.187 4.751 1.00 . A A . 8 DPN CD2 1 1
9 1310 1 1 6 . CE1 C -1.967 -1.361 3.652 1.00 . A A . 8 DPN CE1 1 1
9 1311 1 1 6 . CE2 C -2.162 0.136 5.535 1.00 . A A . 8 DPN CE2 1 1
9 1312 1 1 6 . CG C -1.343 0.968 3.413 1.00 . A A . 8 DPN CG 1 1
9 1313 1 1 6 . CZ C -2.299 -1.136 4.985 1.00 . A A . 8 DPN CZ 1 1
9 1314 1 1 6 . H H -0.803 4.215 0.292 1.00 . A A . 8 DPN H 1 1
9 1315 1 1 6 . HA H -2.647 3.251 2.507 1.00 . A A . 8 DPN HA 1 1
9 1316 1 1 6 . HB2 H -0.197 2.796 3.195 1.00 . A A . 8 DPN HB2 1 1
9 1317 1 1 6 . HB3 H -0.029 1.725 1.859 1.00 . A A . 8 DPN HB3 1 1
9 1318 1 1 6 . HD1 H -1.225 -0.502 1.839 1.00 . A A . 8 DPN HD1 1 1
9 1319 1 1 6 . HD2 H -1.581 2.169 5.189 1.00 . A A . 8 DPN HD2 1 1
9 1320 1 1 6 . HE1 H -2.076 -2.348 3.226 1.00 . A A . 8 DPN HE1 1 1
9 1321 1 1 6 . HE2 H -2.421 0.310 6.569 1.00 . A A . 8 DPN HE2 1 1
9 1322 1 1 6 . HZ H -2.668 -1.949 5.593 1.00 . A A . 8 DPN HZ 1 1
9 1323 1 1 6 . N N -1.239 4.189 1.222 1.00 . A A . 8 DPN N 1 1
9 1324 1 1 6 . O O -3.818 2.013 0.703 1.00 . A A . 8 DPN O 1 1
9 1325 1 1 7 ARG C C -1.453 -0.760 -1.060 1.00 . A A . 9 ARG C 1 1
9 1326 1 1 7 ARG CA C -2.342 0.514 -1.198 1.00 . A A . 9 ARG CA 1 1
9 1327 1 1 7 ARG CB C -2.394 1.076 -2.638 1.00 . A A . 9 ARG CB 1 1
9 1328 1 1 7 ARG CD C -3.214 0.808 -5.091 1.00 . A A . 9 ARG CD 1 1
9 1329 1 1 7 ARG CG C -3.094 0.174 -3.691 1.00 . A A . 9 ARG CG 1 1
9 1330 1 1 7 ARG CZ C -4.544 2.656 -6.149 1.00 . A A . 9 ARG CZ 1 1
9 1331 1 1 7 ARG H H -0.830 1.769 -0.168 1.00 . A A . 9 ARG H 1 1
9 1332 1 1 7 ARG HA H -3.383 0.250 -0.914 1.00 . A A . 9 ARG HA 1 1
9 1333 1 1 7 ARG HB2 H -2.928 2.041 -2.600 1.00 . A A . 9 ARG HB2 1 1
9 1334 1 1 7 ARG HB3 H -1.366 1.312 -2.968 1.00 . A A . 9 ARG HB3 1 1
9 1335 1 1 7 ARG HD2 H -2.225 1.192 -5.415 1.00 . A A . 9 ARG HD2 1 1
9 1336 1 1 7 ARG HD3 H -3.488 0.015 -5.818 1.00 . A A . 9 ARG HD3 1 1
9 1337 1 1 7 ARG HE H -4.769 2.105 -4.253 1.00 . A A . 9 ARG HE 1 1
9 1338 1 1 7 ARG HG2 H -2.522 -0.770 -3.787 1.00 . A A . 9 ARG HG2 1 1
9 1339 1 1 7 ARG HG3 H -4.092 -0.142 -3.329 1.00 . A A . 9 ARG HG3 1 1
