Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
|
|
597694 | 2n7t RC | 25820 | cing | 4-filtered-FRED | STAR | entry | full | 64 |
data_FRED_restraints_with_modified_coordinates_PDB_code_2n7t
# This FRED archive file contains, for PDB entry <2n7t>:
#
# - 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_2n7t
_Assembly.Sf_category assembly
_Assembly.Entry_ID 1
_Assembly.ID 1
_Assembly.Name 2n7t
_Assembly.Number_of_components 1
_Assembly.Organic_ligands .
_Assembly.Metal_ions .
_Assembly.Paramagnetic .
_Assembly.Thiol_state "not present"
_Assembly.Molecular_mass 1220.42
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_992 A . 1 1
stop_
save_
save_Peptide_PG_992
_Entity.Sf_category entity
_Entity.Entry_ID 1
_Entity.ID 1
_Entity.Name "Peptide PG 992"
_Entity.Type polymer
_Entity.Polymer_type polypeptide(L)
_Entity.Polymer_seq_one_letter_code XXDWPXRWKX
_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 TRP . 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
TRP 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
55 1 . . . 1 1
56 1 . . . 1 1
57 1 . . . 1 1
58 1 . . . 1 1
59 1 . . . 1 1
60 1 . . . 1 1
61 1 . . . 1 1
62 1 . . . 1 1
63 1 . . . 1 1
64 1 . . . 1 1
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 HB2 . 4 NLE HB2 1 1
6 1 2 1 1 8 TRP HE3 . 10 TRP HE3 1 1
7 1 1 1 1 2 NLE HB3 . 4 NLE HB3 1 1
7 1 2 1 1 3 ASP H . 5 ASP HN 1 1
8 1 1 1 1 2 NLE HB3 . 4 NLE HB3 1 1
8 1 2 1 1 8 TRP HE3 . 10 TRP HE3 1 1
9 1 1 1 1 3 ASP H . 5 ASP HN 1 1
9 1 2 1 1 3 ASP HB2 . 5 ASP HB2 1 1
10 1 1 1 1 3 ASP H . 5 ASP HN 1 1
10 1 2 1 1 3 ASP QB . 5 ASP QB 1 1
11 1 1 1 1 3 ASP H . 5 ASP HN 1 1
11 1 2 1 1 3 ASP HB3 . 5 ASP HB3 1 1
12 1 1 1 1 3 ASP H . 5 ASP HN 1 1
12 1 2 1 1 8 TRP HA . 10 TRP HA 1 1
13 1 1 1 1 3 ASP H . 5 ASP HN 1 1
13 1 2 1 1 9 LYS H . 11 LYS HN 1 1
14 1 1 1 1 4 TRP H . 6 TRP HN 1 1
14 1 2 1 1 4 TRP QB . 6 TRP QB 1 1
15 1 1 1 1 4 TRP HA . 6 TRP HA 1 1
15 1 2 1 1 4 TRP HD1 . 6 TRP HD1 1 1
16 1 1 1 1 4 TRP HA . 6 TRP HA 1 1
16 1 2 1 1 4 TRP HE3 . 6 TRP HE3 1 1
17 1 1 1 1 4 TRP HA . 6 TRP HA 1 1
17 1 2 1 1 5 PRO HA . 7 PRO HA 1 1
18 1 1 1 1 4 TRP HA . 6 TRP HA 1 1
18 1 2 1 1 7 ARG H . 9 ARG HN 1 1
19 1 1 1 1 4 TRP QB . 6 TRP QB 1 1
19 1 2 1 1 4 TRP HD1 . 6 TRP HD1 1 1
20 1 1 1 1 4 TRP QB . 6 TRP QB 1 1
20 1 2 1 1 4 TRP HE3 . 6 TRP HE3 1 1
21 1 1 1 1 4 TRP HD1 . 6 TRP HD1 1 1
21 1 2 1 1 5 PRO HA . 7 PRO HA 1 1
22 1 1 1 1 4 TRP HD1 . 6 TRP HD1 1 1
22 1 2 1 1 5 PRO HB2 . 7 PRO HB2 1 1
23 1 1 1 1 4 TRP HD1 . 6 TRP HD1 1 1
23 1 2 1 1 5 PRO QB . 7 PRO QB 1 1
24 1 1 1 1 4 TRP HD1 . 6 TRP HD1 1 1
24 1 2 1 1 5 PRO HB3 . 7 PRO HB3 1 1
25 1 1 1 1 4 TRP HD1 . 6 TRP HD1 1 1
25 1 2 1 1 5 PRO QD . 7 PRO QD 1 1
26 1 1 1 1 4 TRP HE3 . 6 TRP HE3 1 1
26 1 2 1 1 5 PRO HA . 7 PRO HA 1 1
27 1 1 1 1 7 ARG H . 9 ARG HN 1 1
27 1 2 1 1 7 ARG HB2 . 9 ARG HB2 1 1
28 1 1 1 1 7 ARG H . 9 ARG HN 1 1
28 1 2 1 1 7 ARG HB3 . 9 ARG HB3 1 1
29 1 1 1 1 7 ARG H . 9 ARG HN 1 1
29 1 2 1 1 7 ARG HG2 . 9 ARG HG2 1 1
30 1 1 1 1 7 ARG H . 9 ARG HN 1 1
30 1 2 1 1 7 ARG QG . 9 ARG QG 1 1
31 1 1 1 1 7 ARG H . 9 ARG HN 1 1
31 1 2 1 1 7 ARG HG3 . 9 ARG HG3 1 1
32 1 1 1 1 7 ARG H . 9 ARG HN 1 1
32 1 2 1 1 8 TRP H . 10 TRP HN 1 1
33 1 1 1 1 7 ARG HA . 9 ARG HA 1 1
33 1 2 1 1 8 TRP H . 10 TRP HN 1 1
34 1 1 1 1 7 ARG HB2 . 9 ARG HB2 1 1
34 1 2 1 1 8 TRP H . 10 TRP HN 1 1
35 1 1 1 1 7 ARG HB3 . 9 ARG HB3 1 1
35 1 2 1 1 8 TRP H . 10 TRP HN 1 1
36 1 1 1 1 8 TRP H . 10 TRP HN 1 1
36 1 2 1 1 8 TRP HB2 . 10 TRP HB2 1 1
37 1 1 1 1 8 TRP H . 10 TRP HN 1 1
37 1 2 1 1 8 TRP HB3 . 10 TRP HB3 1 1
38 1 1 1 1 8 TRP H . 10 TRP HN 1 1
38 1 2 1 1 8 TRP HD1 . 10 TRP HD1 1 1
39 1 1 1 1 8 TRP H . 10 TRP HN 1 1
39 1 2 1 1 8 TRP HE3 . 10 TRP HE3 1 1
40 1 1 1 1 8 TRP H . 10 TRP HN 1 1
40 1 2 1 1 9 LYS H . 11 LYS HN 1 1
41 1 1 1 1 8 TRP HA . 10 TRP HA 1 1
41 1 2 1 1 8 TRP HD1 . 10 TRP HD1 1 1
42 1 1 1 1 8 TRP HA . 10 TRP HA 1 1
42 1 2 1 1 8 TRP HE3 . 10 TRP HE3 1 1
43 1 1 1 1 8 TRP HA . 10 TRP HA 1 1
43 1 2 1 1 9 LYS H . 11 LYS HN 1 1
44 1 1 1 1 8 TRP QB . 10 TRP QB 1 1
44 1 2 1 1 8 TRP HD1 . 10 TRP HD1 1 1
45 1 1 1 1 8 TRP HB2 . 10 TRP HB2 1 1
45 1 2 1 1 8 TRP HD1 . 10 TRP HD1 1 1
46 1 1 1 1 8 TRP HB2 . 10 TRP HB2 1 1
46 1 2 1 1 8 TRP HE3 . 10 TRP HE3 1 1
47 1 1 1 1 8 TRP HB2 . 10 TRP HB2 1 1
47 1 2 1 1 9 LYS H . 11 LYS HN 1 1
48 1 1 1 1 8 TRP HB3 . 10 TRP HB3 1 1
48 1 2 1 1 8 TRP HD1 . 10 TRP HD1 1 1
49 1 1 1 1 8 TRP HB3 . 10 TRP HB3 1 1
49 1 2 1 1 8 TRP HE3 . 10 TRP HE3 1 1
50 1 1 1 1 8 TRP HB3 . 10 TRP HB3 1 1
50 1 2 1 1 9 LYS H . 11 LYS HN 1 1
51 1 1 1 1 8 TRP HE3 . 10 TRP HE3 1 1
51 1 2 1 1 9 LYS H . 11 LYS HN 1 1
52 1 1 1 1 9 LYS H . 11 LYS HN 1 1
52 1 2 1 1 9 LYS HB2 . 11 LYS HB2 1 1
53 1 1 1 1 9 LYS H . 11 LYS HN 1 1
53 1 2 1 1 9 LYS QB . 11 LYS QB 1 1
54 1 1 1 1 9 LYS H . 11 LYS HN 1 1
54 1 2 1 1 9 LYS HB3 . 11 LYS HB3 1 1
55 1 1 1 1 9 LYS H . 11 LYS HN 1 1
55 1 2 1 1 9 LYS HG2 . 11 LYS HG2 1 1
56 1 1 1 1 9 LYS H . 11 LYS HN 1 1
56 1 2 1 1 9 LYS QG . 11 LYS QG 1 1
57 1 1 1 1 9 LYS H . 11 LYS HN 1 1
57 1 2 1 1 9 LYS HG3 . 11 LYS HG3 1 1
58 1 1 1 1 9 LYS HA . 11 LYS HA 1 1
58 1 2 1 1 9 LYS HB2 . 11 LYS HB2 1 1
59 1 1 1 1 9 LYS HA . 11 LYS HA 1 1
59 1 2 1 1 9 LYS QB . 11 LYS QB 1 1
60 1 1 1 1 9 LYS HA . 11 LYS HA 1 1
60 1 2 1 1 9 LYS HB3 . 11 LYS HB3 1 1
61 1 1 1 1 9 LYS HA . 11 LYS HA 1 1
61 1 2 1 1 9 LYS HG2 . 11 LYS HG2 1 1
62 1 1 1 1 9 LYS HA . 11 LYS HA 1 1
62 1 2 1 1 9 LYS QG . 11 LYS QG 1 1
63 1 1 1 1 9 LYS HA . 11 LYS HA 1 1
63 1 2 1 1 9 LYS HG3 . 11 LYS HG3 1 1
64 1 1 1 1 9 LYS QE . 11 LYS QE 1 1
64 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 . . . . . . . 2.65 1 1
2 1 . . . . . . . 3.17 1 1
3 1 . . . . . . . 4.17 1 1
4 1 . . . . . . . 3.39 1 1
5 1 . . . . . . . 3.58 1 1
6 1 . . . . . . . 4.97 1 1
7 1 . . . . . . . 3.58 1 1
8 1 . . . . . . . 4.97 1 1
9 1 . . . . . . . 3.52 1 1
10 1 . . . . . . . 2.98 1 1
11 1 . . . . . . . 3.52 1 1
12 1 . . . . . . . 3.89 1 1
13 1 . . . . . . . 3.89 1 1
14 1 . . . . . . . 3.62 1 1
15 1 . . . . . . . 4.97 1 1
16 1 . . . . . . . 3.7 1 1
17 1 . . . . . . . 2.59 1 1
18 1 . . . . . . . 4.17 1 1
19 1 . . . . . . . 3.39 1 1
20 1 . . . . . . . 3.61 1 1
21 1 . . . . . . . 4.66 1 1
22 1 . . . . . . . 5.04 1 1
23 1 . . . . . . . 4.38 1 1
24 1 . . . . . . . 5.04 1 1
25 1 . . . . . . . 4.23 1 1
26 1 . . . . . . . 3.92 1 1
27 1 . . . . . . . 3.11 1 1
28 1 . . . . . . . 3.52 1 1
29 1 . . . . . . . 4.72 1 1
30 1 . . . . . . . 4.15 1 1
31 1 . . . . . . . 4.72 1 1
32 1 . . . . . . . 4.23 1 1
33 1 . . . . . . . 2.68 1 1
34 1 . . . . . . . 3.73 1 1
35 1 . . . . . . . 3.48 1 1
36 1 . . . . . . . 3.11 1 1
37 1 . . . . . . . 3.11 1 1
38 1 . . . . . . . 4.42 1 1
39 1 . . . . . . . 5.5 1 1
40 1 . . . . . . . 4.57 1 1
41 1 . . . . . . . 4.82 1 1
42 1 . . . . . . . 2.96 1 1
43 1 . . . . . . . 2.65 1 1
44 1 . . . . . . . 2.95 1 1
45 1 . . . . . . . 3.39 1 1
46 1 . . . . . . . 3.89 1 1
47 1 . . . . . . . 4.11 1 1
48 1 . . . . . . . 3.39 1 1
49 1 . . . . . . . 3.89 1 1
50 1 . . . . . . . 4.11 1 1
51 1 . . . . . . . 4.26 1 1
52 1 . . . . . . . 3.45 1 1
53 1 . . . . . . . 2.88 1 1
54 1 . . . . . . . 3.45 1 1
55 1 . . . . . . . 4.38 1 1
56 1 . . . . . . . 3.78 1 1
57 1 . . . . . . . 4.38 1 1
58 1 . . . . . . . 2.96 1 1
59 1 . . . . . . . 2.57 1 1
60 1 . . . . . . . 2.96 1 1
61 1 . . . . . . . 4.01 1 1
62 1 . . . . . . . 3.38 1 1
63 1 . . . . . . . 4.01 1 1
64 1 . . . . . . . 3.24 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 0.411 -4.349 1.353 1.00 . A A . 3 ACE C 1 1
1 2 1 1 1 ACE CH3 C 0.776 -5.761 1.770 1.00 . A A . 3 ACE CH3 1 1
1 3 1 1 1 ACE H1 H 0.829 -6.425 0.890 1.00 . A A . 3 ACE H1 1 1
1 4 1 1 1 ACE H2 H 1.762 -5.785 2.267 1.00 . A A . 3 ACE H2 1 1
1 5 1 1 1 ACE H3 H 0.028 -6.194 2.459 1.00 . A A . 3 ACE H3 1 1
1 6 1 1 1 ACE O O 0.401 -4.026 0.166 1.00 . A A . 3 ACE O 1 1
1 7 1 1 2 NLE C C 0.927 -1.128 1.976 1.00 . A A . 4 NLE C 1 1
1 8 1 1 2 NLE CA C -0.287 -2.099 2.116 1.00 . A A . 4 NLE CA 1 1
1 9 1 1 2 NLE CB C -1.316 -1.661 3.185 1.00 . A A . 4 NLE CB 1 1
1 10 1 1 2 NLE CD C -2.082 -1.606 5.658 1.00 . A A . 4 NLE CD 1 1
1 11 1 1 2 NLE CE C -2.798 -0.249 5.694 1.00 . A A . 4 NLE CE 1 1
1 12 1 1 2 NLE CG C -0.895 -1.673 4.678 1.00 . A A . 4 NLE CG 1 1
1 13 1 1 2 NLE H H 0.115 -3.924 3.280 1.00 . A A . 4 NLE H 1 1
1 14 1 1 2 NLE HA H -0.866 -2.077 1.170 1.00 . A A . 4 NLE HA 1 1
1 15 1 1 2 NLE HB2 H -2.215 -2.281 3.042 1.00 . A A . 4 NLE HB2 1 1
1 16 1 1 2 NLE HB3 H -1.665 -0.646 2.936 1.00 . A A . 4 NLE HB3 1 1
1 17 1 1 2 NLE HD2 H -1.714 -1.835 6.676 1.00 . A A . 4 NLE HD2 1 1
1 18 1 1 2 NLE HD3 H -2.808 -2.408 5.424 1.00 . A A . 4 NLE HD3 1 1
1 19 1 1 2 NLE HE1 H -2.115 0.560 6.010 1.00 . A A . 4 NLE HE1 1 1
1 20 1 1 2 NLE HE2 H -3.209 0.034 4.706 1.00 . A A . 4 NLE HE2 1 1
1 21 1 1 2 NLE HE3 H -3.643 -0.258 6.406 1.00 . A A . 4 NLE HE3 1 1
1 22 1 1 2 NLE HG2 H -0.182 -0.849 4.880 1.00 . A A . 4 NLE HG2 1 1
1 23 1 1 2 NLE HG3 H -0.327 -2.595 4.900 1.00 . A A . 4 NLE HG3 1 1
1 24 1 1 2 NLE N N 0.117 -3.511 2.346 1.00 . A A . 4 NLE N 1 1
1 25 1 1 2 NLE O O 1.719 -0.927 2.902 1.00 . A A . 4 NLE O 1 1
1 26 1 1 3 ASP C C 1.718 1.826 0.249 1.00 . A A . 5 ASP C 1 1
1 27 1 1 3 ASP CA C 2.189 0.345 0.406 1.00 . A A . 5 ASP CA 1 1
1 28 1 1 3 ASP CB C 2.805 -0.221 -0.903 1.00 . A A . 5 ASP CB 1 1
1 29 1 1 3 ASP CG C 3.748 -1.418 -0.709 1.00 . A A . 5 ASP CG 1 1
1 30 1 1 3 ASP H H 0.287 -0.772 0.128 1.00 . A A . 5 ASP H 1 1
1 31 1 1 3 ASP HA H 2.978 0.312 1.188 1.00 . A A . 5 ASP HA 1 1
1 32 1 1 3 ASP HB2 H 2.026 -0.455 -1.653 1.00 . A A . 5 ASP HB2 1 1
1 33 1 1 3 ASP HB3 H 3.405 0.567 -1.390 1.00 . A A . 5 ASP HB3 1 1
1 34 1 1 3 ASP N N 1.043 -0.525 0.788 1.00 . A A . 5 ASP N 1 1
1 35 1 1 3 ASP O O 0.756 2.113 -0.472 1.00 . A A . 5 ASP O 1 1
1 36 1 1 3 ASP OD1 O 4.957 -1.222 -0.580 1.00 . A A . 5 ASP OD1 1 1
1 37 1 1 4 TRP C C 1.886 4.949 -0.356 1.00 . A A . 6 TRP C 1 1
1 38 1 1 4 TRP CA C 1.976 4.194 1.031 1.00 . A A . 6 TRP CA 1 1
1 39 1 1 4 TRP CB C 2.962 4.881 2.022 1.00 . A A . 6 TRP CB 1 1
1 40 1 1 4 TRP CD1 C 2.947 7.486 1.687 1.00 . A A . 6 TRP CD1 1 1
1 41 1 1 4 TRP CD2 C 1.828 6.772 3.473 1.00 . A A . 6 TRP CD2 1 1
1 42 1 1 4 TRP CE2 C 1.699 8.181 3.358 1.00 . A A . 6 TRP CE2 1 1
1 43 1 1 4 TRP CE3 C 1.156 6.073 4.506 1.00 . A A . 6 TRP CE3 1 1
1 44 1 1 4 TRP CG C 2.611 6.326 2.421 1.00 . A A . 6 TRP CG 1 1