9 1340 1 1 7 ARG HH11 H -3.273 1.799 -7.376 1.00 . A A . 9 ARG HH11 1 1
9 1341 1 1 7 ARG HH12 H -4.263 3.171 -8.073 1.00 . A A . 9 ARG HH12 1 1
9 1342 1 1 7 ARG HH21 H -5.885 3.651 -5.075 1.00 . A A . 9 ARG HH21 1 1
9 1343 1 1 7 ARG HH22 H -5.670 4.156 -6.810 1.00 . A A . 9 ARG HH22 1 1
9 1344 1 1 7 ARG N N -1.837 1.573 -0.286 1.00 . A A . 9 ARG N 1 1
9 1345 1 1 7 ARG NE N -4.243 1.886 -5.104 1.00 . A A . 9 ARG NE 1 1
9 1346 1 1 7 ARG NH1 N -3.975 2.539 -7.324 1.00 . A A . 9 ARG NH1 1 1
9 1347 1 1 7 ARG NH2 N -5.453 3.575 -5.997 1.00 . A A . 9 ARG NH2 1 1
9 1348 1 1 7 ARG O O -0.223 -0.703 -0.960 1.00 . A A . 9 ARG O 1 1
9 1349 1 1 8 TRP C C -1.177 -3.869 -2.329 1.00 . A A . 10 TRP C 1 1
9 1350 1 1 8 TRP CA C -1.438 -3.237 -0.927 1.00 . A A . 10 TRP CA 1 1
9 1351 1 1 8 TRP CB C -2.315 -4.121 -0.013 1.00 . A A . 10 TRP CB 1 1
9 1352 1 1 8 TRP CD1 C -1.964 -6.667 -0.364 1.00 . A A . 10 TRP CD1 1 1
9 1353 1 1 8 TRP CD2 C -0.765 -5.798 1.289 1.00 . A A . 10 TRP CD2 1 1
9 1354 1 1 8 TRP CE2 C -0.466 -7.177 1.165 1.00 . A A . 10 TRP CE2 1 1
9 1355 1 1 8 TRP CE3 C -0.116 -5.003 2.263 1.00 . A A . 10 TRP CE3 1 1
9 1356 1 1 8 TRP CG C -1.703 -5.478 0.331 1.00 . A A . 10 TRP CG 1 1
9 1357 1 1 8 TRP CH2 C 1.113 -6.977 2.988 1.00 . A A . 10 TRP CH2 1 1
9 1358 1 1 8 TRP CZ2 C 0.487 -7.773 2.024 1.00 . A A . 10 TRP CZ2 1 1
9 1359 1 1 8 TRP CZ3 C 0.815 -5.613 3.105 1.00 . A A . 10 TRP CZ3 1 1
9 1360 1 1 8 TRP H H -3.093 -1.844 -1.344 1.00 . A A . 10 TRP H 1 1
9 1361 1 1 8 TRP HA H -0.477 -3.099 -0.386 1.00 . A A . 10 TRP HA 1 1
9 1362 1 1 8 TRP HB2 H -2.513 -3.590 0.931 1.00 . A A . 10 TRP HB2 1 1
9 1363 1 1 8 TRP HB3 H -3.300 -4.273 -0.486 1.00 . A A . 10 TRP HB3 1 1
9 1364 1 1 8 TRP HD1 H -2.645 -6.698 -1.203 1.00 . A A . 10 TRP HD1 1 1
9 1365 1 1 8 TRP HE1 H -1.200 -8.724 -0.173 1.00 . A A . 10 TRP HE1 1 1
9 1366 1 1 8 TRP HE3 H -0.333 -3.948 2.333 1.00 . A A . 10 TRP HE3 1 1
9 1367 1 1 8 TRP HH2 H 1.841 -7.421 3.652 1.00 . A A . 10 TRP HH2 1 1
9 1368 1 1 8 TRP HZ2 H 0.725 -8.823 1.937 1.00 . A A . 10 TRP HZ2 1 1
9 1369 1 1 8 TRP HZ3 H 1.320 -5.020 3.855 1.00 . A A . 10 TRP HZ3 1 1