1 45 1 1 4 TRP CH2 C 0.246 8.192 5.291 1.00 . A A . 6 TRP CH2 1 1
1 46 1 1 4 TRP CZ2 C 0.897 8.897 4.275 1.00 . A A . 6 TRP CZ2 1 1
1 47 1 1 4 TRP CZ3 C 0.374 6.803 5.404 1.00 . A A . 6 TRP CZ3 1 1
1 48 1 1 4 TRP H H 3.208 2.411 1.456 1.00 . A A . 6 TRP H 1 1
1 49 1 1 4 TRP HA H 0.979 4.187 1.509 1.00 . A A . 6 TRP HA 1 1
1 50 1 1 4 TRP HB2 H 3.039 4.285 2.953 1.00 . A A . 6 TRP HB2 1 1
1 51 1 1 4 TRP HB3 H 3.985 4.869 1.598 1.00 . A A . 6 TRP HB3 1 1
1 52 1 1 4 TRP HD1 H 3.483 7.474 0.748 1.00 . A A . 6 TRP HD1 1 1
1 53 1 1 4 TRP HE1 H 2.450 9.615 1.917 1.00 . A A . 6 TRP HE1 1 1
1 54 1 1 4 TRP HE3 H 1.239 5.002 4.596 1.00 . A A . 6 TRP HE3 1 1
1 55 1 1 4 TRP HH2 H -0.372 8.729 5.998 1.00 . A A . 6 TRP HH2 1 1
1 56 1 1 4 TRP HZ2 H 0.783 9.968 4.187 1.00 . A A . 6 TRP HZ2 1 1
1 57 1 1 4 TRP HZ3 H -0.145 6.287 6.198 1.00 . A A . 6 TRP HZ3 1 1
1 58 1 1 4 TRP N N 2.399 2.764 0.936 1.00 . A A . 6 TRP N 1 1
1 59 1 1 4 TRP NE1 N 2.392 8.648 2.256 1.00 . A A . 6 TRP NE1 1 1
1 60 1 1 4 TRP O O 2.838 4.837 -1.139 1.00 . A A . 6 TRP O 1 1
1 61 1 1 5 PRO C C -1.522 5.197 0.483 1.00 . A A . 7 PRO C 1 1
1 62 1 1 5 PRO CA C -0.285 6.135 0.238 1.00 . A A . 7 PRO CA 1 1
1 63 1 1 5 PRO CB C -0.660 7.500 -0.373 1.00 . A A . 7 PRO CB 1 1
1 64 1 1 5 PRO CD C 0.774 6.460 -1.986 1.00 . A A . 7 PRO CD 1 1
1 65 1 1 5 PRO CG C -0.480 7.326 -1.882 1.00 . A A . 7 PRO CG 1 1
1 66 1 1 5 PRO HA H 0.119 6.341 1.243 1.00 . A A . 7 PRO HA 1 1
1 67 1 1 5 PRO HB2 H -1.675 7.843 -0.098 1.00 . A A . 7 PRO HB2 1 1
1 68 1 1 5 PRO HB3 H 0.031 8.281 0.003 1.00 . A A . 7 PRO HB3 1 1
1 69 1 1 5 PRO HD2 H 0.735 5.782 -2.859 1.00 . A A . 7 PRO HD2 1 1
1 70 1 1 5 PRO HD3 H 1.680 7.090 -2.094 1.00 . A A . 7 PRO HD3 1 1
1 71 1 1 5 PRO HG2 H -1.352 6.797 -2.315 1.00 . A A . 7 PRO HG2 1 1
1 72 1 1 5 PRO HG3 H -0.380 8.289 -2.417 1.00 . A A . 7 PRO HG3 1 1
1 73 1 1 5 PRO N N 0.805 5.717 -0.707 1.00 . A A . 7 PRO N 1 1
1 74 1 1 5 PRO O O -2.486 5.628 1.118 1.00 . A A . 7 PRO O 1 1
1 75 1 1 6 . C C -2.996 2.132 -0.936 1.00 . A A . 8 4J2 C 1 1
1 76 1 1 6 . CA C -2.541 2.913 0.339 1.00 . A A . 8 4J2 CA 1 1
1 77 1 1 6 . CB C -2.045 1.893 1.415 1.00 . A A . 8 4J2 CB 1 1
1 78 1 1 6 . CD1 C -2.637 3.079 3.579 1.00 . A A . 8 4J2 CD1 1 1
1 79 1 1 6 . CD2 C -0.441 2.102 3.369 1.00 . A A . 8 4J2 CD2 1 1
1 80 1 1 6 . CE1 C -2.355 3.482 4.880 1.00 . A A . 8 4J2 CE1 1 1
1 81 1 1 6 . CE2 C -0.136 2.474 4.675 1.00 . A A . 8 4J2 CE2 1 1
1 82 1 1 6 . CE3 C 1.095 2.153 5.250 1.00 . A A . 8 4J2 CE3 1 1
1 83 1 1 6 . CE4 C 1.369 2.525 6.562 1.00 . A A . 8 4J2 CE4 1 1
1 84 1 1 6 . CG C -1.688 2.401 2.818 1.00 . A A . 8 4J2 CG 1 1
1 85 1 1 6 . CZ1 C -1.116 3.184 5.451 1.00 . A A . 8 4J2 CZ1 1 1
1 86 1 1 6 . CZ2 C -0.816 3.538 6.767 1.00 . A A . 8 4J2 CZ2 1 1
1 87 1 1 6 . CZ3 C 0.421 3.213 7.315 1.00 . A A . 8 4J2 CZ3 1 1
1 88 1 1 6 . H H -0.583 3.663 -0.374 1.00 . A A . 8 4J2 H 1 1
1 89 1 1 6 . HA H -3.454 3.407 0.725 1.00 . A A . 8 4J2 HA 1 1
1 90 1 1 6 . HB1 H -1.190 1.328 1.001 1.00 . A A . 8 4J2 HB1 1 1
1 91 1 1 6 . HB2 H -2.815 1.114 1.540 1.00 . A A . 8 4J2 HB2 1 1
1 92 1 1 6 . HD1 H -3.604 3.270 3.140 1.00 . A A . 8 4J2 HD1 1 1
1 93 1 1 6 . HD2 H 0.275 1.547 2.782 1.00 . A A . 8 4J2 HD2 1 1
1 94 1 1 6 . HE1 H -3.115 4.008 5.441 1.00 . A A . 8 4J2 HE1 1 1
1 95 1 1 6 . HE3 H 1.844 1.607 4.692 1.00 . A A . 8 4J2 HE3 1 1
1 96 1 1 6 . HE4 H 2.323 2.274 7.002 1.00 . A A . 8 4J2 HE4 1 1
1 97 1 1 6 . HZ2 H -1.535 4.068 7.378 1.00 . A A . 8 4J2 HZ2 1 1
1 98 1 1 6 . HZ23 H 0.647 3.493 8.334 1.00 . A A . 8 4J2 HZ23 1 1
1 99 1 1 6 . N N -1.483 3.928 0.048 1.00 . A A . 8 4J2 N 1 1
1 100 1 1 6 . O O -4.192 2.034 -1.217 1.00 . A A . 8 4J2 O 1 1
1 101 1 1 7 ARG C C -1.972 -0.983 -1.882 1.00 . A A . 9 ARG C 1 1
1 102 1 1 7 ARG CA C -2.296 0.379 -2.571 1.00 . A A . 9 ARG CA 1 1
1 103 1 1 7 ARG CB C -1.454 0.600 -3.856 1.00 . A A . 9 ARG CB 1 1
1 104 1 1 7 ARG CD C 0.856 1.072 -4.950 1.00 . A A . 9 ARG CD 1 1
1 105 1 1 7 ARG CG C 0.091 0.571 -3.712 1.00 . A A . 9 ARG CG 1 1
1 106 1 1 7 ARG CZ C 2.907 2.159 -3.988 1.00 . A A . 9 ARG CZ 1 1
1 107 1 1 7 ARG H H -1.112 1.604 -1.218 1.00 . A A . 9 ARG H 1 1
1 108 1 1 7 ARG HA H -3.363 0.386 -2.877 1.00 . A A . 9 ARG HA 1 1
1 109 1 1 7 ARG HB2 H -1.743 -0.168 -4.587 1.00 . A A . 9 ARG HB2 1 1
1 110 1 1 7 ARG HB3 H -1.784 1.547 -4.315 1.00 . A A . 9 ARG HB3 1 1
1 111 1 1 7 ARG HD2 H 0.706 0.372 -5.795 1.00 . A A . 9 ARG HD2 1 1
1 112 1 1 7 ARG HD3 H 0.461 2.043 -5.310 1.00 . A A . 9 ARG HD3 1 1
1 113 1 1 7 ARG HG2 H 0.386 1.179 -2.836 1.00 . A A . 9 ARG HG2 1 1
1 114 1 1 7 ARG HG3 H 0.429 -0.454 -3.466 1.00 . A A . 9 ARG HG3 1 1
1 115 1 1 7 ARG HH11 H 1.264 3.137 -3.639 1.00 . A A . 9 ARG HH11 1 1
1 116 1 1 7 ARG HH12 H 2.796 3.829 -2.887 1.00 . A A . 9 ARG HH12 1 1
1 117 1 1 7 ARG HH21 H 4.594 1.245 -4.226 1.00 . A A . 9 ARG HH21 1 1
1 118 1 1 7 ARG HH22 H 4.634 2.843 -3.295 1.00 . A A . 9 ARG HH22 1 1
1 119 1 1 7 ARG N N -2.041 1.501 -1.640 1.00 . A A . 9 ARG N 1 1
1 120 1 1 7 ARG NE N 2.313 1.169 -4.659 1.00 . A A . 9 ARG NE 1 1
1 121 1 1 7 ARG NH1 N 2.273 3.189 -3.495 1.00 . A A . 9 ARG NH1 1 1
1 122 1 1 7 ARG NH2 N 4.184 2.081 -3.804 1.00 . A A . 9 ARG NH2 1 1
1 123 1 1 7 ARG O O -1.003 -1.109 -1.123 1.00 . A A . 9 ARG O 1 1
1 124 1 1 8 TRP C C -1.660 -4.154 -2.854 1.00 . A A . 10 TRP C 1 1
1 125 1 1 8 TRP CA C -2.469 -3.402 -1.752 1.00 . A A . 10 TRP CA 1 1
1 126 1 1 8 TRP CB C -3.810 -4.082 -1.399 1.00 . A A . 10 TRP CB 1 1
1 127 1 1 8 TRP CD1 C -3.703 -6.669 -1.443 1.00 . A A . 10 TRP CD1 1 1
1 128 1 1 8 TRP CD2 C -3.374 -5.775 0.561 1.00 . A A . 10 TRP CD2 1 1
1 129 1 1 8 TRP CE2 C -3.263 -7.184 0.652 1.00 . A A . 10 TRP CE2 1 1
1 130 1 1 8 TRP CE3 C -3.196 -4.961 1.704 1.00 . A A . 10 TRP CE3 1 1
1 131 1 1 8 TRP CG C -3.650 -5.454 -0.749 1.00 . A A . 10 TRP CG 1 1
1 132 1 1 8 TRP CH2 C -2.819 -6.975 3.022 1.00 . A A . 10 TRP CH2 1 1
1 133 1 1 8 TRP CZ2 C -2.980 -7.792 1.898 1.00 . A A . 10 TRP CZ2 1 1
1 134 1 1 8 TRP CZ3 C -2.924 -5.580 2.925 1.00 . A A . 10 TRP CZ3 1 1
1 135 1 1 8 TRP H H -3.418 -1.824 -2.958 1.00 . A A . 10 TRP H 1 1
1 136 1 1 8 TRP HA H -1.883 -3.373 -0.810 1.00 . A A . 10 TRP HA 1 1
1 137 1 1 8 TRP HB2 H -4.387 -3.450 -0.707 1.00 . A A . 10 TRP HB2 1 1
1 138 1 1 8 TRP HB3 H -4.438 -4.170 -2.303 1.00 . A A . 10 TRP HB3 1 1
1 139 1 1 8 TRP HD1 H -3.881 -6.698 -2.507 1.00 . A A . 10 TRP HD1 1 1
1 140 1 1 8 TRP HE1 H -3.461 -8.767 -0.825 1.00 . A A . 10 TRP HE1 1 1
1 141 1 1 8 TRP HE3 H -3.259 -3.885 1.616 1.00 . A A . 10 TRP HE3 1 1
1 142 1 1 8 TRP HH2 H -2.605 -7.427 3.980 1.00 . A A . 10 TRP HH2 1 1
1 143 1 1 8 TRP HZ2 H -2.895 -8.865 1.980 1.00 . A A . 10 TRP HZ2 1 1
1 144 1 1 8 TRP HZ3 H -2.786 -4.973 3.808 1.00 . A A . 10 TRP HZ3 1 1
1 145 1 1 8 TRP N N -2.762 -2.015 -2.195 1.00 . A A . 10 TRP N 1 1
1 146 1 1 8 TRP NE1 N -3.459 -7.768 -0.593 1.00 . A A . 10 TRP NE1 1 1
1 147 1 1 8 TRP O O -2.142 -4.365 -3.971 1.00 . A A . 10 TRP O 1 1
1 148 1 1 9 LYS C C 0.318 -6.767 -3.698 1.00 . A A . 11 LYS C 1 1
1 149 1 1 9 LYS CA C 0.497 -5.226 -3.473 1.00 . A A . 11 LYS CA 1 1
1 150 1 1 9 LYS CB C 1.941 -4.773 -3.131 1.00 . A A . 11 LYS CB 1 1
1 151 1 1 9 LYS CD C 4.005 -4.851 -1.561 1.00 . A A . 11 LYS CD 1 1
1 152 1 1 9 LYS CE C 3.946 -3.865 -0.376 1.00 . A A . 11 LYS CE 1 1
1 153 1 1 9 LYS CG C 2.664 -5.503 -1.975 1.00 . A A . 11 LYS CG 1 1
1 154 1 1 9 LYS H H -0.146 -4.289 -1.558 1.00 . A A . 11 LYS H 1 1
1 155 1 1 9 LYS HA H 0.308 -4.790 -4.472 1.00 . A A . 11 LYS HA 1 1
1 156 1 1 9 LYS HB2 H 2.556 -4.891 -4.039 1.00 . A A . 11 LYS HB2 1 1
1 157 1 1 9 LYS HB3 H 1.949 -3.680 -2.950 1.00 . A A . 11 LYS HB3 1 1
1 158 1 1 9 LYS HD2 H 4.698 -5.664 -1.271 1.00 . A A . 11 LYS HD2 1 1
1 159 1 1 9 LYS HD3 H 4.500 -4.373 -2.430 1.00 . A A . 11 LYS HD3 1 1
1 160 1 1 9 LYS HE2 H 3.482 -4.366 0.495 1.00 . A A . 11 LYS HE2 1 1
1 161 1 1 9 LYS HE3 H 4.980 -3.640 -0.045 1.00 . A A . 11 LYS HE3 1 1
1 162 1 1 9 LYS HG2 H 1.993 -5.594 -1.102 1.00 . A A . 11 LYS HG2 1 1
1 163 1 1 9 LYS HG3 H 2.853 -6.546 -2.295 1.00 . A A . 11 LYS HG3 1 1
1 164 1 1 9 LYS HZ1 H 2.160 -2.618 -0.701 1.00 . A A . 11 LYS HZ1 1 1
1 165 1 1 9 LYS N N -0.434 -4.565 -2.511 1.00 . A A . 11 LYS N 1 1
1 166 1 1 9 LYS NZ N 3.186 -2.629 -0.674 1.00 . A A . 11 LYS NZ 1 1
1 167 1 1 9 LYS O O 0.616 -7.286 -4.770 1.00 . A A . 11 LYS O 1 1
1 168 1 1 10 NH2 HN1 H -0.533 -7.108 -1.925 1.00 . A A . 12 NH2 HN1 1 1
1 169 1 1 10 NH2 HN2 H -0.276 -8.534 -3.063 1.00 . A A . 12 NH2 HN2 1 1
1 170 1 1 10 NH2 N N -0.141 -7.568 -2.752 1.00 . A A . 12 NH2 N 1 1
2 171 1 1 1 ACE C C 0.141 -4.605 1.801 1.00 . A A . 3 ACE C 1 1
2 172 1 1 1 ACE CH3 C 0.647 -5.868 2.467 1.00 . A A . 3 ACE CH3 1 1
2 173 1 1 1 ACE H1 H 0.543 -6.731 1.786 1.00 . A A . 3 ACE H1 1 1
2 174 1 1 1 ACE H2 H 1.716 -5.783 2.736 1.00 . A A . 3 ACE H2 1 1
2 175 1 1 1 ACE H3 H 0.071 -6.102 3.381 1.00 . A A . 3 ACE H3 1 1
2 176 1 1 1 ACE O O -0.286 -4.632 0.648 1.00 . A A . 3 ACE O 1 1
2 177 1 1 2 NLE C C 0.928 -1.229 1.818 1.00 . A A . 4 NLE C 1 1
2 178 1 1 2 NLE CA C -0.288 -2.178 2.069 1.00 . A A . 4 NLE CA 1 1
2 179 1 1 2 NLE CB C -1.255 -1.555 3.106 1.00 . A A . 4 NLE CB 1 1
2 180 1 1 2 NLE CD C -3.391 -1.714 4.577 1.00 . A A . 4 NLE CD 1 1
2 181 1 1 2 NLE CE C -4.084 -0.394 4.209 1.00 . A A . 4 NLE CE 1 1
2 182 1 1 2 NLE CG C -2.548 -2.332 3.447 1.00 . A A . 4 NLE CG 1 1
2 183 1 1 2 NLE H H 0.535 -3.633 3.501 1.00 . A A . 4 NLE H 1 1
2 184 1 1 2 NLE HA H -0.870 -2.293 1.130 1.00 . A A . 4 NLE HA 1 1
2 185 1 1 2 NLE HB2 H -1.569 -0.575 2.720 1.00 . A A . 4 NLE HB2 1 1
2 186 1 1 2 NLE HB3 H -0.692 -1.328 4.025 1.00 . A A . 4 NLE HB3 1 1
2 187 1 1 2 NLE HD2 H -2.766 -1.570 5.480 1.00 . A A . 4 NLE HD2 1 1
2 188 1 1 2 NLE HD3 H -4.166 -2.444 4.878 1.00 . A A . 4 NLE HD3 1 1
2 189 1 1 2 NLE HE1 H -3.353 0.411 4.022 1.00 . A A . 4 NLE HE1 1 1
2 190 1 1 2 NLE HE2 H -4.712 -0.493 3.304 1.00 . A A . 4 NLE HE2 1 1
2 191 1 1 2 NLE HE3 H -4.741 -0.043 5.027 1.00 . A A . 4 NLE HE3 1 1
2 192 1 1 2 NLE HG2 H -2.275 -3.359 3.753 1.00 . A A . 4 NLE HG2 1 1
2 193 1 1 2 NLE HG3 H -3.169 -2.449 2.539 1.00 . A A . 4 NLE HG3 1 1
2 194 1 1 2 NLE N N 0.190 -3.503 2.548 1.00 . A A . 4 NLE N 1 1
2 195 1 1 2 NLE O O 1.707 -0.922 2.727 1.00 . A A . 4 NLE O 1 1
2 196 1 1 3 ASP C C 1.608 1.686 0.167 1.00 . A A . 5 ASP C 1 1
2 197 1 1 3 ASP CA C 2.131 0.214 0.176 1.00 . A A . 5 ASP CA 1 1