9 1370 1 1 8 TRP N N -2.115 -1.923 -1.056 1.00 . A A . 10 TRP N 1 1
9 1371 1 1 8 TRP NE1 N -1.204 -7.745 0.135 1.00 . A A . 10 TRP NE1 1 1
9 1372 1 1 8 TRP O O -2.080 -4.044 -3.154 1.00 . A A . 10 TRP O 1 1
9 1373 1 1 9 LYS C C 1.561 -5.936 -3.571 1.00 . A A . 11 LYS C 1 1
9 1374 1 1 9 LYS CA C 0.601 -4.738 -3.842 1.00 . A A . 11 LYS CA 1 1
9 1375 1 1 9 LYS CB C 1.280 -3.551 -4.587 1.00 . A A . 11 LYS CB 1 1
9 1376 1 1 9 LYS CD C 0.918 -1.336 -5.911 1.00 . A A . 11 LYS CD 1 1
9 1377 1 1 9 LYS CE C 0.821 -0.074 -5.031 1.00 . A A . 11 LYS CE 1 1
9 1378 1 1 9 LYS CG C 0.289 -2.613 -5.309 1.00 . A A . 11 LYS CG 1 1
9 1379 1 1 9 LYS H H 0.727 -3.884 -1.811 1.00 . A A . 11 LYS H 1 1
9 1380 1 1 9 LYS HA H -0.225 -5.123 -4.476 1.00 . A A . 11 LYS HA 1 1
9 1381 1 1 9 LYS HB2 H 1.916 -2.976 -3.886 1.00 . A A . 11 LYS HB2 1 1
9 1382 1 1 9 LYS HB3 H 1.983 -3.946 -5.340 1.00 . A A . 11 LYS HB3 1 1
9 1383 1 1 9 LYS HD2 H 1.959 -1.514 -6.243 1.00 . A A . 11 LYS HD2 1 1
9 1384 1 1 9 LYS HD3 H 0.375 -1.114 -6.850 1.00 . A A . 11 LYS HD3 1 1
9 1385 1 1 9 LYS HE2 H 0.957 0.819 -5.675 1.00 . A A . 11 LYS HE2 1 1
9 1386 1 1 9 LYS HE3 H -0.198 0.024 -4.613 1.00 . A A . 11 LYS HE3 1 1
9 1387 1 1 9 LYS HG2 H -0.196 -3.198 -6.112 1.00 . A A . 11 LYS HG2 1 1
9 1388 1 1 9 LYS HG3 H -0.539 -2.338 -4.627 1.00 . A A . 11 LYS HG3 1 1
9 1389 1 1 9 LYS HZ1 H 2.525 -0.762 -3.806 1.00 . A A . 11 LYS HZ1 1 1
9 1390 1 1 9 LYS N N 0.088 -4.220 -2.549 1.00 . A A . 11 LYS N 1 1
9 1391 1 1 9 LYS NZ N 1.820 -0.033 -3.944 1.00 . A A . 11 LYS NZ 1 1
9 1392 1 1 9 LYS O O 2.783 -5.820 -3.505 1.00 . A A . 11 LYS O 1 1
9 1393 1 1 10 NH2 HN1 H 0.045 -7.214 -3.288 1.00 . A A . 12 NH2 HN1 1 1
9 1394 1 1 10 NH2 HN2 H 1.768 -7.847 -3.163 1.00 . A A . 12 NH2 HN2 1 1
9 1395 1 1 10 NH2 N N 1.060 -7.146 -3.401 1.00 . A A . 12 NH2 N 1 1
10 1396 1 1 1 ACE C C 2.972 -3.799 -0.398 1.00 . A A . 3 ACE C 1 1
10 1397 1 1 1 ACE CH3 C 3.778 -5.022 -0.789 1.00 . A A . 3 ACE CH3 1 1
10 1398 1 1 1 ACE H1 H 4.864 -4.850 -0.673 1.00 . A A . 3 ACE H1 1 1
10 1399 1 1 1 ACE H2 H 3.493 -5.898 -0.180 1.00 . A A . 3 ACE H2 1 1
10 1400 1 1 1 ACE H3 H 3.597 -5.283 -1.847 1.00 . A A . 3 ACE H3 1 1
10 1401 1 1 1 ACE O O 2.170 -3.298 -1.186 1.00 . A A . 3 ACE O 1 1
10 1402 1 1 2 NLE C C 3.226 -0.821 1.068 1.00 . A A . 4 NLE C 1 1
10 1403 1 1 2 NLE CA C 2.471 -2.148 1.378 1.00 . A A . 4 NLE CA 1 1
10 1404 1 1 2 NLE CB C 2.268 -2.337 2.899 1.00 . A A . 4 NLE CB 1 1
10 1405 1 1 2 NLE CD C 1.048 -1.586 5.064 1.00 . A A . 4 NLE CD 1 1
10 1406 1 1 2 NLE CE C 2.241 -1.165 5.934 1.00 . A A . 4 NLE CE 1 1
10 1407 1 1 2 NLE CG C 1.259 -1.363 3.554 1.00 . A A . 4 NLE CG 1 1
10 1408 1 1 2 NLE H H 3.947 -3.800 1.334 1.00 . A A . 4 NLE H 1 1
10 1409 1 1 2 NLE HA H 1.456 -2.125 0.929 1.00 . A A . 4 NLE HA 1 1
10 1410 1 1 2 NLE HB2 H 3.247 -2.257 3.400 1.00 . A A . 4 NLE HB2 1 1
10 1411 1 1 2 NLE HB3 H 1.912 -3.363 3.087 1.00 . A A . 4 NLE HB3 1 1
10 1412 1 1 2 NLE HD2 H 0.787 -2.644 5.263 1.00 . A A . 4 NLE HD2 1 1
10 1413 1 1 2 NLE HD3 H 0.162 -1.008 5.390 1.00 . A A . 4 NLE HD3 1 1
10 1414 1 1 2 NLE HE1 H 3.146 -1.762 5.718 1.00 . A A . 4 NLE HE1 1 1
10 1415 1 1 2 NLE HE2 H 2.504 -0.101 5.783 1.00 . A A . 4 NLE HE2 1 1
10 1416 1 1 2 NLE HE3 H 2.019 -1.293 7.010 1.00 . A A . 4 NLE HE3 1 1
10 1417 1 1 2 NLE HG2 H 0.283 -1.469 3.044 1.00 . A A . 4 NLE HG2 1 1
10 1418 1 1 2 NLE HG3 H 1.560 -0.311 3.377 1.00 . A A . 4 NLE HG3 1 1
10 1419 1 1 2 NLE N N 3.189 -3.332 0.831 1.00 . A A . 4 NLE N 1 1
10 1420 1 1 2 NLE O O 4.411 -0.656 1.380 1.00 . A A . 4 NLE O 1 1
10 1421 1 1 3 ASP C C 2.238 2.673 0.315 1.00 . A A . 5 ASP C 1 1
10 1422 1 1 3 ASP CA C 3.074 1.392 -0.055 1.00 . A A . 5 ASP CA 1 1
10 1423 1 1 3 ASP CB C 3.305 1.231 -1.581 1.00 . A A . 5 ASP CB 1 1
10 1424 1 1 3 ASP CG C 2.114 0.970 -2.526 1.00 . A A . 5 ASP CG 1 1
10 1425 1 1 3 ASP H H 1.605 -0.240 0.117 1.00 . A A . 5 ASP H 1 1
10 1426 1 1 3 ASP HA H 4.084 1.519 0.374 1.00 . A A . 5 ASP HA 1 1
10 1427 1 1 3 ASP HB2 H 3.774 2.156 -1.940 1.00 . A A . 5 ASP HB2 1 1
10 1428 1 1 3 ASP HB3 H 4.085 0.458 -1.725 1.00 . A A . 5 ASP HB3 1 1
10 1429 1 1 3 ASP N N 2.502 0.123 0.462 1.00 . A A . 5 ASP N 1 1
10 1430 1 1 3 ASP O O 1.007 2.628 0.216 1.00 . A A . 5 ASP O 1 1