2 198 1 1 3 ASP CB C 2.653 -0.205 -1.227 1.00 . A A . 5 ASP CB 1 1
2 199 1 1 3 ASP CG C 3.756 -1.273 -1.208 1.00 . A A . 5 ASP CG 1 1
2 200 1 1 3 ASP H H 0.242 -0.924 -0.022 1.00 . A A . 5 ASP H 1 1
2 201 1 1 3 ASP HA H 2.979 0.152 0.892 1.00 . A A . 5 ASP HA 1 1
2 202 1 1 3 ASP HB2 H 1.816 -0.482 -1.897 1.00 . A A . 5 ASP HB2 1 1
2 203 1 1 3 ASP HB3 H 3.109 0.669 -1.726 1.00 . A A . 5 ASP HB3 1 1
2 204 1 1 3 ASP N N 1.059 -0.738 0.580 1.00 . A A . 5 ASP N 1 1
2 205 1 1 3 ASP O O 0.574 1.985 -0.441 1.00 . A A . 5 ASP O 1 1
2 206 1 1 3 ASP OD1 O 4.806 -1.046 -0.605 1.00 . A A . 5 ASP OD1 1 1
2 207 1 1 4 TRP C C 1.855 4.767 -0.512 1.00 . A A . 6 TRP C 1 1
2 208 1 1 4 TRP CA C 1.990 4.055 0.895 1.00 . A A . 6 TRP CA 1 1
2 209 1 1 4 TRP CB C 3.069 4.718 1.803 1.00 . A A . 6 TRP CB 1 1
2 210 1 1 4 TRP CD1 C 3.127 7.319 1.450 1.00 . A A . 6 TRP CD1 1 1
2 211 1 1 4 TRP CD2 C 2.085 6.650 3.299 1.00 . A A . 6 TRP CD2 1 1
2 212 1 1 4 TRP CE2 C 1.998 8.062 3.185 1.00 . A A . 6 TRP CE2 1 1
2 213 1 1 4 TRP CE3 C 1.446 5.978 4.371 1.00 . A A . 6 TRP CE3 1 1
2 214 1 1 4 TRP CG C 2.792 6.174 2.208 1.00 . A A . 6 TRP CG 1 1
2 215 1 1 4 TRP CH2 C 0.652 8.130 5.192 1.00 . A A . 6 TRP CH2 1 1
2 216 1 1 4 TRP CZ2 C 1.271 8.809 4.140 1.00 . A A . 6 TRP CZ2 1 1
2 217 1 1 4 TRP CZ3 C 0.739 6.738 5.306 1.00 . A A . 6 TRP CZ3 1 1
2 218 1 1 4 TRP H H 3.217 2.246 1.222 1.00 . A A . 6 TRP H 1 1
2 219 1 1 4 TRP HA H 1.025 4.111 1.432 1.00 . A A . 6 TRP HA 1 1
2 220 1 1 4 TRP HB2 H 3.195 4.130 2.733 1.00 . A A . 6 TRP HB2 1 1
2 221 1 1 4 TRP HB3 H 4.059 4.667 1.306 1.00 . A A . 6 TRP HB3 1 1
2 222 1 1 4 TRP HD1 H 3.609 7.285 0.483 1.00 . A A . 6 TRP HD1 1 1
2 223 1 1 4 TRP HE1 H 2.714 9.464 1.694 1.00 . A A . 6 TRP HE1 1 1
2 224 1 1 4 TRP HE3 H 1.496 4.904 4.462 1.00 . A A . 6 TRP HE3 1 1
2 225 1 1 4 TRP HH2 H 0.093 8.690 5.928 1.00 . A A . 6 TRP HH2 1 1
2 226 1 1 4 TRP HZ2 H 1.188 9.882 4.051 1.00 . A A . 6 TRP HZ2 1 1
2 227 1 1 4 TRP HZ3 H 0.246 6.242 6.129 1.00 . A A . 6 TRP HZ3 1 1
2 228 1 1 4 TRP N N 2.349 2.606 0.814 1.00 . A A . 6 TRP N 1 1
2 229 1 1 4 TRP NE1 N 2.644 8.502 2.042 1.00 . A A . 6 TRP NE1 1 1
2 230 1 1 4 TRP O O 2.736 4.552 -1.354 1.00 . A A . 6 TRP O 1 1
2 231 1 1 5 PRO C C -1.448 5.256 0.544 1.00 . A A . 7 PRO C 1 1
2 232 1 1 5 PRO CA C -0.194 6.121 0.159 1.00 . A A . 7 PRO CA 1 1
2 233 1 1 5 PRO CB C -0.563 7.452 -0.526 1.00 . A A . 7 PRO CB 1 1
2 234 1 1 5 PRO CD C 0.708 6.233 -2.156 1.00 . A A . 7 PRO CD 1 1
2 235 1 1 5 PRO CG C -0.499 7.161 -2.027 1.00 . A A . 7 PRO CG 1 1
2 236 1 1 5 PRO HA H 0.287 6.374 1.118 1.00 . A A . 7 PRO HA 1 1
2 237 1 1 5 PRO HB2 H -1.543 7.855 -0.208 1.00 . A A . 7 PRO HB2 1 1
2 238 1 1 5 PRO HB3 H 0.182 8.228 -0.259 1.00 . A A . 7 PRO HB3 1 1
2 239 1 1 5 PRO HD2 H 0.574 5.484 -2.962 1.00 . A A . 7 PRO HD2 1 1
2 240 1 1 5 PRO HD3 H 1.628 6.807 -2.385 1.00 . A A . 7 PRO HD3 1 1
2 241 1 1 5 PRO HG2 H -1.419 6.642 -2.358 1.00 . A A . 7 PRO HG2 1 1
2 242 1 1 5 PRO HG3 H -0.401 8.077 -2.639 1.00 . A A . 7 PRO HG3 1 1
2 243 1 1 5 PRO N N 0.810 5.595 -0.826 1.00 . A A . 7 PRO N 1 1
2 244 1 1 5 PRO O O -2.323 5.741 1.266 1.00 . A A . 7 PRO O 1 1
2 245 1 1 6 . C C -3.135 2.264 -0.791 1.00 . A A . 8 4J2 C 1 1
2 246 1 1 6 . CA C -2.608 3.035 0.464 1.00 . A A . 8 4J2 CA 1 1
2 247 1 1 6 . CB C -2.116 2.001 1.526 1.00 . A A . 8 4J2 CB 1 1
2 248 1 1 6 . CD1 C -2.464 3.249 3.710 1.00 . A A . 8 4J2 CD1 1 1
2 249 1 1 6 . CD2 C -0.379 2.081 3.372 1.00 . A A . 8 4J2 CD2 1 1
2 250 1 1 6 . CE1 C -2.076 3.606 4.999 1.00 . A A . 8 4J2 CE1 1 1
2 251 1 1 6 . CE2 C 0.033 2.414 4.660 1.00 . A A . 8 4J2 CE2 1 1
2 252 1 1 6 . CE3 C 1.271 2.000 5.153 1.00 . A A . 8 4J2 CE3 1 1
2 253 1 1 6 . CE4 C 1.657 2.346 6.443 1.00 . A A . 8 4J2 CE4 1 1
2 254 1 1 6 . CG C -1.625 2.491 2.896 1.00 . A A . 8 4J2 CG 1 1
2 255 1 1 6 . CZ1 C -0.840 3.192 5.496 1.00 . A A . 8 4J2 CZ1 1 1
2 256 1 1 6 . CZ2 C -0.430 3.516 6.791 1.00 . A A . 8 4J2 CZ2 1 1
2 257 1 1 6 . CZ3 C 0.814 3.098 7.257 1.00 . A A . 8 4J2 CZ3 1 1
2 258 1 1 6 . H H -0.677 3.687 -0.399 1.00 . A A . 8 4J2 H 1 1
2 259 1 1 6 . HA H -3.480 3.579 0.879 1.00 . A A . 8 4J2 HA 1 1
2 260 1 1 6 . HB1 H -1.335 1.365 1.070 1.00 . A A . 8 4J2 HB1 1 1
2 261 1 1 6 . HB2 H -2.931 1.283 1.710 1.00 . A A . 8 4J2 HB2 1 1
2 262 1 1 6 . HD1 H -3.427 3.543 3.325 1.00 . A A . 8 4J2 HD1 1 1
2 263 1 1 6 . HD2 H 0.252 1.473 2.741 1.00 . A A . 8 4J2 HD2 1 1
2 264 1 1 6 . HE1 H -2.753 4.194 5.604 1.00 . A A . 8 4J2 HE1 1 1
2 265 1 1 6 . HE3 H 1.942 1.407 4.545 1.00 . A A . 8 4J2 HE3 1 1
2 266 1 1 6 . HE4 H 2.618 2.024 6.819 1.00 . A A . 8 4J2 HE4 1 1
2 267 1 1 6 . HZ2 H -1.065 4.097 7.445 1.00 . A A . 8 4J2 HZ2 1 1
2 268 1 1 6 . HZ23 H 1.126 3.356 8.259 1.00 . A A . 8 4J2 HZ23 1 1
2 269 1 1 6 . N N -1.516 3.991 0.112 1.00 . A A . 8 4J2 N 1 1
2 270 1 1 6 . O O -4.341 2.211 -1.038 1.00 . A A . 8 4J2 O 1 1
2 271 1 1 7 ARG C C -2.094 -0.851 -1.943 1.00 . A A . 9 ARG C 1 1
2 272 1 1 7 ARG CA C -2.520 0.544 -2.501 1.00 . A A . 9 ARG CA 1 1
2 273 1 1 7 ARG CB C -1.812 0.911 -3.832 1.00 . A A . 9 ARG CB 1 1
2 274 1 1 7 ARG CD C 0.343 1.501 -5.178 1.00 . A A . 9 ARG CD 1 1
2 275 1 1 7 ARG CG C -0.259 1.004 -3.848 1.00 . A A . 9 ARG CG 1 1
2 276 1 1 7 ARG CZ C -0.649 3.630 -6.084 1.00 . A A . 9 ARG CZ 1 1
2 277 1 1 7 ARG H H -1.274 1.671 -1.126 1.00 . A A . 9 ARG H 1 1
2 278 1 1 7 ARG HA H -3.611 0.519 -2.703 1.00 . A A . 9 ARG HA 1 1
2 279 1 1 7 ARG HB2 H -2.118 0.174 -4.585 1.00 . A A . 9 ARG HB2 1 1
2 280 1 1 7 ARG HB3 H -2.245 1.862 -4.189 1.00 . A A . 9 ARG HB3 1 1
2 281 1 1 7 ARG HD2 H 1.422 1.256 -5.186 1.00 . A A . 9 ARG HD2 1 1
2 282 1 1 7 ARG HD3 H -0.065 0.943 -6.043 1.00 . A A . 9 ARG HD3 1 1
2 283 1 1 7 ARG HG2 H 0.101 1.656 -3.028 1.00 . A A . 9 ARG HG2 1 1
2 284 1 1 7 ARG HG3 H 0.159 0.005 -3.618 1.00 . A A . 9 ARG HG3 1 1
2 285 1 1 7 ARG HH11 H -1.574 2.038 -6.745 1.00 . A A . 9 ARG HH11 1 1
2 286 1 1 7 ARG HH12 H -2.189 3.667 -7.347 1.00 . A A . 9 ARG HH12 1 1
2 287 1 1 7 ARG HH21 H 0.192 5.271 -5.520 1.00 . A A . 9 ARG HH21 1 1
2 288 1 1 7 ARG HH22 H -1.237 5.433 -6.681 1.00 . A A . 9 ARG HH22 1 1
2 289 1 1 7 ARG N N -2.219 1.604 -1.518 1.00 . A A . 9 ARG N 1 1
2 290 1 1 7 ARG NE N 0.232 2.978 -5.326 1.00 . A A . 9 ARG NE 1 1
2 291 1 1 7 ARG NH1 N -1.573 3.057 -6.809 1.00 . A A . 9 ARG NH1 1 1
2 292 1 1 7 ARG NH2 N -0.577 4.922 -6.096 1.00 . A A . 9 ARG NH2 1 1
2 293 1 1 7 ARG O O -1.156 -0.981 -1.146 1.00 . A A . 9 ARG O 1 1
2 294 1 1 8 TRP C C -1.302 -3.914 -2.852 1.00 . A A . 10 TRP C 1 1
2 295 1 1 8 TRP CA C -2.447 -3.300 -1.979 1.00 . A A . 10 TRP CA 1 1
2 296 1 1 8 TRP CB C -3.772 -4.102 -2.015 1.00 . A A . 10 TRP CB 1 1
2 297 1 1 8 TRP CD1 C -3.615 -6.677 -2.243 1.00 . A A . 10 TRP CD1 1 1
2 298 1 1 8 TRP CD2 C -3.508 -5.937 -0.153 1.00 . A A . 10 TRP CD2 1 1
2 299 1 1 8 TRP CE2 C -3.358 -7.345 -0.161 1.00 . A A . 10 TRP CE2 1 1
2 300 1 1 8 TRP CE3 C -3.448 -5.210 1.061 1.00 . A A . 10 TRP CE3 1 1
2 301 1 1 8 TRP CG C -3.663 -5.519 -1.458 1.00 . A A . 10 TRP CG 1 1
2 302 1 1 8 TRP CH2 C -3.096 -7.310 2.244 1.00 . A A . 10 TRP CH2 1 1
2 303 1 1 8 TRP CZ2 C -3.147 -8.040 1.053 1.00 . A A . 10 TRP CZ2 1 1
2 304 1 1 8 TRP CZ3 C -3.246 -5.916 2.247 1.00 . A A . 10 TRP CZ3 1 1
2 305 1 1 8 TRP H H -3.404 -1.714 -3.174 1.00 . A A . 10 TRP H 1 1
2 306 1 1 8 TRP HA H -2.118 -3.282 -0.918 1.00 . A A . 10 TRP HA 1 1
2 307 1 1 8 TRP HB2 H -4.554 -3.582 -1.435 1.00 . A A . 10 TRP HB2 1 1
2 308 1 1 8 TRP HB3 H -4.163 -4.139 -3.047 1.00 . A A . 10 TRP HB3 1 1
2 309 1 1 8 TRP HD1 H -3.682 -6.632 -3.320 1.00 . A A . 10 TRP HD1 1 1
2 310 1 1 8 TRP HE1 H -3.372 -8.812 -1.765 1.00 . A A . 10 TRP HE1 1 1
2 311 1 1 8 TRP HE3 H -3.529 -4.132 1.058 1.00 . A A . 10 TRP HE3 1 1
2 312 1 1 8 TRP HH2 H -2.932 -7.829 3.178 1.00 . A A . 10 TRP HH2 1 1
2 313 1 1 8 TRP HZ2 H -3.024 -9.113 1.058 1.00 . A A . 10 TRP HZ2 1 1
2 314 1 1 8 TRP HZ3 H -3.188 -5.374 3.178 1.00 . A A . 10 TRP HZ3 1 1
2 315 1 1 8 TRP N N -2.776 -1.911 -2.390 1.00 . A A . 10 TRP N 1 1
2 316 1 1 8 TRP NE1 N -3.420 -7.834 -1.460 1.00 . A A . 10 TRP NE1 1 1
2 317 1 1 8 TRP O O -1.283 -3.792 -4.081 1.00 . A A . 10 TRP O 1 1
2 318 1 1 9 LYS C C 0.576 -6.514 -3.653 1.00 . A A . 11 LYS C 1 1
2 319 1 1 9 LYS CA C 0.830 -5.202 -2.836 1.00 . A A . 11 LYS CA 1 1
2 320 1 1 9 LYS CB C 1.844 -5.364 -1.671 1.00 . A A . 11 LYS CB 1 1
2 321 1 1 9 LYS CD C 4.103 -4.674 -2.822 1.00 . A A . 11 LYS CD 1 1
2 322 1 1 9 LYS CE C 4.568 -3.457 -1.998 1.00 . A A . 11 LYS CE 1 1
2 323 1 1 9 LYS CG C 3.284 -5.742 -2.059 1.00 . A A . 11 LYS CG 1 1
2 324 1 1 9 LYS H H -0.430 -4.604 -1.160 1.00 . A A . 11 LYS H 1 1
2 325 1 1 9 LYS HA H 1.251 -4.465 -3.544 1.00 . A A . 11 LYS HA 1 1
2 326 1 1 9 LYS HB2 H 1.893 -4.444 -1.055 1.00 . A A . 11 LYS HB2 1 1
2 327 1 1 9 LYS HB3 H 1.463 -6.134 -0.974 1.00 . A A . 11 LYS HB3 1 1
2 328 1 1 9 LYS HD2 H 5.015 -5.179 -3.197 1.00 . A A . 11 LYS HD2 1 1
2 329 1 1 9 LYS HD3 H 3.583 -4.355 -3.746 1.00 . A A . 11 LYS HD3 1 1
2 330 1 1 9 LYS HE2 H 4.903 -3.781 -0.991 1.00 . A A . 11 LYS HE2 1 1
2 331 1 1 9 LYS HE3 H 5.471 -3.027 -2.477 1.00 . A A . 11 LYS HE3 1 1
2 332 1 1 9 LYS HG2 H 3.820 -6.017 -1.131 1.00 . A A . 11 LYS HG2 1 1
2 333 1 1 9 LYS HG3 H 3.247 -6.671 -2.655 1.00 . A A . 11 LYS HG3 1 1
2 334 1 1 9 LYS HZ1 H 2.612 -2.476 -2.322 1.00 . A A . 11 LYS HZ1 1 1
2 335 1 1 9 LYS N N -0.361 -4.602 -2.190 1.00 . A A . 11 LYS N 1 1
2 336 1 1 9 LYS NZ N 3.537 -2.401 -1.889 1.00 . A A . 11 LYS NZ 1 1
2 337 1 1 9 LYS O O 1.079 -6.676 -4.760 1.00 . A A . 11 LYS O 1 1
2 338 1 1 10 NH2 HN1 H -0.299 -8.265 -3.843 1.00 . A A . 12 NH2 HN1 1 1
2 339 1 1 10 NH2 HN2 H -0.709 -7.292 -2.333 1.00 . A A . 12 NH2 HN2 1 1
2 340 1 1 10 NH2 N N -0.164 -7.502 -3.176 1.00 . A A . 12 NH2 N 1 1
3 341 1 1 1 ACE C C 0.562 -4.637 1.352 1.00 . A A . 3 ACE C 1 1
3 342 1 1 1 ACE CH3 C 1.121 -5.883 2.014 1.00 . A A . 3 ACE CH3 1 1
3 343 1 1 1 ACE H1 H 0.416 -6.289 2.761 1.00 . A A . 3 ACE H1 1 1
3 344 1 1 1 ACE H2 H 1.304 -6.675 1.267 1.00 . A A . 3 ACE H2 1 1
3 345 1 1 1 ACE H3 H 2.085 -5.680 2.516 1.00 . A A . 3 ACE H3 1 1
3 346 1 1 1 ACE O O 0.269 -4.637 0.156 1.00 . A A . 3 ACE O 1 1
3 347 1 1 2 NLE C C 1.129 -1.271 1.506 1.00 . A A . 4 NLE C 1 1
3 348 1 1 2 NLE CA C -0.067 -2.263 1.701 1.00 . A A . 4 NLE CA 1 1
3 349 1 1 2 NLE CB C -1.043 -1.658 2.740 1.00 . A A . 4 NLE CB 1 1