10 1431 1 1 3 ASP OD1 O 1.278 1.848 -2.741 1.00 . A A . 5 ASP OD1 1 1
10 1432 1 1 4 PRO C C 1.444 5.607 -0.659 1.00 . A A . 6 PRO C 1 1
10 1433 1 1 4 PRO CA C 2.111 5.161 0.701 1.00 . A A . 6 PRO CA 1 1
10 1434 1 1 4 PRO CB C 3.220 6.146 1.131 1.00 . A A . 6 PRO CB 1 1
10 1435 1 1 4 PRO CD C 4.240 3.970 1.118 1.00 . A A . 6 PRO CD 1 1
10 1436 1 1 4 PRO CG C 4.249 5.297 1.874 1.00 . A A . 6 PRO CG 1 1
10 1437 1 1 4 PRO HA H 1.374 5.105 1.521 1.00 . A A . 6 PRO HA 1 1
10 1438 1 1 4 PRO HB2 H 3.707 6.614 0.252 1.00 . A A . 6 PRO HB2 1 1
10 1439 1 1 4 PRO HB3 H 2.829 6.975 1.751 1.00 . A A . 6 PRO HB3 1 1
10 1440 1 1 4 PRO HD2 H 4.921 3.997 0.244 1.00 . A A . 6 PRO HD2 1 1
10 1441 1 1 4 PRO HD3 H 4.561 3.145 1.783 1.00 . A A . 6 PRO HD3 1 1
10 1442 1 1 4 PRO HG2 H 5.251 5.763 1.901 1.00 . A A . 6 PRO HG2 1 1
10 1443 1 1 4 PRO HG3 H 3.934 5.143 2.926 1.00 . A A . 6 PRO HG3 1 1
10 1444 1 1 4 PRO N N 2.835 3.854 0.676 1.00 . A A . 6 PRO N 1 1
10 1445 1 1 4 PRO O O 2.109 5.452 -1.691 1.00 . A A . 6 PRO O 1 1
10 1446 1 1 5 PRO C C -1.669 5.424 0.878 1.00 . A A . 7 PRO C 1 1
10 1447 1 1 5 PRO CA C -0.662 6.537 0.415 1.00 . A A . 7 PRO CA 1 1
10 1448 1 1 5 PRO CB C -1.330 7.816 -0.139 1.00 . A A . 7 PRO CB 1 1
10 1449 1 1 5 PRO CD C -0.293 6.734 -2.025 1.00 . A A . 7 PRO CD 1 1
10 1450 1 1 5 PRO CG C -1.521 7.554 -1.635 1.00 . A A . 7 PRO CG 1 1
10 1451 1 1 5 PRO HA H -0.060 6.840 1.293 1.00 . A A . 7 PRO HA 1 1
10 1452 1 1 5 PRO HB2 H -2.277 8.073 0.373 1.00 . A A . 7 PRO HB2 1 1
10 1453 1 1 5 PRO HB3 H -0.659 8.686 0.007 1.00 . A A . 7 PRO HB3 1 1
10 1454 1 1 5 PRO HD2 H -0.534 5.939 -2.758 1.00 . A A . 7 PRO HD2 1 1
10 1455 1 1 5 PRO HD3 H 0.481 7.379 -2.483 1.00 . A A . 7 PRO HD3 1 1
10 1456 1 1 5 PRO HG2 H -2.440 6.965 -1.807 1.00 . A A . 7 PRO HG2 1 1
10 1457 1 1 5 PRO HG3 H -1.616 8.487 -2.224 1.00 . A A . 7 PRO HG3 1 1
10 1458 1 1 5 PRO N N 0.197 6.168 -0.748 1.00 . A A . 7 PRO N 1 1
10 1459 1 1 5 PRO O O -2.894 5.535 0.743 1.00 . A A . 7 PRO O 1 1
10 1460 1 1 6 . C C -2.549 2.311 0.957 1.00 . A A . 8 DPN C 1 1
10 1461 1 1 6 . CA C -1.912 3.232 2.043 1.00 . A A . 8 DPN CA 1 1