3 350 1 1 2 NLE CD C -3.265 -1.647 4.066 1.00 . A A . 4 NLE CD 1 1
3 351 1 1 2 NLE CE C -2.717 -1.567 5.499 1.00 . A A . 4 NLE CE 1 1
3 352 1 1 2 NLE CG C -2.354 -2.402 3.076 1.00 . A A . 4 NLE CG 1 1
3 353 1 1 2 NLE H H 0.710 -3.739 3.130 1.00 . A A . 4 NLE H 1 1
3 354 1 1 2 NLE HA H -0.628 -2.371 0.750 1.00 . A A . 4 NLE HA 1 1
3 355 1 1 2 NLE HB2 H -1.347 -0.677 2.355 1.00 . A A . 4 NLE HB2 1 1
3 356 1 1 2 NLE HB3 H -0.482 -1.438 3.665 1.00 . A A . 4 NLE HB3 1 1
3 357 1 1 2 NLE HD2 H -4.253 -2.146 4.093 1.00 . A A . 4 NLE HD2 1 1
3 358 1 1 2 NLE HD3 H -3.473 -0.625 3.689 1.00 . A A . 4 NLE HD3 1 1
3 359 1 1 2 NLE HE1 H -1.782 -0.978 5.552 1.00 . A A . 4 NLE HE1 1 1
3 360 1 1 2 NLE HE2 H -3.440 -1.076 6.176 1.00 . A A . 4 NLE HE2 1 1
3 361 1 1 2 NLE HE3 H -2.505 -2.570 5.914 1.00 . A A . 4 NLE HE3 1 1
3 362 1 1 2 NLE HG2 H -2.138 -3.416 3.462 1.00 . A A . 4 NLE HG2 1 1
3 363 1 1 2 NLE HG3 H -2.924 -2.547 2.143 1.00 . A A . 4 NLE HG3 1 1
3 364 1 1 2 NLE N N 0.412 -3.591 2.164 1.00 . A A . 4 NLE N 1 1
3 365 1 1 2 NLE O O 1.947 -1.066 2.410 1.00 . A A . 4 NLE O 1 1
3 366 1 1 3 ASP C C 1.643 1.856 0.185 1.00 . A A . 5 ASP C 1 1
3 367 1 1 3 ASP CA C 2.220 0.415 0.029 1.00 . A A . 5 ASP CA 1 1
3 368 1 1 3 ASP CB C 2.725 0.179 -1.420 1.00 . A A . 5 ASP CB 1 1
3 369 1 1 3 ASP CG C 3.646 -1.038 -1.594 1.00 . A A . 5 ASP CG 1 1
3 370 1 1 3 ASP H H 0.396 -0.806 -0.293 1.00 . A A . 5 ASP H 1 1
3 371 1 1 3 ASP HA H 3.093 0.303 0.707 1.00 . A A . 5 ASP HA 1 1
3 372 1 1 3 ASP HB2 H 1.867 0.154 -2.120 1.00 . A A . 5 ASP HB2 1 1
3 373 1 1 3 ASP HB3 H 3.317 1.052 -1.743 1.00 . A A . 5 ASP HB3 1 1
3 374 1 1 3 ASP N N 1.183 -0.606 0.345 1.00 . A A . 5 ASP N 1 1
3 375 1 1 3 ASP O O 0.671 2.217 -0.487 1.00 . A A . 5 ASP O 1 1
3 376 1 1 3 ASP OD1 O 4.637 -1.175 -0.877 1.00 . A A . 5 ASP OD1 1 1
3 377 1 1 4 TRP C C 1.773 5.019 0.043 1.00 . A A . 6 TRP C 1 1
3 378 1 1 4 TRP CA C 1.813 4.086 1.321 1.00 . A A . 6 TRP CA 1 1
3 379 1 1 4 TRP CB C 2.754 4.638 2.434 1.00 . A A . 6 TRP CB 1 1
3 380 1 1 4 TRP CD1 C 2.693 7.264 2.494 1.00 . A A . 6 TRP CD1 1 1
3 381 1 1 4 TRP CD2 C 1.523 6.267 4.103 1.00 . A A . 6 TRP CD2 1 1
3 382 1 1 4 TRP CE2 C 1.364 7.673 4.198 1.00 . A A . 6 TRP CE2 1 1
3 383 1 1 4 TRP CE3 C 0.830 5.408 4.992 1.00 . A A . 6 TRP CE3 1 1
3 384 1 1 4 TRP CG C 2.355 5.999 3.029 1.00 . A A . 6 TRP CG 1 1
3 385 1 1 4 TRP CH2 C -0.162 7.365 6.048 1.00 . A A . 6 TRP CH2 1 1
3 386 1 1 4 TRP CZ2 C 0.510 8.227 5.178 1.00 . A A . 6 TRP CZ2 1 1
3 387 1 1 4 TRP CZ3 C -0.003 5.977 5.956 1.00 . A A . 6 TRP CZ3 1 1
3 388 1 1 4 TRP H H 3.078 2.283 1.519 1.00 . A A . 6 TRP H 1 1
3 389 1 1 4 TRP HA H 0.797 4.010 1.751 1.00 . A A . 6 TRP HA 1 1
3 390 1 1 4 TRP HB2 H 2.817 3.913 3.270 1.00 . A A . 6 TRP HB2 1 1
3 391 1 1 4 TRP HB3 H 3.788 4.707 2.048 1.00 . A A . 6 TRP HB3 1 1
3 392 1 1 4 TRP HD1 H 3.267 7.403 1.588 1.00 . A A . 6 TRP HD1 1 1
3 393 1 1 4 TRP HE1 H 2.136 9.324 3.023 1.00 . A A . 6 TRP HE1 1 1
3 394 1 1 4 TRP HE3 H 0.939 4.337 4.923 1.00 . A A . 6 TRP HE3 1 1
3 395 1 1 4 TRP HH2 H -0.819 7.776 6.802 1.00 . A A . 6 TRP HH2 1 1
3 396 1 1 4 TRP HZ2 H 0.372 9.297 5.248 1.00 . A A . 6 TRP HZ2 1 1
3 397 1 1 4 TRP HZ3 H -0.538 5.335 6.639 1.00 . A A . 6 TRP HZ3 1 1
3 398 1 1 4 TRP N N 2.260 2.685 1.050 1.00 . A A . 6 TRP N 1 1
3 399 1 1 4 TRP NE1 N 2.088 8.316 3.209 1.00 . A A . 6 TRP NE1 1 1
3 400 1 1 4 TRP O O 2.744 4.988 -0.723 1.00 . A A . 6 TRP O 1 1
3 401 1 1 5 PRO C C -1.644 5.159 0.776 1.00 . A A . 7 PRO C 1 1
3 402 1 1 5 PRO CA C -0.416 6.134 0.701 1.00 . A A . 7 PRO CA 1 1
3 403 1 1 5 PRO CB C -0.794 7.558 0.242 1.00 . A A . 7 PRO CB 1 1
3 404 1 1 5 PRO CD C 0.734 6.741 -1.415 1.00 . A A . 7 PRO CD 1 1
3 405 1 1 5 PRO CG C -0.539 7.572 -1.266 1.00 . A A . 7 PRO CG 1 1
3 406 1 1 5 PRO HA H -0.057 6.220 1.740 1.00 . A A . 7 PRO HA 1 1
3 407 1 1 5 PRO HB2 H -1.828 7.846 0.506 1.00 . A A . 7 PRO HB2 1 1
3 408 1 1 5 PRO HB3 H -0.139 8.298 0.743 1.00 . A A . 7 PRO HB3 1 1
3 409 1 1 5 PRO HD2 H 0.750 6.174 -2.366 1.00 . A A . 7 PRO HD2 1 1
3 410 1 1 5 PRO HD3 H 1.633 7.388 -1.400 1.00 . A A . 7 PRO HD3 1 1
3 411 1 1 5 PRO HG2 H -1.380 7.089 -1.803 1.00 . A A . 7 PRO HG2 1 1
3 412 1 1 5 PRO HG3 H -0.433 8.593 -1.675 1.00 . A A . 7 PRO HG3 1 1
3 413 1 1 5 PRO N N 0.718 5.847 -0.237 1.00 . A A . 7 PRO N 1 1
3 414 1 1 5 PRO O O -2.615 5.467 1.472 1.00 . A A . 7 PRO O 1 1
3 415 1 1 6 . C C -2.985 2.270 -1.125 1.00 . A A . 8 4J2 C 1 1
3 416 1 1 6 . CA C -2.628 2.919 0.252 1.00 . A A . 8 4J2 CA 1 1
3 417 1 1 6 . CB C -2.160 1.805 1.242 1.00 . A A . 8 4J2 CB 1 1
3 418 1 1 6 . CD1 C -2.948 2.658 3.497 1.00 . A A . 8 4J2 CD1 1 1
3 419 1 1 6 . CD2 C -0.698 1.803 3.313 1.00 . A A . 8 4J2 CD2 1 1
3 420 1 1 6 . CE1 C -2.796 2.819 4.871 1.00 . A A . 8 4J2 CE1 1 1
3 421 1 1 6 . CE2 C -0.526 1.923 4.689 1.00 . A A . 8 4J2 CE2 1 1
3 422 1 1 6 . CE3 C 0.661 1.526 5.307 1.00 . A A . 8 4J2 CE3 1 1
3 423 1 1 6 . CE4 C 0.803 1.652 6.686 1.00 . A A . 8 4J2 CE4 1 1
3 424 1 1 6 . CG C -1.913 2.149 2.717 1.00 . A A . 8 4J2 CG 1 1
3 425 1 1 6 . CZ1 C -1.600 2.448 5.489 1.00 . A A . 8 4J2 CZ1 1 1
3 426 1 1 6 . CZ2 C -1.429 2.558 6.870 1.00 . A A . 8 4J2 CZ2 1 1
3 427 1 1 6 . CZ3 C -0.233 2.165 7.461 1.00 . A A . 8 4J2 CZ3 1 1
3 428 1 1 6 . H H -0.687 3.805 -0.325 1.00 . A A . 8 4J2 H 1 1
3 429 1 1 6 . HA H -3.576 3.349 0.635 1.00 . A A . 8 4J2 HA 1 1
3 430 1 1 6 . HB1 H -1.262 1.313 0.826 1.00 . A A . 8 4J2 HB1 1 1
3 431 1 1 6 . HB2 H -2.906 0.991 1.227 1.00 . A A . 8 4J2 HB2 1 1
3 432 1 1 6 . HD1 H -3.883 2.905 3.017 1.00 . A A . 8 4J2 HD1 1 1
3 433 1 1 6 . HD2 H 0.087 1.382 2.702 1.00 . A A . 8 4J2 HD2 1 1
3 434 1 1 6 . HE1 H -3.622 3.213 5.446 1.00 . A A . 8 4J2 HE1 1 1
3 435 1 1 6 . HE3 H 1.479 1.117 4.729 1.00 . A A . 8 4J2 HE3 1 1
3 436 1 1 6 . HE4 H 1.727 1.346 7.159 1.00 . A A . 8 4J2 HE4 1 1
3 437 1 1 6 . HZ2 H -2.220 2.947 7.498 1.00 . A A . 8 4J2 HZ2 1 1
3 438 1 1 6 . HZ23 H -0.107 2.255 8.531 1.00 . A A . 8 4J2 HZ23 1 1
3 439 1 1 6 . N N -1.593 3.986 0.128 1.00 . A A . 8 4J2 N 1 1
3 440 1 1 6 . O O -4.158 2.221 -1.502 1.00 . A A . 8 4J2 O 1 1
3 441 1 1 7 ARG C C -1.890 -0.761 -2.251 1.00 . A A . 9 ARG C 1 1
3 442 1 1 7 ARG CA C -2.194 0.652 -2.849 1.00 . A A . 9 ARG CA 1 1
3 443 1 1 7 ARG CB C -1.272 1.018 -4.038 1.00 . A A . 9 ARG CB 1 1
3 444 1 1 7 ARG CD C -2.659 0.199 -6.111 1.00 . A A . 9 ARG CD 1 1
3 445 1 1 7 ARG CG C -1.345 0.130 -5.303 1.00 . A A . 9 ARG CG 1 1
3 446 1 1 7 ARG CZ C -4.939 -0.438 -5.245 1.00 . A A . 9 ARG CZ 1 1
3 447 1 1 7 ARG H H -1.082 1.753 -1.330 1.00 . A A . 9 ARG H 1 1
3 448 1 1 7 ARG HA H -3.244 0.682 -3.205 1.00 . A A . 9 ARG HA 1 1
3 449 1 1 7 ARG HB2 H -1.470 2.062 -4.343 1.00 . A A . 9 ARG HB2 1 1
3 450 1 1 7 ARG HB3 H -0.224 1.014 -3.683 1.00 . A A . 9 ARG HB3 1 1
3 451 1 1 7 ARG HD2 H -3.009 1.246 -6.192 1.00 . A A . 9 ARG HD2 1 1
3 452 1 1 7 ARG HD3 H -2.447 -0.100 -7.156 1.00 . A A . 9 ARG HD3 1 1
3 453 1 1 7 ARG HG2 H -0.520 0.459 -5.961 1.00 . A A . 9 ARG HG2 1 1
3 454 1 1 7 ARG HG3 H -1.093 -0.919 -5.055 1.00 . A A . 9 ARG HG3 1 1
3 455 1 1 7 ARG HH11 H -4.795 1.492 -5.572 1.00 . A A . 9 ARG HH11 1 1
3 456 1 1 7 ARG HH12 H -6.414 0.867 -4.962 1.00 . A A . 9 ARG HH12 1 1
3 457 1 1 7 ARG HH21 H -5.232 -2.319 -4.923 1.00 . A A . 9 ARG HH21 1 1
3 458 1 1 7 ARG HH22 H -6.662 -1.194 -4.609 1.00 . A A . 9 ARG HH22 1 1
3 459 1 1 7 ARG N N -1.985 1.693 -1.817 1.00 . A A . 9 ARG N 1 1
3 460 1 1 7 ARG NE N -3.688 -0.743 -5.591 1.00 . A A . 9 ARG NE 1 1
3 461 1 1 7 ARG NH1 N -5.446 0.766 -5.267 1.00 . A A . 9 ARG NH1 1 1
3 462 1 1 7 ARG NH2 N -5.695 -1.411 -4.855 1.00 . A A . 9 ARG NH2 1 1
3 463 1 1 7 ARG O O -1.022 -0.939 -1.388 1.00 . A A . 9 ARG O 1 1
3 464 1 1 8 TRP C C -1.519 -3.992 -3.250 1.00 . A A . 10 TRP C 1 1
3 465 1 1 8 TRP CA C -2.448 -3.176 -2.295 1.00 . A A . 10 TRP CA 1 1
3 466 1 1 8 TRP CB C -3.872 -3.782 -2.167 1.00 . A A . 10 TRP CB 1 1
3 467 1 1 8 TRP CD1 C -4.230 -6.318 -2.587 1.00 . A A . 10 TRP CD1 1 1
3 468 1 1 8 TRP CD2 C -3.563 -5.823 -0.531 1.00 . A A . 10 TRP CD2 1 1
3 469 1 1 8 TRP CE2 C -3.654 -7.230 -0.668 1.00 . A A . 10 TRP CE2 1 1
3 470 1 1 8 TRP CE3 C -3.081 -5.246 0.666 1.00 . A A . 10 TRP CE3 1 1
3 471 1 1 8 TRP CG C -3.927 -5.249 -1.730 1.00 . A A . 10 TRP CG 1 1
3 472 1 1 8 TRP CH2 C -2.795 -7.484 1.580 1.00 . A A . 10 TRP CH2 1 1
3 473 1 1 8 TRP CZ2 C -3.260 -8.071 0.400 1.00 . A A . 10 TRP CZ2 1 1
3 474 1 1 8 TRP CZ3 C -2.708 -6.091 1.710 1.00 . A A . 10 TRP CZ3 1 1
3 475 1 1 8 TRP H H -3.060 -1.524 -3.640 1.00 . A A . 10 TRP H 1 1
3 476 1 1 8 TRP HA H -2.020 -3.186 -1.271 1.00 . A A . 10 TRP HA 1 1
3 477 1 1 8 TRP HB2 H -4.471 -3.193 -1.453 1.00 . A A . 10 TRP HB2 1 1
3 478 1 1 8 TRP HB3 H -4.398 -3.680 -3.131 1.00 . A A . 10 TRP HB3 1 1
3 479 1 1 8 TRP HD1 H -4.471 -6.162 -3.628 1.00 . A A . 10 TRP HD1 1 1
3 480 1 1 8 TRP HE1 H -4.148 -8.503 -2.356 1.00 . A A . 10 TRP HE1 1 1
3 481 1 1 8 TRP HE3 H -2.982 -4.176 0.745 1.00 . A A . 10 TRP HE3 1 1
3 482 1 1 8 TRP HH2 H -2.489 -8.114 2.403 1.00 . A A . 10 TRP HH2 1 1
3 483 1 1 8 TRP HZ2 H -3.308 -9.145 0.299 1.00 . A A . 10 TRP HZ2 1 1
3 484 1 1 8 TRP HZ3 H -2.327 -5.656 2.624 1.00 . A A . 10 TRP HZ3 1 1
3 485 1 1 8 TRP N N -2.610 -1.771 -2.745 1.00 . A A . 10 TRP N 1 1
3 486 1 1 8 TRP NE1 N -4.078 -7.565 -1.946 1.00 . A A . 10 TRP NE1 1 1
3 487 1 1 8 TRP O O -1.741 -4.073 -4.461 1.00 . A A . 10 TRP O 1 1
3 488 1 1 9 LYS C C -0.089 -7.153 -2.675 1.00 . A A . 11 LYS C 1 1
3 489 1 1 9 LYS CA C 0.240 -5.758 -3.302 1.00 . A A . 11 LYS CA 1 1
3 490 1 1 9 LYS CB C 1.746 -5.396 -3.234 1.00 . A A . 11 LYS CB 1 1
3 491 1 1 9 LYS CD C 3.655 -3.844 -4.103 1.00 . A A . 11 LYS CD 1 1
3 492 1 1 9 LYS CE C 4.063 -3.153 -2.787 1.00 . A A . 11 LYS CE 1 1
3 493 1 1 9 LYS CG C 2.181 -4.286 -4.223 1.00 . A A . 11 LYS CG 1 1
3 494 1 1 9 LYS H H -0.399 -4.459 -1.650 1.00 . A A . 11 LYS H 1 1
3 495 1 1 9 LYS HA H -0.027 -5.849 -4.372 1.00 . A A . 11 LYS HA 1 1
3 496 1 1 9 LYS HB2 H 2.003 -5.114 -2.195 1.00 . A A . 11 LYS HB2 1 1
3 497 1 1 9 LYS HB3 H 2.343 -6.300 -3.439 1.00 . A A . 11 LYS HB3 1 1
3 498 1 1 9 LYS HD2 H 4.308 -4.722 -4.262 1.00 . A A . 11 LYS HD2 1 1
3 499 1 1 9 LYS HD3 H 3.893 -3.167 -4.946 1.00 . A A . 11 LYS HD3 1 1
3 500 1 1 9 LYS HE2 H 3.912 -3.842 -1.934 1.00 . A A . 11 LYS HE2 1 1