10 1462 1 1 6 . CB C -0.968 2.490 3.041 1.00 . A A . 8 DPN CB 1 1
10 1463 1 1 6 . CD1 C -1.974 1.991 5.323 1.00 . A A . 8 DPN CD1 1 1
10 1464 1 1 6 . CD2 C -2.028 0.252 3.648 1.00 . A A . 8 DPN CD2 1 1
10 1465 1 1 6 . CE1 C -2.610 1.141 6.224 1.00 . A A . 8 DPN CE1 1 1
10 1466 1 1 6 . CE2 C -2.667 -0.596 4.548 1.00 . A A . 8 DPN CE2 1 1
10 1467 1 1 6 . CG C -1.678 1.552 4.028 1.00 . A A . 8 DPN CG 1 1
10 1468 1 1 6 . CZ C -2.957 -0.152 5.836 1.00 . A A . 8 DPN CZ 1 1
10 1469 1 1 6 . H H -0.149 4.195 1.162 1.00 . A A . 8 DPN H 1 1
10 1470 1 1 6 . HA H -2.746 3.666 2.631 1.00 . A A . 8 DPN HA 1 1
10 1471 1 1 6 . HB2 H -0.366 3.223 3.604 1.00 . A A . 8 DPN HB2 1 1
10 1472 1 1 6 . HB3 H -0.195 1.920 2.490 1.00 . A A . 8 DPN HB3 1 1
10 1473 1 1 6 . HD1 H -1.712 2.992 5.637 1.00 . A A . 8 DPN HD1 1 1
10 1474 1 1 6 . HD2 H -1.804 -0.107 2.653 1.00 . A A . 8 DPN HD2 1 1
10 1475 1 1 6 . HE1 H -2.830 1.489 7.222 1.00 . A A . 8 DPN HE1 1 1
10 1476 1 1 6 . HE2 H -2.931 -1.597 4.242 1.00 . A A . 8 DPN HE2 1 1
10 1477 1 1 6 . HZ H -3.449 -0.812 6.536 1.00 . A A . 8 DPN HZ 1 1
10 1478 1 1 6 . N N -1.123 4.345 1.454 1.00 . A A . 8 DPN N 1 1
10 1479 1 1 6 . O O -3.773 2.298 0.803 1.00 . A A . 8 DPN O 1 1
10 1480 1 1 7 ARG C C -1.325 -0.722 -0.704 1.00 . A A . 9 ARG C 1 1
10 1481 1 1 7 ARG CA C -2.170 0.583 -0.807 1.00 . A A . 9 ARG CA 1 1
10 1482 1 1 7 ARG CB C -2.100 1.227 -2.226 1.00 . A A . 9 ARG CB 1 1
10 1483 1 1 7 ARG CD C -4.723 1.605 -2.533 1.00 . A A . 9 ARG CD 1 1
10 1484 1 1 7 ARG CG C -3.368 1.120 -3.114 1.00 . A A . 9 ARG CG 1 1
10 1485 1 1 7 ARG CZ C -4.886 4.114 -2.290 1.00 . A A . 9 ARG CZ 1 1
10 1486 1 1 7 ARG H H -0.722 1.797 0.344 1.00 . A A . 9 ARG H 1 1
10 1487 1 1 7 ARG HA H -3.221 0.310 -0.578 1.00 . A A . 9 ARG HA 1 1
10 1488 1 1 7 ARG HB2 H -1.849 2.300 -2.150 1.00 . A A . 9 ARG HB2 1 1
10 1489 1 1 7 ARG HB3 H -1.236 0.817 -2.786 1.00 . A A . 9 ARG HB3 1 1
10 1490 1 1 7 ARG HD2 H -5.504 1.609 -3.319 1.00 . A A . 9 ARG HD2 1 1
10 1491 1 1 7 ARG HD3 H -5.093 0.843 -1.819 1.00 . A A . 9 ARG HD3 1 1
10 1492 1 1 7 ARG HE H -4.322 2.897 -0.813 1.00 . A A . 9 ARG HE 1 1