3 501 1 1 9 LYS HE3 H 5.151 -2.948 -2.818 1.00 . A A . 11 LYS HE3 1 1
3 502 1 1 9 LYS HG2 H 2.004 -4.634 -5.257 1.00 . A A . 11 LYS HG2 1 1
3 503 1 1 9 LYS HG3 H 1.528 -3.400 -4.102 1.00 . A A . 11 LYS HG3 1 1
3 504 1 1 9 LYS HZ1 H 2.447 -1.676 -3.053 1.00 . A A . 11 LYS HZ1 1 1
3 505 1 1 9 LYS N N -0.534 -4.669 -2.648 1.00 . A A . 11 LYS N 1 1
3 506 1 1 9 LYS NZ N 3.315 -1.898 -2.558 1.00 . A A . 11 LYS NZ 1 1
3 507 1 1 9 LYS O O -0.481 -8.086 -3.370 1.00 . A A . 11 LYS O 1 1
3 508 1 1 10 NH2 HN1 H 0.188 -6.555 -0.789 1.00 . A A . 12 NH2 HN1 1 1
3 509 1 1 10 NH2 HN2 H -0.314 -8.299 -1.097 1.00 . A A . 12 NH2 HN2 1 1
3 510 1 1 10 NH2 N N 0.048 -7.385 -1.378 1.00 . A A . 12 NH2 N 1 1
4 511 1 1 1 ACE C C 0.790 -4.428 2.695 1.00 . A A . 3 ACE C 1 1
4 512 1 1 1 ACE CH3 C 0.854 -4.728 1.203 1.00 . A A . 3 ACE CH3 1 1
4 513 1 1 1 ACE H1 H 1.424 -5.656 1.022 1.00 . A A . 3 ACE H1 1 1
4 514 1 1 1 ACE H2 H -0.162 -4.875 0.799 1.00 . A A . 3 ACE H2 1 1
4 515 1 1 1 ACE H3 H 1.353 -3.913 0.651 1.00 . A A . 3 ACE H3 1 1
4 516 1 1 1 ACE O O 1.120 -5.292 3.500 1.00 . A A . 3 ACE O 1 1
4 517 1 1 2 NLE C C 1.016 -1.086 2.029 1.00 . A A . 4 NLE C 1 1
4 518 1 1 2 NLE CA C -0.115 -2.102 2.402 1.00 . A A . 4 NLE CA 1 1
4 519 1 1 2 NLE CB C -1.297 -1.441 3.163 1.00 . A A . 4 NLE CB 1 1
4 520 1 1 2 NLE CD C -2.311 -0.323 5.283 1.00 . A A . 4 NLE CD 1 1
4 521 1 1 2 NLE CE C -3.465 -1.284 5.607 1.00 . A A . 4 NLE CE 1 1
4 522 1 1 2 NLE CG C -1.088 -1.003 4.640 1.00 . A A . 4 NLE CG 1 1
4 523 1 1 2 NLE H H 0.372 -3.251 4.212 1.00 . A A . 4 NLE H 1 1
4 524 1 1 2 NLE HA H -0.567 -2.480 1.461 1.00 . A A . 4 NLE HA 1 1
4 525 1 1 2 NLE HB2 H -2.158 -2.126 3.109 1.00 . A A . 4 NLE HB2 1 1
4 526 1 1 2 NLE HB3 H -1.629 -0.563 2.584 1.00 . A A . 4 NLE HB3 1 1
4 527 1 1 2 NLE HD2 H -2.676 0.497 4.639 1.00 . A A . 4 NLE HD2 1 1
4 528 1 1 2 NLE HD3 H -1.990 0.176 6.219 1.00 . A A . 4 NLE HD3 1 1
4 529 1 1 2 NLE HE1 H -3.142 -2.099 6.281 1.00 . A A . 4 NLE HE1 1 1
4 530 1 1 2 NLE HE2 H -4.295 -0.753 6.108 1.00 . A A . 4 NLE HE2 1 1
4 531 1 1 2 NLE HE3 H -3.883 -1.751 4.696 1.00 . A A . 4 NLE HE3 1 1
4 532 1 1 2 NLE HG2 H -0.228 -0.309 4.689 1.00 . A A . 4 NLE HG2 1 1
4 533 1 1 2 NLE HG3 H -0.784 -1.864 5.264 1.00 . A A . 4 NLE HG3 1 1
4 534 1 1 2 NLE N N 0.373 -3.266 3.191 1.00 . A A . 4 NLE N 1 1
4 535 1 1 2 NLE O O 1.776 -0.610 2.879 1.00 . A A . 4 NLE O 1 1
4 536 1 1 3 ASP C C 1.589 1.665 0.160 1.00 . A A . 5 ASP C 1 1
4 537 1 1 3 ASP CA C 2.114 0.193 0.187 1.00 . A A . 5 ASP CA 1 1
4 538 1 1 3 ASP CB C 2.490 -0.284 -1.247 1.00 . A A . 5 ASP CB 1 1
4 539 1 1 3 ASP CG C 3.495 -1.446 -1.340 1.00 . A A . 5 ASP CG 1 1
4 540 1 1 3 ASP H H 0.287 -1.049 0.167 1.00 . A A . 5 ASP H 1 1
4 541 1 1 3 ASP HA H 3.031 0.155 0.813 1.00 . A A . 5 ASP HA 1 1
4 542 1 1 3 ASP HB2 H 1.571 -0.497 -1.829 1.00 . A A . 5 ASP HB2 1 1
4 543 1 1 3 ASP HB3 H 2.966 0.552 -1.791 1.00 . A A . 5 ASP HB3 1 1
4 544 1 1 3 ASP N N 1.094 -0.743 0.735 1.00 . A A . 5 ASP N 1 1
4 545 1 1 3 ASP O O 0.565 1.953 -0.468 1.00 . A A . 5 ASP O 1 1
4 546 1 1 3 ASP OD1 O 4.388 -1.569 -0.500 1.00 . A A . 5 ASP OD1 1 1
4 547 1 1 4 TRP C C 1.839 4.745 -0.557 1.00 . A A . 6 TRP C 1 1
4 548 1 1 4 TRP CA C 1.950 4.047 0.860 1.00 . A A . 6 TRP CA 1 1
4 549 1 1 4 TRP CB C 3.008 4.729 1.781 1.00 . A A . 6 TRP CB 1 1
4 550 1 1 4 TRP CD1 C 3.137 7.312 1.323 1.00 . A A . 6 TRP CD1 1 1
4 551 1 1 4 TRP CD2 C 2.033 6.751 3.172 1.00 . A A . 6 TRP CD2 1 1
4 552 1 1 4 TRP CE2 C 1.984 8.158 2.993 1.00 . A A . 6 TRP CE2 1 1
4 553 1 1 4 TRP CE3 C 1.349 6.143 4.252 1.00 . A A . 6 TRP CE3 1 1
4 554 1 1 4 TRP CG C 2.755 6.209 2.121 1.00 . A A . 6 TRP CG 1 1
4 555 1 1 4 TRP CH2 C 0.587 8.345 4.959 1.00 . A A . 6 TRP CH2 1 1
4 556 1 1 4 TRP CZ2 C 1.250 8.962 3.895 1.00 . A A . 6 TRP CZ2 1 1
4 557 1 1 4 TRP CZ3 C 0.636 6.956 5.134 1.00 . A A . 6 TRP CZ3 1 1
4 558 1 1 4 TRP H H 3.157 2.240 1.269 1.00 . A A . 6 TRP H 1 1
4 559 1 1 4 TRP HA H 0.973 4.107 1.375 1.00 . A A . 6 TRP HA 1 1
4 560 1 1 4 TRP HB2 H 3.088 4.174 2.736 1.00 . A A . 6 TRP HB2 1 1
4 561 1 1 4 TRP HB3 H 4.012 4.640 1.323 1.00 . A A . 6 TRP HB3 1 1
4 562 1 1 4 TRP HD1 H 3.641 7.224 0.372 1.00 . A A . 6 TRP HD1 1 1
4 563 1 1 4 TRP HE1 H 2.775 9.477 1.465 1.00 . A A . 6 TRP HE1 1 1
4 564 1 1 4 TRP HE3 H 1.371 5.074 4.388 1.00 . A A . 6 TRP HE3 1 1
4 565 1 1 4 TRP HH2 H 0.021 8.949 5.654 1.00 . A A . 6 TRP HH2 1 1
4 566 1 1 4 TRP HZ2 H 1.197 10.032 3.760 1.00 . A A . 6 TRP HZ2 1 1
4 567 1 1 4 TRP HZ3 H 0.108 6.508 5.962 1.00 . A A . 6 TRP HZ3 1 1
4 568 1 1 4 TRP N N 2.315 2.598 0.809 1.00 . A A . 6 TRP N 1 1
4 569 1 1 4 TRP NE1 N 2.671 8.532 1.852 1.00 . A A . 6 TRP NE1 1 1
4 570 1 1 4 TRP O O 2.728 4.513 -1.386 1.00 . A A . 6 TRP O 1 1
4 571 1 1 5 PRO C C -1.504 5.239 0.370 1.00 . A A . 7 PRO C 1 1
4 572 1 1 5 PRO CA C -0.223 6.098 0.074 1.00 . A A . 7 PRO CA 1 1
4 573 1 1 5 PRO CB C -0.535 7.464 -0.570 1.00 . A A . 7 PRO CB 1 1
4 574 1 1 5 PRO CD C 0.778 6.284 -2.194 1.00 . A A . 7 PRO CD 1 1
4 575 1 1 5 PRO CG C -0.413 7.233 -2.076 1.00 . A A . 7 PRO CG 1 1
4 576 1 1 5 PRO HA H 0.219 6.305 1.063 1.00 . A A . 7 PRO HA 1 1
4 577 1 1 5 PRO HB2 H -1.517 7.876 -0.275 1.00 . A A . 7 PRO HB2 1 1
4 578 1 1 5 PRO HB3 H 0.215 8.212 -0.240 1.00 . A A . 7 PRO HB3 1 1
4 579 1 1 5 PRO HD2 H 0.664 5.574 -3.035 1.00 . A A . 7 PRO HD2 1 1
4 580 1 1 5 PRO HD3 H 1.718 6.847 -2.359 1.00 . A A . 7 PRO HD3 1 1
4 581 1 1 5 PRO HG2 H -1.331 6.750 -2.466 1.00 . A A . 7 PRO HG2 1 1
4 582 1 1 5 PRO HG3 H -0.270 8.170 -2.645 1.00 . A A . 7 PRO HG3 1 1
4 583 1 1 5 PRO N N 0.812 5.590 -0.887 1.00 . A A . 7 PRO N 1 1
4 584 1 1 5 PRO O O -2.423 5.729 1.030 1.00 . A A . 7 PRO O 1 1
4 585 1 1 6 . C C -3.108 2.193 -0.975 1.00 . A A . 8 4J2 C 1 1
4 586 1 1 6 . CA C -2.644 3.010 0.273 1.00 . A A . 8 4J2 CA 1 1
4 587 1 1 6 . CB C -2.193 2.019 1.394 1.00 . A A . 8 4J2 CB 1 1
4 588 1 1 6 . CD1 C -2.713 3.278 3.533 1.00 . A A . 8 4J2 CD1 1 1
4 589 1 1 6 . CD2 C -0.526 2.290 3.284 1.00 . A A . 8 4J2 CD2 1 1
4 590 1 1 6 . CE1 C -2.393 3.711 4.817 1.00 . A A . 8 4J2 CE1 1 1
4 591 1 1 6 . CE2 C -0.184 2.687 4.574 1.00 . A A . 8 4J2 CE2 1 1
4 592 1 1 6 . CE3 C 1.056 2.363 5.126 1.00 . A A . 8 4J2 CE3 1 1
4 593 1 1 6 . CE4 C 1.367 2.760 6.424 1.00 . A A . 8 4J2 CE4 1 1
4 594 1 1 6 . CG C -1.787 2.577 2.764 1.00 . A A . 8 4J2 CG 1 1
4 595 1 1 6 . CZ1 C -1.140 3.419 5.360 1.00 . A A . 8 4J2 CZ1 1 1
4 596 1 1 6 . CZ2 C -0.803 3.802 6.659 1.00 . A A . 8 4J2 CZ2 1 1
4 597 1 1 6 . CZ3 C 0.444 3.476 7.184 1.00 . A A . 8 4J2 CZ3 1 1
4 598 1 1 6 . H H -0.677 3.656 -0.503 1.00 . A A . 8 4J2 H 1 1
4 599 1 1 6 . HA H -3.540 3.557 0.630 1.00 . A A . 8 4J2 HA 1 1
4 600 1 1 6 . HB1 H -1.378 1.380 1.007 1.00 . A A . 8 4J2 HB1 1 1
4 601 1 1 6 . HB2 H -3.005 1.293 1.566 1.00 . A A . 8 4J2 HB2 1 1
4 602 1 1 6 . HD1 H -3.693 3.454 3.119 1.00 . A A . 8 4J2 HD1 1 1
4 603 1 1 6 . HD2 H 0.164 1.703 2.694 1.00 . A A . 8 4J2 HD2 1 1
4 604 1 1 6 . HE1 H -3.137 4.249 5.388 1.00 . A A . 8 4J2 HE1 1 1
4 605 1 1 6 . HE3 H 1.783 1.794 4.562 1.00 . A A . 8 4J2 HE3 1 1
4 606 1 1 6 . HE4 H 2.328 2.506 6.846 1.00 . A A . 8 4J2 HE4 1 1
4 607 1 1 6 . HZ2 H -1.502 4.351 7.276 1.00 . A A . 8 4J2 HZ2 1 1
4 608 1 1 6 . HZ23 H 0.698 3.775 8.190 1.00 . A A . 8 4J2 HZ23 1 1
4 609 1 1 6 . N N -1.547 3.969 -0.056 1.00 . A A . 8 4J2 N 1 1
4 610 1 1 6 . O O -4.301 2.130 -1.277 1.00 . A A . 8 4J2 O 1 1
4 611 1 1 7 ARG C C -2.075 -0.974 -1.782 1.00 . A A . 9 ARG C 1 1
4 612 1 1 7 ARG CA C -2.441 0.352 -2.525 1.00 . A A . 9 ARG CA 1 1
4 613 1 1 7 ARG CB C -1.588 0.583 -3.799 1.00 . A A . 9 ARG CB 1 1
4 614 1 1 7 ARG CD C -0.970 -0.117 -6.188 1.00 . A A . 9 ARG CD 1 1
4 615 1 1 7 ARG CG C -1.796 -0.441 -4.934 1.00 . A A . 9 ARG CG 1 1
4 616 1 1 7 ARG CZ C -0.623 -1.246 -8.393 1.00 . A A . 9 ARG CZ 1 1
4 617 1 1 7 ARG H H -1.248 1.570 -1.171 1.00 . A A . 9 ARG H 1 1
4 618 1 1 7 ARG HA H -3.514 0.339 -2.815 1.00 . A A . 9 ARG HA 1 1
4 619 1 1 7 ARG HB2 H -1.814 1.588 -4.201 1.00 . A A . 9 ARG HB2 1 1
4 620 1 1 7 ARG HB3 H -0.517 0.600 -3.524 1.00 . A A . 9 ARG HB3 1 1
4 621 1 1 7 ARG HD2 H -1.262 0.871 -6.597 1.00 . A A . 9 ARG HD2 1 1
4 622 1 1 7 ARG HD3 H 0.107 -0.055 -5.932 1.00 . A A . 9 ARG HD3 1 1
4 623 1 1 7 ARG HG2 H -1.522 -1.454 -4.576 1.00 . A A . 9 ARG HG2 1 1
4 624 1 1 7 ARG HG3 H -2.870 -0.490 -5.196 1.00 . A A . 9 ARG HG3 1 1
4 625 1 1 7 ARG HH11 H 0.424 0.398 -8.204 1.00 . A A . 9 ARG HH11 1 1
4 626 1 1 7 ARG HH12 H 0.603 -0.523 -9.790 1.00 . A A . 9 ARG HH12 1 1
4 627 1 1 7 ARG HH21 H -1.609 -2.874 -8.703 1.00 . A A . 9 ARG HH21 1 1
4 628 1 1 7 ARG HH22 H -0.503 -2.308 -10.071 1.00 . A A . 9 ARG HH22 1 1
4 629 1 1 7 ARG N N -2.163 1.498 -1.633 1.00 . A A . 9 ARG N 1 1
4 630 1 1 7 ARG NE N -1.199 -1.181 -7.195 1.00 . A A . 9 ARG NE 1 1
4 631 1 1 7 ARG NH1 N 0.231 -0.367 -8.852 1.00 . A A . 9 ARG NH1 1 1
4 632 1 1 7 ARG NH2 N -0.935 -2.249 -9.148 1.00 . A A . 9 ARG NH2 1 1
4 633 1 1 7 ARG O O -1.131 -1.047 -0.985 1.00 . A A . 9 ARG O 1 1
4 634 1 1 8 TRP C C -1.483 -4.085 -2.713 1.00 . A A . 10 TRP C 1 1
4 635 1 1 8 TRP CA C -2.427 -3.415 -1.659 1.00 . A A . 10 TRP CA 1 1
4 636 1 1 8 TRP CB C -3.730 -4.208 -1.388 1.00 . A A . 10 TRP CB 1 1
4 637 1 1 8 TRP CD1 C -3.322 -6.760 -1.377 1.00 . A A . 10 TRP CD1 1 1
4 638 1 1 8 TRP CD2 C -3.174 -5.804 0.621 1.00 . A A . 10 TRP CD2 1 1
4 639 1 1 8 TRP CE2 C -2.818 -7.171 0.726 1.00 . A A . 10 TRP CE2 1 1
4 640 1 1 8 TRP CE3 C -3.090 -4.946 1.745 1.00 . A A . 10 TRP CE3 1 1
4 641 1 1 8 TRP CG C -3.482 -5.547 -0.699 1.00 . A A . 10 TRP CG 1 1
4 642 1 1 8 TRP CH2 C -2.295 -6.833 3.065 1.00 . A A . 10 TRP CH2 1 1
4 643 1 1 8 TRP CZ2 C -2.366 -7.689 1.963 1.00 . A A . 10 TRP CZ2 1 1
4 644 1 1 8 TRP CZ3 C -2.657 -5.483 2.958 1.00 . A A . 10 TRP CZ3 1 1
4 645 1 1 8 TRP H H -3.373 -1.905 -2.935 1.00 . A A . 10 TRP H 1 1
4 646 1 1 8 TRP HA H -1.894 -3.347 -0.688 1.00 . A A . 10 TRP HA 1 1
4 647 1 1 8 TRP HB2 H -4.409 -3.626 -0.745 1.00 . A A . 10 TRP HB2 1 1
4 648 1 1 8 TRP HB3 H -4.291 -4.364 -2.326 1.00 . A A . 10 TRP HB3 1 1
4 649 1 1 8 TRP HD1 H -3.408 -6.814 -2.451 1.00 . A A . 10 TRP HD1 1 1
4 650 1 1 8 TRP HE1 H -2.632 -8.752 -0.753 1.00 . A A . 10 TRP HE1 1 1
4 651 1 1 8 TRP HE3 H -3.343 -3.900 1.653 1.00 . A A . 10 TRP HE3 1 1
4 652 1 1 8 TRP HH2 H -1.943 -7.214 4.013 1.00 . A A . 10 TRP HH2 1 1