10 1493 1 1 7 ARG HG2 H -3.164 1.684 -4.044 1.00 . A A . 9 ARG HG2 1 1
10 1494 1 1 7 ARG HG3 H -3.479 0.071 -3.449 1.00 . A A . 9 ARG HG3 1 1
10 1495 1 1 7 ARG HH11 H -5.418 3.479 -4.066 1.00 . A A . 9 ARG HH11 1 1
10 1496 1 1 7 ARG HH12 H -5.478 5.290 -3.808 1.00 . A A . 9 ARG HH12 1 1
10 1497 1 1 7 ARG HH21 H -4.274 4.973 -0.590 1.00 . A A . 9 ARG HH21 1 1
10 1498 1 1 7 ARG HH22 H -4.908 6.063 -1.902 1.00 . A A . 9 ARG HH22 1 1
10 1499 1 1 7 ARG N N -1.719 1.566 0.208 1.00 . A A . 9 ARG N 1 1
10 1500 1 1 7 ARG NE N -4.638 2.904 -1.801 1.00 . A A . 9 ARG NE 1 1
10 1501 1 1 7 ARG NH1 N -5.309 4.329 -3.510 1.00 . A A . 9 ARG NH1 1 1
10 1502 1 1 7 ARG NH2 N -4.699 5.143 -1.515 1.00 . A A . 9 ARG NH2 1 1
10 1503 1 1 7 ARG O O -0.126 -0.710 -0.405 1.00 . A A . 9 ARG O 1 1
10 1504 1 1 8 TRP C C -1.225 -3.730 -2.445 1.00 . A A . 10 TRP C 1 1
10 1505 1 1 8 TRP CA C -1.334 -3.189 -0.988 1.00 . A A . 10 TRP CA 1 1
10 1506 1 1 8 TRP CB C -2.154 -4.117 -0.060 1.00 . A A . 10 TRP CB 1 1
10 1507 1 1 8 TRP CD1 C -2.175 -6.614 -0.769 1.00 . A A . 10 TRP CD1 1 1
10 1508 1 1 8 TRP CD2 C -0.594 -6.101 0.706 1.00 . A A . 10 TRP CD2 1 1
10 1509 1 1 8 TRP CE2 C -0.466 -7.461 0.328 1.00 . A A . 10 TRP CE2 1 1
10 1510 1 1 8 TRP CE3 C 0.317 -5.517 1.617 1.00 . A A . 10 TRP CE3 1 1
10 1511 1 1 8 TRP CG C -1.662 -5.567 0.016 1.00 . A A . 10 TRP CG 1 1
10 1512 1 1 8 TRP CH2 C 1.474 -7.656 1.760 1.00 . A A . 10 TRP CH2 1 1
10 1513 1 1 8 TRP CZ2 C 0.583 -8.247 0.860 1.00 . A A . 10 TRP CZ2 1 1
10 1514 1 1 8 TRP CZ3 C 1.341 -6.312 2.134 1.00 . A A . 10 TRP CZ3 1 1
10 1515 1 1 8 TRP H H -2.903 -1.704 -1.395 1.00 . A A . 10 TRP H 1 1
10 1516 1 1 8 TRP HA H -0.322 -3.126 -0.536 1.00 . A A . 10 TRP HA 1 1
10 1517 1 1 8 TRP HB2 H -2.157 -3.695 0.957 1.00 . A A . 10 TRP HB2 1 1
10 1518 1 1 8 TRP HB3 H -3.207 -4.118 -0.389 1.00 . A A . 10 TRP HB3 1 1
10 1519 1 1 8 TRP HD1 H -2.988 -6.466 -1.463 1.00 . A A . 10 TRP HD1 1 1
10 1520 1 1 8 TRP HE1 H -1.615 -8.729 -1.010 1.00 . A A . 10 TRP HE1 1 1
10 1521 1 1 8 TRP HE3 H 0.219 -4.477 1.895 1.00 . A A . 10 TRP HE3 1 1