4 653 1 1 8 TRP HZ2 H -2.067 -8.724 2.049 1.00 . A A . 10 TRP HZ2 1 1
4 654 1 1 8 TRP HZ3 H -2.576 -4.841 3.825 1.00 . A A . 10 TRP HZ3 1 1
4 655 1 1 8 TRP N N -2.805 -2.049 -2.097 1.00 . A A . 10 TRP N 1 1
4 656 1 1 8 TRP NE1 N -2.909 -7.793 -0.511 1.00 . A A . 10 TRP NE1 1 1
4 657 1 1 8 TRP O O -1.730 -4.043 -3.923 1.00 . A A . 10 TRP O 1 1
4 658 1 1 9 LYS C C 0.245 -6.671 -3.736 1.00 . A A . 11 LYS C 1 1
4 659 1 1 9 LYS CA C 0.652 -5.299 -3.096 1.00 . A A . 11 LYS CA 1 1
4 660 1 1 9 LYS CB C 1.894 -5.365 -2.168 1.00 . A A . 11 LYS CB 1 1
4 661 1 1 9 LYS CD C 3.855 -4.409 -3.621 1.00 . A A . 11 LYS CD 1 1
4 662 1 1 9 LYS CE C 4.402 -3.271 -2.731 1.00 . A A . 11 LYS CE 1 1
4 663 1 1 9 LYS CG C 3.242 -5.613 -2.864 1.00 . A A . 11 LYS CG 1 1
4 664 1 1 9 LYS H H -0.274 -4.701 -1.219 1.00 . A A . 11 LYS H 1 1
4 665 1 1 9 LYS HA H 0.887 -4.586 -3.909 1.00 . A A . 11 LYS HA 1 1
4 666 1 1 9 LYS HB2 H 2.000 -4.443 -1.565 1.00 . A A . 11 LYS HB2 1 1
4 667 1 1 9 LYS HB3 H 1.734 -6.170 -1.425 1.00 . A A . 11 LYS HB3 1 1
4 668 1 1 9 LYS HD2 H 4.705 -4.802 -4.211 1.00 . A A . 11 LYS HD2 1 1
4 669 1 1 9 LYS HD3 H 3.157 -4.021 -4.387 1.00 . A A . 11 LYS HD3 1 1
4 670 1 1 9 LYS HE2 H 4.864 -3.697 -1.815 1.00 . A A . 11 LYS HE2 1 1
4 671 1 1 9 LYS HE3 H 5.237 -2.772 -3.261 1.00 . A A . 11 LYS HE3 1 1
4 672 1 1 9 LYS HG2 H 3.956 -5.957 -2.093 1.00 . A A . 11 LYS HG2 1 1
4 673 1 1 9 LYS HG3 H 3.129 -6.472 -3.550 1.00 . A A . 11 LYS HG3 1 1
4 674 1 1 9 LYS HZ1 H 2.605 -2.020 -3.031 1.00 . A A . 11 LYS HZ1 1 1
4 675 1 1 9 LYS N N -0.404 -4.720 -2.234 1.00 . A A . 11 LYS N 1 1
4 676 1 1 9 LYS NZ N 3.384 -2.246 -2.406 1.00 . A A . 11 LYS NZ 1 1
4 677 1 1 9 LYS O O 0.538 -7.759 -3.246 1.00 . A A . 11 LYS O 1 1
4 678 1 1 10 NH2 HN1 H -0.907 -5.779 -5.081 1.00 . A A . 12 NH2 HN1 1 1
4 679 1 1 10 NH2 HN2 H -0.743 -7.610 -5.142 1.00 . A A . 12 NH2 HN2 1 1
4 680 1 1 10 NH2 N N -0.451 -6.671 -4.854 1.00 . A A . 12 NH2 N 1 1
5 681 1 1 1 ACE C C 0.651 -4.339 1.070 1.00 . A A . 3 ACE C 1 1
5 682 1 1 1 ACE CH3 C 1.058 -5.740 1.484 1.00 . A A . 3 ACE CH3 1 1
5 683 1 1 1 ACE H1 H 0.221 -6.271 1.971 1.00 . A A . 3 ACE H1 1 1
5 684 1 1 1 ACE H2 H 1.359 -6.334 0.602 1.00 . A A . 3 ACE H2 1 1
5 685 1 1 1 ACE H3 H 1.917 -5.727 2.179 1.00 . A A . 3 ACE H3 1 1
5 686 1 1 1 ACE O O 0.567 -4.035 -0.119 1.00 . A A . 3 ACE O 1 1
5 687 1 1 2 NLE C C 1.104 -1.076 1.717 1.00 . A A . 4 NLE C 1 1
5 688 1 1 2 NLE CA C -0.067 -2.101 1.851 1.00 . A A . 4 NLE CA 1 1
5 689 1 1 2 NLE CB C -1.104 -1.716 2.937 1.00 . A A . 4 NLE CB 1 1
5 690 1 1 2 NLE CD C -1.783 -1.256 5.397 1.00 . A A . 4 NLE CD 1 1
5 691 1 1 2 NLE CE C -2.944 -2.248 5.560 1.00 . A A . 4 NLE CE 1 1
5 692 1 1 2 NLE CG C -0.679 -1.726 4.429 1.00 . A A . 4 NLE CG 1 1
5 693 1 1 2 NLE H H 0.451 -3.899 3.007 1.00 . A A . 4 NLE H 1 1
5 694 1 1 2 NLE HA H -0.652 -2.083 0.905 1.00 . A A . 4 NLE HA 1 1
5 695 1 1 2 NLE HB2 H -1.978 -2.368 2.799 1.00 . A A . 4 NLE HB2 1 1
5 696 1 1 2 NLE HB3 H -1.490 -0.714 2.695 1.00 . A A . 4 NLE HB3 1 1
5 697 1 1 2 NLE HD2 H -2.173 -0.269 5.081 1.00 . A A . 4 NLE HD2 1 1
5 698 1 1 2 NLE HD3 H -1.330 -1.072 6.391 1.00 . A A . 4 NLE HD3 1 1
5 699 1 1 2 NLE HE1 H -2.593 -3.238 5.906 1.00 . A A . 4 NLE HE1 1 1
5 700 1 1 2 NLE HE2 H -3.679 -1.883 6.301 1.00 . A A . 4 NLE HE2 1 1
5 701 1 1 2 NLE HE3 H -3.493 -2.402 4.612 1.00 . A A . 4 NLE HE3 1 1
5 702 1 1 2 NLE HG2 H 0.197 -1.064 4.560 1.00 . A A . 4 NLE HG2 1 1
5 703 1 1 2 NLE HG3 H -0.325 -2.731 4.729 1.00 . A A . 4 NLE HG3 1 1
5 704 1 1 2 NLE N N 0.389 -3.498 2.069 1.00 . A A . 4 NLE N 1 1
5 705 1 1 2 NLE O O 1.881 -0.843 2.648 1.00 . A A . 4 NLE O 1 1
5 706 1 1 3 ASP C C 1.705 1.982 0.260 1.00 . A A . 5 ASP C 1 1
5 707 1 1 3 ASP CA C 2.269 0.530 0.205 1.00 . A A . 5 ASP CA 1 1
5 708 1 1 3 ASP CB C 2.813 0.197 -1.210 1.00 . A A . 5 ASP CB 1 1
5 709 1 1 3 ASP CG C 3.706 -1.046 -1.300 1.00 . A A . 5 ASP CG 1 1
5 710 1 1 3 ASP H H 0.508 -0.771 -0.161 1.00 . A A . 5 ASP H 1 1
5 711 1 1 3 ASP HA H 3.116 0.442 0.920 1.00 . A A . 5 ASP HA 1 1
5 712 1 1 3 ASP HB2 H 1.988 0.143 -1.948 1.00 . A A . 5 ASP HB2 1 1
5 713 1 1 3 ASP HB3 H 3.429 1.042 -1.565 1.00 . A A . 5 ASP HB3 1 1
5 714 1 1 3 ASP N N 1.196 -0.449 0.539 1.00 . A A . 5 ASP N 1 1
5 715 1 1 3 ASP O O 0.752 2.303 -0.458 1.00 . A A . 5 ASP O 1 1
5 716 1 1 3 ASP OD1 O 4.918 -0.947 -1.110 1.00 . A A . 5 ASP OD1 1 1
5 717 1 1 4 TRP C C 1.709 5.130 -0.020 1.00 . A A . 6 TRP C 1 1
5 718 1 1 4 TRP CA C 1.804 4.262 1.300 1.00 . A A . 6 TRP CA 1 1
5 719 1 1 4 TRP CB C 2.733 4.908 2.371 1.00 . A A . 6 TRP CB 1 1
5 720 1 1 4 TRP CD1 C 2.573 7.528 2.266 1.00 . A A . 6 TRP CD1 1 1
5 721 1 1 4 TRP CD2 C 1.465 6.595 3.956 1.00 . A A . 6 TRP CD2 1 1
5 722 1 1 4 TRP CE2 C 1.256 7.999 3.964 1.00 . A A . 6 TRP CE2 1 1
5 723 1 1 4 TRP CE3 C 0.818 5.770 4.909 1.00 . A A . 6 TRP CE3 1 1
5 724 1 1 4 TRP CG C 2.292 6.289 2.887 1.00 . A A . 6 TRP CG 1 1
5 725 1 1 4 TRP CH2 C -0.227 7.756 5.857 1.00 . A A . 6 TRP CH2 1 1
5 726 1 1 4 TRP CZ2 C 0.398 8.584 4.923 1.00 . A A . 6 TRP CZ2 1 1
5 727 1 1 4 TRP CZ3 C -0.019 6.370 5.851 1.00 . A A . 6 TRP CZ3 1 1
5 728 1 1 4 TRP H H 3.100 2.494 1.609 1.00 . A A . 6 TRP H 1 1
5 729 1 1 4 TRP HA H 0.799 4.171 1.751 1.00 . A A . 6 TRP HA 1 1
5 730 1 1 4 TRP HB2 H 2.828 4.235 3.246 1.00 . A A . 6 TRP HB2 1 1
5 731 1 1 4 TRP HB3 H 3.763 4.989 1.971 1.00 . A A . 6 TRP HB3 1 1
5 732 1 1 4 TRP HD1 H 3.123 7.631 1.342 1.00 . A A . 6 TRP HD1 1 1
5 733 1 1 4 TRP HE1 H 1.948 9.597 2.671 1.00 . A A . 6 TRP HE1 1 1
5 734 1 1 4 TRP HE3 H 0.963 4.702 4.906 1.00 . A A . 6 TRP HE3 1 1
5 735 1 1 4 TRP HH2 H -0.886 8.190 6.596 1.00 . A A . 6 TRP HH2 1 1
5 736 1 1 4 TRP HZ2 H 0.224 9.649 4.927 1.00 . A A . 6 TRP HZ2 1 1
5 737 1 1 4 TRP HZ3 H -0.519 5.757 6.585 1.00 . A A . 6 TRP HZ3 1 1
5 738 1 1 4 TRP N N 2.293 2.862 1.095 1.00 . A A . 6 TRP N 1 1
5 739 1 1 4 TRP NE1 N 1.941 8.602 2.923 1.00 . A A . 6 TRP NE1 1 1
5 740 1 1 4 TRP O O 2.676 5.113 -0.792 1.00 . A A . 6 TRP O 1 1
5 741 1 1 5 PRO C C -1.718 5.120 0.704 1.00 . A A . 7 PRO C 1 1
5 742 1 1 5 PRO CA C -0.536 6.151 0.603 1.00 . A A . 7 PRO CA 1 1
5 743 1 1 5 PRO CB C -0.977 7.540 0.097 1.00 . A A . 7 PRO CB 1 1
5 744 1 1 5 PRO CD C 0.575 6.732 -1.543 1.00 . A A . 7 PRO CD 1 1
5 745 1 1 5 PRO CG C -0.732 7.512 -1.413 1.00 . A A . 7 PRO CG 1 1
5 746 1 1 5 PRO HA H -0.181 6.288 1.639 1.00 . A A . 7 PRO HA 1 1
5 747 1 1 5 PRO HB2 H -2.020 7.794 0.358 1.00 . A A . 7 PRO HB2 1 1
5 748 1 1 5 PRO HB3 H -0.350 8.324 0.566 1.00 . A A . 7 PRO HB3 1 1
5 749 1 1 5 PRO HD2 H 0.607 6.126 -2.469 1.00 . A A . 7 PRO HD2 1 1
5 750 1 1 5 PRO HD3 H 1.445 7.418 -1.565 1.00 . A A . 7 PRO HD3 1 1
5 751 1 1 5 PRO HG2 H -1.554 6.974 -1.925 1.00 . A A . 7 PRO HG2 1 1
5 752 1 1 5 PRO HG3 H -0.673 8.522 -1.858 1.00 . A A . 7 PRO HG3 1 1
5 753 1 1 5 PRO N N 0.610 5.888 -0.329 1.00 . A A . 7 PRO N 1 1
5 754 1 1 5 PRO O O -2.723 5.416 1.354 1.00 . A A . 7 PRO O 1 1
5 755 1 1 6 . C C -2.841 2.073 -1.074 1.00 . A A . 8 4J2 C 1 1
5 756 1 1 6 . CA C -2.565 2.800 0.283 1.00 . A A . 8 4J2 CA 1 1
5 757 1 1 6 . CB C -2.064 1.761 1.338 1.00 . A A . 8 4J2 CB 1 1
5 758 1 1 6 . CD1 C -2.882 2.741 3.532 1.00 . A A . 8 4J2 CD1 1 1
5 759 1 1 6 . CD2 C -0.610 1.938 3.408 1.00 . A A . 8 4J2 CD2 1 1
5 760 1 1 6 . CE1 C -2.727 3.031 4.884 1.00 . A A . 8 4J2 CE1 1 1
5 761 1 1 6 . CE2 C -0.430 2.197 4.764 1.00 . A A . 8 4J2 CE2 1 1
5 762 1 1 6 . CE3 C 0.773 1.898 5.405 1.00 . A A . 8 4J2 CE3 1 1
5 763 1 1 6 . CE4 C 0.920 2.150 6.766 1.00 . A A . 8 4J2 CE4 1 1
5 764 1 1 6 . CG C -1.834 2.200 2.792 1.00 . A A . 8 4J2 CG 1 1
5 765 1 1 6 . CZ1 C -1.515 2.757 5.522 1.00 . A A . 8 4J2 CZ1 1 1
5 766 1 1 6 . CZ2 C -1.342 2.995 6.887 1.00 . A A . 8 4J2 CZ2 1 1
5 767 1 1 6 . CZ3 C -0.129 2.696 7.502 1.00 . A A . 8 4J2 CZ3 1 1
5 768 1 1 6 . H H -0.661 3.759 -0.293 1.00 . A A . 8 4J2 H 1 1
5 769 1 1 6 . HA H -3.545 3.194 0.620 1.00 . A A . 8 4J2 HA 1 1
5 770 1 1 6 . HB1 H -1.143 1.285 0.956 1.00 . A A . 8 4J2 HB1 1 1
5 771 1 1 6 . HB2 H -2.780 0.922 1.364 1.00 . A A . 8 4J2 HB2 1 1
5 772 1 1 6 . HD1 H -3.824 2.918 3.037 1.00 . A A . 8 4J2 HD1 1 1
5 773 1 1 6 . HD2 H 0.182 1.479 2.834 1.00 . A A . 8 4J2 HD2 1 1
5 774 1 1 6 . HE1 H -3.562 3.449 5.428 1.00 . A A . 8 4J2 HE1 1 1
5 775 1 1 6 . HE3 H 1.601 1.464 4.860 1.00 . A A . 8 4J2 HE3 1 1
5 776 1 1 6 . HE4 H 1.853 1.918 7.257 1.00 . A A . 8 4J2 HE4 1 1
5 777 1 1 6 . HZ2 H -2.141 3.412 7.485 1.00 . A A . 8 4J2 HZ2 1 1
5 778 1 1 6 . HZ23 H -0.002 2.883 8.558 1.00 . A A . 8 4J2 HZ23 1 1
5 779 1 1 6 . N N -1.585 3.914 0.130 1.00 . A A . 8 4J2 N 1 1
5 780 1 1 6 . O O -3.992 1.959 -1.499 1.00 . A A . 8 4J2 O 1 1
5 781 1 1 7 ARG C C -1.593 -0.884 -2.262 1.00 . A A . 9 ARG C 1 1
5 782 1 1 7 ARG CA C -1.893 0.545 -2.814 1.00 . A A . 9 ARG CA 1 1
5 783 1 1 7 ARG CB C -0.878 0.917 -3.922 1.00 . A A . 9 ARG CB 1 1
5 784 1 1 7 ARG CD C -0.099 2.576 -5.757 1.00 . A A . 9 ARG CD 1 1
5 785 1 1 7 ARG CG C -1.146 2.244 -4.677 1.00 . A A . 9 ARG CG 1 1
5 786 1 1 7 ARG CZ C 0.563 1.670 -7.997 1.00 . A A . 9 ARG CZ 1 1
5 787 1 1 7 ARG H H -0.905 1.661 -1.190 1.00 . A A . 9 ARG H 1 1
5 788 1 1 7 ARG HA H -2.909 0.575 -3.263 1.00 . A A . 9 ARG HA 1 1
5 789 1 1 7 ARG HB2 H 0.140 0.919 -3.495 1.00 . A A . 9 ARG HB2 1 1
5 790 1 1 7 ARG HB3 H -0.856 0.102 -4.669 1.00 . A A . 9 ARG HB3 1 1
5 791 1 1 7 ARG HD2 H -0.232 3.627 -6.082 1.00 . A A . 9 ARG HD2 1 1
5 792 1 1 7 ARG HD3 H 0.922 2.514 -5.328 1.00 . A A . 9 ARG HD3 1 1
5 793 1 1 7 ARG HG2 H -2.157 2.230 -5.132 1.00 . A A . 9 ARG HG2 1 1
5 794 1 1 7 ARG HG3 H -1.174 3.076 -3.947 1.00 . A A . 9 ARG HG3 1 1
5 795 1 1 7 ARG HH11 H 1.732 3.114 -7.380 1.00 . A A . 9 ARG HH11 1 1
5 796 1 1 7 ARG HH12 H 2.127 2.367 -9.017 1.00 . A A . 9 ARG HH12 1 1
5 797 1 1 7 ARG HH21 H -0.518 0.241 -8.713 1.00 . A A . 9 ARG HH21 1 1
5 798 1 1 7 ARG HH22 H 0.905 0.800 -9.752 1.00 . A A . 9 ARG HH22 1 1
5 799 1 1 7 ARG N N -1.787 1.517 -1.699 1.00 . A A . 9 ARG N 1 1
5 800 1 1 7 ARG NE N -0.236 1.676 -6.933 1.00 . A A . 9 ARG NE 1 1
5 801 1 1 7 ARG NH1 N 1.588 2.466 -8.157 1.00 . A A . 9 ARG NH1 1 1
5 802 1 1 7 ARG NH2 N 0.299 0.815 -8.931 1.00 . A A . 9 ARG NH2 1 1
5 803 1 1 7 ARG O O -0.558 -1.129 -1.628 1.00 . A A . 9 ARG O 1 1
5 804 1 1 8 TRP C C -1.664 -4.141 -3.056 1.00 . A A . 10 TRP C 1 1
5 805 1 1 8 TRP CA C -2.380 -3.222 -2.015 1.00 . A A . 10 TRP CA 1 1
5 806 1 1 8 TRP CB C -3.802 -3.715 -1.645 1.00 . A A . 10 TRP CB 1 1
5 807 1 1 8 TRP CD1 C -4.152 -6.282 -1.730 1.00 . A A . 10 TRP CD1 1 1
5 808 1 1 8 TRP CD2 C -3.518 -5.516 0.252 1.00 . A A . 10 TRP CD2 1 1
5 809 1 1 8 TRP CE2 C -3.614 -6.928 0.303 1.00 . A A . 10 TRP CE2 1 1
5 810 1 1 8 TRP CE3 C -3.104 -4.778 1.384 1.00 . A A . 10 TRP CE3 1 1
5 811 1 1 8 TRP CG C -3.850 -5.111 -1.022 1.00 . A A . 10 TRP CG 1 1
5 812 1 1 8 TRP CH2 C -2.879 -6.873 2.609 1.00 . A A . 10 TRP CH2 1 1
5 813 1 1 8 TRP CZ2 C -3.287 -7.615 1.496 1.00 . A A . 10 TRP CZ2 1 1
5 814 1 1 8 TRP CZ3 C -2.791 -5.474 2.553 1.00 . A A . 10 TRP CZ3 1 1
5 815 1 1 8 TRP H H -3.247 -1.548 -3.155 1.00 . A A . 10 TRP H 1 1
5 816 1 1 8 TRP HA H -1.805 -3.218 -1.064 1.00 . A A . 10 TRP HA 1 1
5 817 1 1 8 TRP HB2 H -4.276 -3.017 -0.937 1.00 . A A . 10 TRP HB2 1 1
5 818 1 1 8 TRP HB3 H -4.445 -3.697 -2.542 1.00 . A A . 10 TRP HB3 1 1
5 819 1 1 8 TRP HD1 H -4.402 -6.257 -2.781 1.00 . A A . 10 TRP HD1 1 1
5 820 1 1 8 TRP HE1 H -4.166 -8.413 -1.187 1.00 . A A . 10 TRP HE1 1 1
5 821 1 1 8 TRP HE3 H -3.037 -3.703 1.329 1.00 . A A . 10 TRP HE3 1 1
5 822 1 1 8 TRP HH2 H -2.627 -7.385 3.527 1.00 . A A . 10 TRP HH2 1 1
5 823 1 1 8 TRP HZ2 H -3.349 -8.692 1.544 1.00 . A A . 10 TRP HZ2 1 1
5 824 1 1 8 TRP HZ3 H -2.473 -4.926 3.428 1.00 . A A . 10 TRP HZ3 1 1
5 825 1 1 8 TRP N N -2.508 -1.829 -2.508 1.00 . A A . 10 TRP N 1 1
5 826 1 1 8 TRP NE1 N -4.016 -7.432 -0.925 1.00 . A A . 10 TRP NE1 1 1
5 827 1 1 8 TRP O O -2.127 -4.329 -4.185 1.00 . A A . 10 TRP O 1 1
5 828 1 1 9 LYS C C -0.324 -7.253 -3.142 1.00 . A A . 11 LYS C 1 1
5 829 1 1 9 LYS CA C 0.174 -5.792 -3.395 1.00 . A A . 11 LYS CA 1 1
5 830 1 1 9 LYS CB C 1.685 -5.618 -3.094 1.00 . A A . 11 LYS CB 1 1
5 831 1 1 9 LYS CD C 3.743 -4.021 -3.192 1.00 . A A . 11 LYS CD 1 1
5 832 1 1 9 LYS CE C 3.804 -3.483 -1.745 1.00 . A A . 11 LYS CE 1 1
5 833 1 1 9 LYS CG C 2.337 -4.363 -3.729 1.00 . A A . 11 LYS CG 1 1
5 834 1 1 9 LYS H H -0.229 -4.423 -1.696 1.00 . A A . 11 LYS H 1 1
5 835 1 1 9 LYS HA H 0.039 -5.613 -4.480 1.00 . A A . 11 LYS HA 1 1
5 836 1 1 9 LYS HB2 H 1.836 -5.623 -1.998 1.00 . A A . 11 LYS HB2 1 1
5 837 1 1 9 LYS HB3 H 2.236 -6.505 -3.454 1.00 . A A . 11 LYS HB3 1 1
5 838 1 1 9 LYS HD2 H 4.394 -4.912 -3.276 1.00 . A A . 11 LYS HD2 1 1
5 839 1 1 9 LYS HD3 H 4.211 -3.272 -3.861 1.00 . A A . 11 LYS HD3 1 1
5 840 1 1 9 LYS HE2 H 3.357 -4.220 -1.051 1.00 . A A . 11 LYS HE2 1 1
5 841 1 1 9 LYS HE3 H 4.865 -3.407 -1.438 1.00 . A A . 11 LYS HE3 1 1
5 842 1 1 9 LYS HG2 H 2.399 -4.506 -4.824 1.00 . A A . 11 LYS HG2 1 1
5 843 1 1 9 LYS HG3 H 1.683 -3.480 -3.596 1.00 . A A . 11 LYS HG3 1 1
5 844 1 1 9 LYS HZ1 H 2.069 -2.120 -1.659 1.00 . A A . 11 LYS HZ1 1 1
5 845 1 1 9 LYS N N -0.568 -4.763 -2.613 1.00 . A A . 11 LYS N 1 1
5 846 1 1 9 LYS NZ N 3.090 -2.193 -1.598 1.00 . A A . 11 LYS NZ 1 1
5 847 1 1 9 LYS O O -0.572 -8.009 -4.076 1.00 . A A . 11 LYS O 1 1
5 848 1 1 10 NH2 HN1 H -0.471 -7.047 -1.164 1.00 . A A . 12 NH2 HN1 1 1
5 849 1 1 10 NH2 HN2 H -0.901 -8.670 -1.912 1.00 . A A . 12 NH2 HN2 1 1
5 850 1 1 10 NH2 N N -0.478 -7.738 -1.920 1.00 . A A . 12 NH2 N 1 1
6 851 1 1 1 ACE C C 0.642 -4.315 1.446 1.00 . A A . 3 ACE C 1 1
6 852 1 1 1 ACE CH3 C 1.010 -5.694 1.956 1.00 . A A . 3 ACE CH3 1 1
6 853 1 1 1 ACE H1 H 1.975 -5.678 2.496 1.00 . A A . 3 ACE H1 1 1
6 854 1 1 1 ACE H2 H 0.236 -6.096 2.633 1.00 . A A . 3 ACE H2 1 1
6 855 1 1 1 ACE H3 H 1.110 -6.405 1.117 1.00 . A A . 3 ACE H3 1 1
6 856 1 1 1 ACE O O 0.552 -4.093 0.240 1.00 . A A . 3 ACE O 1 1
6 857 1 1 2 NLE C C 1.160 -1.001 1.909 1.00 . A A . 4 NLE C 1 1
6 858 1 1 2 NLE CA C -0.021 -2.011 2.068 1.00 . A A . 4 NLE CA 1 1
6 859 1 1 2 NLE CB C -1.087 -1.564 3.099 1.00 . A A . 4 NLE CB 1 1
6 860 1 1 2 NLE CD C -1.847 -0.978 5.511 1.00 . A A . 4 NLE CD 1 1
6 861 1 1 2 NLE CE C -3.019 -1.956 5.683 1.00 . A A . 4 NLE CE 1 1
6 862 1 1 2 NLE CG C -0.716 -1.499 4.604 1.00 . A A . 4 NLE CG 1 1
6 863 1 1 2 NLE H H 0.467 -3.733 3.346 1.00 . A A . 4 NLE H 1 1
6 864 1 1 2 NLE HA H -0.577 -2.043 1.105 1.00 . A A . 4 NLE HA 1 1
6 865 1 1 2 NLE HB2 H -1.962 -2.216 2.963 1.00 . A A . 4 NLE HB2 1 1
6 866 1 1 2 NLE HB3 H -1.456 -0.573 2.794 1.00 . A A . 4 NLE HB3 1 1
6 867 1 1 2 NLE HD2 H -2.220 -0.005 5.136 1.00 . A A . 4 NLE HD2 1 1
6 868 1 1 2 NLE HD3 H -1.427 -0.750 6.510 1.00 . A A . 4 NLE HD3 1 1
6 869 1 1 2 NLE HE1 H -3.540 -2.153 4.728 1.00 . A A . 4 NLE HE1 1 1
6 870 1 1 2 NLE HE2 H -2.686 -2.930 6.087 1.00 . A A . 4 NLE HE2 1 1
6 871 1 1 2 NLE HE3 H -3.774 -1.554 6.383 1.00 . A A . 4 NLE HE3 1 1
6 872 1 1 2 NLE HG2 H 0.158 -0.832 4.731 1.00 . A A . 4 NLE HG2 1 1
6 873 1 1 2 NLE HG3 H -0.374 -2.487 4.966 1.00 . A A . 4 NLE HG3 1 1
6 874 1 1 2 NLE N N 0.422 -3.394 2.383 1.00 . A A . 4 NLE N 1 1
6 875 1 1 2 NLE O O 1.866 -0.663 2.863 1.00 . A A . 4 NLE O 1 1
6 876 1 1 3 ASP C C 1.687 1.977 0.396 1.00 . A A . 5 ASP C 1 1
6 877 1 1 3 ASP CA C 2.342 0.562 0.367 1.00 . A A . 5 ASP CA 1 1
6 878 1 1 3 ASP CB C 2.938 0.275 -1.038 1.00 . A A . 5 ASP CB 1 1
6 879 1 1 3 ASP CG C 4.015 -0.817 -1.109 1.00 . A A . 5 ASP CG 1 1
6 880 1 1 3 ASP H H 0.655 -0.837 -0.016 1.00 . A A . 5 ASP H 1 1
6 881 1 1 3 ASP HA H 3.172 0.535 1.105 1.00 . A A . 5 ASP HA 1 1
6 882 1 1 3 ASP HB2 H 2.138 0.074 -1.778 1.00 . A A . 5 ASP HB2 1 1
6 883 1 1 3 ASP HB3 H 3.420 1.191 -1.423 1.00 . A A . 5 ASP HB3 1 1
6 884 1 1 3 ASP N N 1.334 -0.491 0.682 1.00 . A A . 5 ASP N 1 1
6 885 1 1 3 ASP O O 0.625 2.182 -0.196 1.00 . A A . 5 ASP O 1 1
6 886 1 1 3 ASP OD1 O 5.207 -0.511 -1.111 1.00 . A A . 5 ASP OD1 1 1
6 887 1 1 4 TRP C C 1.697 5.071 -0.318 1.00 . A A . 6 TRP C 1 1
6 888 1 1 4 TRP CA C 1.818 4.374 1.100 1.00 . A A . 6 TRP CA 1 1
6 889 1 1 4 TRP CB C 2.756 5.149 2.071 1.00 . A A . 6 TRP CB 1 1
6 890 1 1 4 TRP CD1 C 2.594 7.752 1.772 1.00 . A A . 6 TRP CD1 1 1
6 891 1 1 4 TRP CD2 C 1.361 6.922 3.429 1.00 . A A . 6 TRP CD2 1 1
6 892 1 1 4 TRP CE2 C 1.141 8.319 3.324 1.00 . A A . 6 TRP CE2 1 1
6 893 1 1 4 TRP CE3 C 0.633 6.150 4.369 1.00 . A A . 6 TRP CE3 1 1
6 894 1 1 4 TRP CG C 2.273 6.557 2.453 1.00 . A A . 6 TRP CG 1 1
6 895 1 1 4 TRP CH2 C -0.510 8.178 5.085 1.00 . A A . 6 TRP CH2 1 1
6 896 1 1 4 TRP CZ2 C 0.193 8.953 4.160 1.00 . A A . 6 TRP CZ2 1 1
6 897 1 1 4 TRP CZ3 C -0.293 6.798 5.187 1.00 . A A . 6 TRP CZ3 1 1
6 898 1 1 4 TRP H H 3.235 2.708 1.444 1.00 . A A . 6 TRP H 1 1
6 899 1 1 4 TRP HA H 0.824 4.329 1.582 1.00 . A A . 6 TRP HA 1 1
6 900 1 1 4 TRP HB2 H 2.890 4.576 3.010 1.00 . A A . 6 TRP HB2 1 1
6 901 1 1 4 TRP HB3 H 3.772 5.217 1.637 1.00 . A A . 6 TRP HB3 1 1
6 902 1 1 4 TRP HD1 H 3.225 7.797 0.895 1.00 . A A . 6 TRP HD1 1 1
6 903 1 1 4 TRP HE1 H 1.927 9.836 1.987 1.00 . A A . 6 TRP HE1 1 1
6 904 1 1 4 TRP HE3 H 0.783 5.085 4.445 1.00 . A A . 6 TRP HE3 1 1
6 905 1 1 4 TRP HH2 H -1.240 8.650 5.728 1.00 . A A . 6 TRP HH2 1 1
6 906 1 1 4 TRP HZ2 H 0.008 10.014 4.076 1.00 . A A . 6 TRP HZ2 1 1
6 907 1 1 4 TRP HZ3 H -0.859 6.224 5.907 1.00 . A A . 6 TRP HZ3 1 1
6 908 1 1 4 TRP N N 2.327 2.968 1.045 1.00 . A A . 6 TRP N 1 1
6 909 1 1 4 TRP NE1 N 1.905 8.860 2.304 1.00 . A A . 6 TRP NE1 1 1
6 910 1 1 4 TRP O O 2.662 4.969 -1.085 1.00 . A A . 6 TRP O 1 1
6 911 1 1 5 PRO C C -1.808 5.198 0.181 1.00 . A A . 7 PRO C 1 1
6 912 1 1 5 PRO CA C -0.559 6.153 0.168 1.00 . A A . 7 PRO CA 1 1
6 913 1 1 5 PRO CB C -0.842 7.571 -0.374 1.00 . A A . 7 PRO CB 1 1
6 914 1 1 5 PRO CD C 0.584 6.522 -2.000 1.00 . A A . 7 PRO CD 1 1
6 915 1 1 5 PRO CG C -0.611 7.468 -1.883 1.00 . A A . 7 PRO CG 1 1
6 916 1 1 5 PRO HA H -0.251 6.269 1.221 1.00 . A A . 7 PRO HA 1 1
6 917 1 1 5 PRO HB2 H -1.849 7.946 -0.119 1.00 . A A . 7 PRO HB2 1 1
6 918 1 1 5 PRO HB3 H -0.129 8.294 0.071 1.00 . A A . 7 PRO HB3 1 1
6 919 1 1 5 PRO HD2 H 0.490 5.841 -2.868 1.00 . A A . 7 PRO HD2 1 1
6 920 1 1 5 PRO HD3 H 1.523 7.097 -2.131 1.00 . A A . 7 PRO HD3 1 1
6 921 1 1 5 PRO HG2 H -1.496 7.024 -2.376 1.00 . A A . 7 PRO HG2 1 1
6 922 1 1 5 PRO HG3 H -0.429 8.450 -2.358 1.00 . A A . 7 PRO HG3 1 1
6 923 1 1 5 PRO N N 0.590 5.779 -0.720 1.00 . A A . 7 PRO N 1 1
6 924 1 1 5 PRO O O -2.959 5.640 0.108 1.00 . A A . 7 PRO O 1 1
6 925 1 1 6 . C C -2.905 2.115 -0.874 1.00 . A A . 8 4J2 C 1 1
6 926 1 1 6 . CA C -2.639 2.854 0.480 1.00 . A A . 8 4J2 CA 1 1
6 927 1 1 6 . CB C -2.228 1.833 1.591 1.00 . A A . 8 4J2 CB 1 1
6 928 1 1 6 . CD1 C -2.918 2.925 3.775 1.00 . A A . 8 4J2 CD1 1 1
6 929 1 1 6 . CD2 C -0.644 2.150 3.542 1.00 . A A . 8 4J2 CD2 1 1
6 930 1 1 6 . CE1 C -2.668 3.322 5.086 1.00 . A A . 8 4J2 CE1 1 1
6 931 1 1 6 . CE2 C -0.367 2.524 4.854 1.00 . A A . 8 4J2 CE2 1 1
6 932 1 1 6 . CE3 C 0.895 2.318 5.414 1.00 . A A . 8 4J2 CE3 1 1
6 933 1 1 6 . CE4 C 1.146 2.704 6.726 1.00 . A A . 8 4J2 CE4 1 1
6 934 1 1 6 . CG C -1.916 2.343 3.004 1.00 . A A . 8 4J2 CG 1 1
6 935 1 1 6 . CZ1 C -1.404 3.125 5.647 1.00 . A A . 8 4J2 CZ1 1 1
6 936 1 1 6 . CZ2 C -1.126 3.497 6.963 1.00 . A A . 8 4J2 CZ2 1 1
6 937 1 1 6 . CZ3 C 0.144 3.290 7.496 1.00 . A A . 8 4J2 CZ3 1 1
6 938 1 1 6 . H H -0.592 3.614 0.212 1.00 . A A . 8 4J2 H 1 1
6 939 1 1 6 . HA H -3.595 3.322 0.788 1.00 . A A . 8 4J2 HA 1 1
6 940 1 1 6 . HB1 H -1.363 1.244 1.232 1.00 . A A . 8 4J2 HB1 1 1
6 941 1 1 6 . HB2 H -3.020 1.071 1.678 1.00 . A A . 8 4J2 HB2 1 1
6 942 1 1 6 . HD1 H -3.898 3.048 3.339 1.00 . A A . 8 4J2 HD1 1 1
6 943 1 1 6 . HD2 H 0.112 1.670 2.938 1.00 . A A . 8 4J2 HD2 1 1
6 944 1 1 6 . HE1 H -3.469 3.769 5.660 1.00 . A A . 8 4J2 HE1 1 1
6 945 1 1 6 . HE3 H 1.689 1.857 4.841 1.00 . A A . 8 4J2 HE3 1 1
6 946 1 1 6 . HE4 H 2.125 2.544 7.155 1.00 . A A . 8 4J2 HE4 1 1
6 947 1 1 6 . HZ2 H -1.885 3.952 7.586 1.00 . A A . 8 4J2 HZ2 1 1
6 948 1 1 6 . HZ23 H 0.353 3.583 8.514 1.00 . A A . 8 4J2 HZ23 1 1
6 949 1 1 6 . N N -1.575 3.891 0.345 1.00 . A A . 8 4J2 N 1 1
6 950 1 1 6 . O O -4.003 2.188 -1.429 1.00 . A A . 8 4J2 O 1 1
6 951 1 1 7 ARG C C -1.556 -0.926 -2.108 1.00 . A A . 9 ARG C 1 1
6 952 1 1 7 ARG CA C -1.979 0.507 -2.561 1.00 . A A . 9 ARG CA 1 1
6 953 1 1 7 ARG CB C -1.055 1.041 -3.690 1.00 . A A . 9 ARG CB 1 1
6 954 1 1 7 ARG CD C -2.635 2.805 -4.787 1.00 . A A . 9 ARG CD 1 1
6 955 1 1 7 ARG CG C -1.256 2.505 -4.164 1.00 . A A . 9 ARG CG 1 1
6 956 1 1 7 ARG CZ C -3.279 5.160 -4.202 1.00 . A A . 9 ARG CZ 1 1
6 957 1 1 7 ARG H H -1.016 1.504 -0.847 1.00 . A A . 9 ARG H 1 1