10 1522 1 1 8 TRP HH2 H 2.279 -8.246 2.175 1.00 . A A . 10 TRP HH2 1 1
10 1523 1 1 8 TRP HZ2 H 0.695 -9.282 0.572 1.00 . A A . 10 TRP HZ2 1 1
10 1524 1 1 8 TRP HZ3 H 2.047 -5.884 2.831 1.00 . A A . 10 TRP HZ3 1 1
10 1525 1 1 8 TRP N N -1.980 -1.854 -0.981 1.00 . A A . 10 TRP N 1 1
10 1526 1 1 8 TRP NE1 N -1.443 -7.807 -0.594 1.00 . A A . 10 TRP NE1 1 1
10 1527 1 1 8 TRP O O -2.203 -3.798 -3.198 1.00 . A A . 10 TRP O 1 1
10 1528 1 1 9 LYS C C 1.307 -6.017 -3.895 1.00 . A A . 11 LYS C 1 1
10 1529 1 1 9 LYS CA C 0.292 -4.840 -4.074 1.00 . A A . 11 LYS CA 1 1
10 1530 1 1 9 LYS CB C 0.684 -3.732 -5.087 1.00 . A A . 11 LYS CB 1 1
10 1531 1 1 9 LYS CD C 1.923 -1.464 -5.277 1.00 . A A . 11 LYS CD 1 1
10 1532 1 1 9 LYS CE C 1.210 -0.530 -4.272 1.00 . A A . 11 LYS CE 1 1
10 1533 1 1 9 LYS CG C 2.001 -2.949 -4.851 1.00 . A A . 11 LYS CG 1 1
10 1534 1 1 9 LYS H H 0.722 -3.856 -2.145 1.00 . A A . 11 LYS H 1 1
10 1535 1 1 9 LYS HA H -0.628 -5.306 -4.480 1.00 . A A . 11 LYS HA 1 1
10 1536 1 1 9 LYS HB2 H 0.736 -4.189 -6.084 1.00 . A A . 11 LYS HB2 1 1
10 1537 1 1 9 LYS HB3 H -0.166 -3.027 -5.147 1.00 . A A . 11 LYS HB3 1 1
10 1538 1 1 9 LYS HD2 H 2.944 -1.085 -5.476 1.00 . A A . 11 LYS HD2 1 1
10 1539 1 1 9 LYS HD3 H 1.417 -1.397 -6.259 1.00 . A A . 11 LYS HD3 1 1
10 1540 1 1 9 LYS HE2 H 0.904 0.395 -4.802 1.00 . A A . 11 LYS HE2 1 1
10 1541 1 1 9 LYS HE3 H 0.270 -0.984 -3.900 1.00 . A A . 11 LYS HE3 1 1
10 1542 1 1 9 LYS HG2 H 2.312 -3.018 -3.792 1.00 . A A . 11 LYS HG2 1 1
10 1543 1 1 9 LYS HG3 H 2.809 -3.458 -5.409 1.00 . A A . 11 LYS HG3 1 1
10 1544 1 1 9 LYS HZ1 H 2.816 -0.874 -2.803 1.00 . A A . 11 LYS HZ1 1 1
10 1545 1 1 9 LYS N N -0.017 -4.185 -2.780 1.00 . A A . 11 LYS N 1 1
10 1546 1 1 9 LYS NZ N 2.105 -0.217 -3.136 1.00 . A A . 11 LYS NZ 1 1
10 1547 1 1 9 LYS O O 2.466 -5.981 -4.299 1.00 . A A . 11 LYS O 1 1
10 1548 1 1 10 NH2 HN1 H 0.033 -7.082 -2.775 1.00 . A A . 12 NH2 HN1 1 1
10 1549 1 1 10 NH2 HN2 H 1.679 -7.801 -3.169 1.00 . A A . 12 NH2 HN2 1 1
10 1550 1 1 10 NH2 N N 0.920 -7.125 -3.290 1.00 . A A . 12 NH2 N 1 1
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