6 958 1 1 7 ARG HA H -3.018 0.483 -2.949 1.00 . A A . 9 ARG HA 1 1
6 959 1 1 7 ARG HB2 H -0.006 0.922 -3.362 1.00 . A A . 9 ARG HB2 1 1
6 960 1 1 7 ARG HB3 H -1.141 0.369 -4.561 1.00 . A A . 9 ARG HB3 1 1
6 961 1 1 7 ARG HD2 H -2.743 2.256 -5.742 1.00 . A A . 9 ARG HD2 1 1
6 962 1 1 7 ARG HD3 H -3.463 2.432 -4.152 1.00 . A A . 9 ARG HD3 1 1
6 963 1 1 7 ARG HG2 H -1.077 3.190 -3.313 1.00 . A A . 9 ARG HG2 1 1
6 964 1 1 7 ARG HG3 H -0.470 2.768 -4.898 1.00 . A A . 9 ARG HG3 1 1
6 965 1 1 7 ARG HH11 H -3.642 3.899 -2.734 1.00 . A A . 9 ARG HH11 1 1
6 966 1 1 7 ARG HH12 H -4.036 5.665 -2.422 1.00 . A A . 9 ARG HH12 1 1
6 967 1 1 7 ARG HH21 H -2.987 6.498 -5.562 1.00 . A A . 9 ARG HH21 1 1
6 968 1 1 7 ARG HH22 H -3.737 7.079 -3.974 1.00 . A A . 9 ARG HH22 1 1
6 969 1 1 7 ARG N N -1.892 1.388 -1.374 1.00 . A A . 9 ARG N 1 1
6 970 1 1 7 ARG NE N -2.780 4.260 -5.052 1.00 . A A . 9 ARG NE 1 1
6 971 1 1 7 ARG NH1 N -3.711 4.887 -2.998 1.00 . A A . 9 ARG NH1 1 1
6 972 1 1 7 ARG NH2 N -3.332 6.388 -4.605 1.00 . A A . 9 ARG NH2 1 1
6 973 1 1 7 ARG O O -0.481 -1.129 -1.527 1.00 . A A . 9 ARG O 1 1
6 974 1 1 8 TRP C C -1.447 -4.209 -2.829 1.00 . A A . 10 TRP C 1 1
6 975 1 1 8 TRP CA C -2.231 -3.297 -1.830 1.00 . A A . 10 TRP CA 1 1
6 976 1 1 8 TRP CB C -3.638 -3.847 -1.477 1.00 . A A . 10 TRP CB 1 1
6 977 1 1 8 TRP CD1 C -3.758 -6.432 -1.412 1.00 . A A . 10 TRP CD1 1 1
6 978 1 1 8 TRP CD2 C -3.365 -5.491 0.558 1.00 . A A . 10 TRP CD2 1 1
6 979 1 1 8 TRP CE2 C -3.328 -6.900 0.694 1.00 . A A . 10 TRP CE2 1 1
6 980 1 1 8 TRP CE3 C -3.118 -4.652 1.668 1.00 . A A . 10 TRP CE3 1 1
6 981 1 1 8 TRP CG C -3.624 -5.198 -0.763 1.00 . A A . 10 TRP CG 1 1
6 982 1 1 8 TRP CH2 C -2.796 -6.638 3.040 1.00 . A A . 10 TRP CH2 1 1
6 983 1 1 8 TRP CZ2 C -3.034 -7.481 1.950 1.00 . A A . 10 TRP CZ2 1 1
6 984 1 1 8 TRP CZ3 C -2.838 -5.244 2.901 1.00 . A A . 10 TRP CZ3 1 1
6 985 1 1 8 TRP H H -3.217 -1.672 -2.941 1.00 . A A . 10 TRP H 1 1
6 986 1 1 8 TRP HA H -1.673 -3.239 -0.870 1.00 . A A . 10 TRP HA 1 1
6 987 1 1 8 TRP HB2 H -4.178 -3.138 -0.829 1.00 . A A . 10 TRP HB2 1 1
6 988 1 1 8 TRP HB3 H -4.254 -3.923 -2.390 1.00 . A A . 10 TRP HB3 1 1
6 989 1 1 8 TRP HD1 H -3.908 -6.490 -2.479 1.00 . A A . 10 TRP HD1 1 1
6 990 1 1 8 TRP HE1 H -3.548 -8.517 -0.740 1.00 . A A . 10 TRP HE1 1 1
6 991 1 1 8 TRP HE3 H -3.148 -3.579 1.550 1.00 . A A . 10 TRP HE3 1 1
6 992 1 1 8 TRP HH2 H -2.571 -7.070 4.006 1.00 . A A . 10 TRP HH2 1 1
6 993 1 1 8 TRP HZ2 H -2.993 -8.555 2.063 1.00 . A A . 10 TRP HZ2 1 1
6 994 1 1 8 TRP HZ3 H -2.647 -4.618 3.760 1.00 . A A . 10 TRP HZ3 1 1
6 995 1 1 8 TRP N N -2.422 -1.919 -2.348 1.00 . A A . 10 TRP N 1 1
6 996 1 1 8 TRP NE1 N -3.576 -7.514 -0.526 1.00 . A A . 10 TRP NE1 1 1
6 997 1 1 8 TRP O O -1.791 -4.337 -4.008 1.00 . A A . 10 TRP O 1 1
6 998 1 1 9 LYS C C -0.331 -7.284 -3.147 1.00 . A A . 11 LYS C 1 1
6 999 1 1 9 LYS CA C 0.379 -5.892 -3.066 1.00 . A A . 11 LYS CA 1 1
6 1000 1 1 9 LYS CB C 1.773 -5.965 -2.386 1.00 . A A . 11 LYS CB 1 1
6 1001 1 1 9 LYS CD C 3.706 -4.547 -1.427 1.00 . A A . 11 LYS CD 1 1
6 1002 1 1 9 LYS CE C 4.483 -3.215 -1.442 1.00 . A A . 11 LYS CE 1 1
6 1003 1 1 9 LYS CG C 2.658 -4.705 -2.554 1.00 . A A . 11 LYS CG 1 1
6 1004 1 1 9 LYS H H -0.178 -4.628 -1.338 1.00 . A A . 11 LYS H 1 1
6 1005 1 1 9 LYS HA H 0.544 -5.531 -4.099 1.00 . A A . 11 LYS HA 1 1
6 1006 1 1 9 LYS HB2 H 1.627 -6.198 -1.313 1.00 . A A . 11 LYS HB2 1 1
6 1007 1 1 9 LYS HB3 H 2.332 -6.833 -2.779 1.00 . A A . 11 LYS HB3 1 1
6 1008 1 1 9 LYS HD2 H 3.216 -4.659 -0.439 1.00 . A A . 11 LYS HD2 1 1
6 1009 1 1 9 LYS HD3 H 4.427 -5.385 -1.483 1.00 . A A . 11 LYS HD3 1 1
6 1010 1 1 9 LYS HE2 H 5.273 -3.240 -0.665 1.00 . A A . 11 LYS HE2 1 1
6 1011 1 1 9 LYS HE3 H 5.014 -3.092 -2.407 1.00 . A A . 11 LYS HE3 1 1
6 1012 1 1 9 LYS HG2 H 3.150 -4.712 -3.546 1.00 . A A . 11 LYS HG2 1 1
6 1013 1 1 9 LYS HG3 H 2.014 -3.805 -2.565 1.00 . A A . 11 LYS HG3 1 1
6 1014 1 1 9 LYS HZ1 H 2.563 -2.177 -1.103 1.00 . A A . 11 LYS HZ1 1 1
6 1015 1 1 9 LYS N N -0.435 -4.909 -2.300 1.00 . A A . 11 LYS N 1 1
6 1016 1 1 9 LYS NZ N 3.578 -2.071 -1.203 1.00 . A A . 11 LYS NZ 1 1
6 1017 1 1 9 LYS O O -0.130 -8.195 -2.346 1.00 . A A . 11 LYS O 1 1
6 1018 1 1 10 NH2 HN1 H -1.686 -8.394 -4.015 1.00 . A A . 12 NH2 HN1 1 1
6 1019 1 1 10 NH2 HN2 H -1.518 -6.663 -4.616 1.00 . A A . 12 NH2 HN2 1 1
6 1020 1 1 10 NH2 N N -1.200 -7.500 -4.113 1.00 . A A . 12 NH2 N 1 1
7 1021 1 1 1 ACE C C 0.407 -4.489 1.769 1.00 . A A . 3 ACE C 1 1
7 1022 1 1 1 ACE CH3 C 0.929 -5.748 2.431 1.00 . A A . 3 ACE CH3 1 1
7 1023 1 1 1 ACE H1 H 2.026 -5.715 2.556 1.00 . A A . 3 ACE H1 1 1
7 1024 1 1 1 ACE H2 H 0.465 -5.905 3.421 1.00 . A A . 3 ACE H2 1 1
7 1025 1 1 1 ACE H3 H 0.692 -6.633 1.814 1.00 . A A . 3 ACE H3 1 1
7 1026 1 1 1 ACE O O -0.194 -4.548 0.699 1.00 . A A . 3 ACE O 1 1
7 1027 1 1 2 NLE C C 1.229 -0.976 1.780 1.00 . A A . 4 NLE C 1 1
7 1028 1 1 2 NLE CA C 0.104 -2.036 2.000 1.00 . A A . 4 NLE CA 1 1
7 1029 1 1 2 NLE CB C -0.992 -1.584 2.998 1.00 . A A . 4 NLE CB 1 1
7 1030 1 1 2 NLE CD C -1.804 -0.912 5.373 1.00 . A A . 4 NLE CD 1 1
7 1031 1 1 2 NLE CE C -2.958 -1.906 5.568 1.00 . A A . 4 NLE CE 1 1
7 1032 1 1 2 NLE CG C -0.646 -1.443 4.504 1.00 . A A . 4 NLE CG 1 1
7 1033 1 1 2 NLE H H 1.011 -3.478 3.372 1.00 . A A . 4 NLE H 1 1
7 1034 1 1 2 NLE HA H -0.433 -2.154 1.036 1.00 . A A . 4 NLE HA 1 1
7 1035 1 1 2 NLE HB2 H -1.835 -2.280 2.880 1.00 . A A . 4 NLE HB2 1 1
7 1036 1 1 2 NLE HB3 H -1.390 -0.623 2.645 1.00 . A A . 4 NLE HB3 1 1
7 1037 1 1 2 NLE HD2 H -2.192 0.035 4.952 1.00 . A A . 4 NLE HD2 1 1
7 1038 1 1 2 NLE HD3 H -1.402 -0.633 6.367 1.00 . A A . 4 NLE HD3 1 1
7 1039 1 1 2 NLE HE1 H -3.728 -1.495 6.247 1.00 . A A . 4 NLE HE1 1 1
7 1040 1 1 2 NLE HE2 H -3.465 -2.143 4.614 1.00 . A A . 4 NLE HE2 1 1
7 1041 1 1 2 NLE HE3 H -2.610 -2.859 6.008 1.00 . A A . 4 NLE HE3 1 1
7 1042 1 1 2 NLE HG2 H 0.214 -0.754 4.614 1.00 . A A . 4 NLE HG2 1 1
7 1043 1 1 2 NLE HG3 H -0.291 -2.408 4.914 1.00 . A A . 4 NLE HG3 1 1
7 1044 1 1 2 NLE N N 0.640 -3.355 2.429 1.00 . A A . 4 NLE N 1 1
7 1045 1 1 2 NLE O O 1.956 -0.595 2.702 1.00 . A A . 4 NLE O 1 1
7 1046 1 1 3 ASP C C 1.701 1.995 0.223 1.00 . A A . 5 ASP C 1 1
7 1047 1 1 3 ASP CA C 2.330 0.567 0.155 1.00 . A A . 5 ASP CA 1 1
7 1048 1 1 3 ASP CB C 2.822 0.275 -1.288 1.00 . A A . 5 ASP CB 1 1
7 1049 1 1 3 ASP CG C 3.796 -0.900 -1.433 1.00 . A A . 5 ASP CG 1 1
7 1050 1 1 3 ASP H H 0.655 -0.866 -0.133 1.00 . A A . 5 ASP H 1 1
7 1051 1 1 3 ASP HA H 3.211 0.525 0.829 1.00 . A A . 5 ASP HA 1 1
7 1052 1 1 3 ASP HB2 H 1.962 0.175 -1.980 1.00 . A A . 5 ASP HB2 1 1
7 1053 1 1 3 ASP HB3 H 3.366 1.155 -1.670 1.00 . A A . 5 ASP HB3 1 1
7 1054 1 1 3 ASP N N 1.336 -0.476 0.540 1.00 . A A . 5 ASP N 1 1
7 1055 1 1 3 ASP O O 0.702 2.261 -0.451 1.00 . A A . 5 ASP O 1 1
7 1056 1 1 3 ASP OD1 O 4.962 -0.780 -1.053 1.00 . A A . 5 ASP OD1 1 1
7 1057 1 1 4 TRP C C 1.650 5.121 -0.218 1.00 . A A . 6 TRP C 1 1
7 1058 1 1 4 TRP CA C 1.793 4.325 1.144 1.00 . A A . 6 TRP CA 1 1
7 1059 1 1 4 TRP CB C 2.743 5.040 2.153 1.00 . A A . 6 TRP CB 1 1
7 1060 1 1 4 TRP CD1 C 2.567 7.649 1.896 1.00 . A A . 6 TRP CD1 1 1
7 1061 1 1 4 TRP CD2 C 1.504 6.815 3.665 1.00 . A A . 6 TRP CD2 1 1
7 1062 1 1 4 TRP CE2 C 1.289 8.216 3.593 1.00 . A A . 6 TRP CE2 1 1
7 1063 1 1 4 TRP CE3 C 0.883 6.047 4.680 1.00 . A A . 6 TRP CE3 1 1
7 1064 1 1 4 TRP CG C 2.307 6.449 2.596 1.00 . A A . 6 TRP CG 1 1
7 1065 1 1 4 TRP CH2 C -0.149 8.083 5.532 1.00 . A A . 6 TRP CH2 1 1
7 1066 1 1 4 TRP CZ2 C 0.450 8.854 4.534 1.00 . A A . 6 TRP CZ2 1 1
7 1067 1 1 4 TRP CZ3 C 0.065 6.701 5.603 1.00 . A A . 6 TRP CZ3 1 1
7 1068 1 1 4 TRP H H 3.144 2.602 1.479 1.00 . A A . 6 TRP H 1 1
7 1069 1 1 4 TRP HA H 0.802 4.248 1.628 1.00 . A A . 6 TRP HA 1 1
7 1070 1 1 4 TRP HB2 H 2.861 4.420 3.063 1.00 . A A . 6 TRP HB2 1 1
7 1071 1 1 4 TRP HB3 H 3.761 5.101 1.724 1.00 . A A . 6 TRP HB3 1 1
7 1072 1 1 4 TRP HD1 H 3.095 7.696 0.954 1.00 . A A . 6 TRP HD1 1 1
7 1073 1 1 4 TRP HE1 H 1.943 9.736 2.192 1.00 . A A . 6 TRP HE1 1 1
7 1074 1 1 4 TRP HE3 H 1.034 4.982 4.738 1.00 . A A . 6 TRP HE3 1 1
7 1075 1 1 4 TRP HH2 H -0.793 8.559 6.258 1.00 . A A . 6 TRP HH2 1 1
7 1076 1 1 4 TRP HZ2 H 0.271 9.919 4.479 1.00 . A A . 6 TRP HZ2 1 1
7 1077 1 1 4 TRP HZ3 H -0.415 6.130 6.384 1.00 . A A . 6 TRP HZ3 1 1
7 1078 1 1 4 TRP N N 2.299 2.924 0.996 1.00 . A A . 6 TRP N 1 1
7 1079 1 1 4 TRP NE1 N 1.945 8.757 2.501 1.00 . A A . 6 TRP NE1 1 1
7 1080 1 1 4 TRP O O 2.592 5.069 -1.017 1.00 . A A . 6 TRP O 1 1
7 1081 1 1 5 PRO C C -1.764 5.129 0.587 1.00 . A A . 7 PRO C 1 1
7 1082 1 1 5 PRO CA C -0.589 6.158 0.413 1.00 . A A . 7 PRO CA 1 1
7 1083 1 1 5 PRO CB C -1.046 7.519 -0.150 1.00 . A A . 7 PRO CB 1 1
7 1084 1 1 5 PRO CD C 0.459 6.631 -1.791 1.00 . A A . 7 PRO CD 1 1
7 1085 1 1 5 PRO CG C -0.847 7.413 -1.662 1.00 . A A . 7 PRO CG 1 1
7 1086 1 1 5 PRO HA H -0.210 6.343 1.433 1.00 . A A . 7 PRO HA 1 1
7 1087 1 1 5 PRO HB2 H -2.081 7.787 0.132 1.00 . A A . 7 PRO HB2 1 1
7 1088 1 1 5 PRO HB3 H -0.405 8.327 0.260 1.00 . A A . 7 PRO HB3 1 1
7 1089 1 1 5 PRO HD2 H 0.464 5.975 -2.683 1.00 . A A . 7 PRO HD2 1 1
7 1090 1 1 5 PRO HD3 H 1.325 7.318 -1.879 1.00 . A A . 7 PRO HD3 1 1
7 1091 1 1 5 PRO HG2 H -1.681 6.846 -2.120 1.00 . A A . 7 PRO HG2 1 1
7 1092 1 1 5 PRO HG3 H -0.806 8.398 -2.162 1.00 . A A . 7 PRO HG3 1 1
7 1093 1 1 5 PRO N N 0.536 5.855 -0.534 1.00 . A A . 7 PRO N 1 1
7 1094 1 1 5 PRO O O -2.765 5.452 1.231 1.00 . A A . 7 PRO O 1 1
7 1095 1 1 6 . C C -2.877 1.965 -0.997 1.00 . A A . 8 4J2 C 1 1
7 1096 1 1 6 . CA C -2.588 2.778 0.308 1.00 . A A . 8 4J2 CA 1 1
7 1097 1 1 6 . CB C -2.045 1.800 1.396 1.00 . A A . 8 4J2 CB 1 1
7 1098 1 1 6 . CD1 C -2.795 2.882 3.565 1.00 . A A . 8 4J2 CD1 1 1
7 1099 1 1 6 . CD2 C -0.516 2.107 3.393 1.00 . A A . 8 4J2 CD2 1 1
7 1100 1 1 6 . CE1 C -2.590 3.249 4.892 1.00 . A A . 8 4J2 CE1 1 1
7 1101 1 1 6 . CE2 C -0.287 2.444 4.725 1.00 . A A . 8 4J2 CE2 1 1
7 1102 1 1 6 . CE3 C 0.946 2.198 5.332 1.00 . A A . 8 4J2 CE3 1 1
7 1103 1 1 6 . CE4 C 1.142 2.528 6.669 1.00 . A A . 8 4J2 CE4 1 1
7 1104 1 1 6 . CG C -1.767 2.316 2.815 1.00 . A A . 8 4J2 CG 1 1
7 1105 1 1 6 . CZ1 C -1.350 3.030 5.495 1.00 . A A . 8 4J2 CZ1 1 1
7 1106 1 1 6 . CZ2 C -1.126 3.345 6.836 1.00 . A A . 8 4J2 CZ2 1 1
7 1107 1 1 6 . CZ3 C 0.115 3.098 7.415 1.00 . A A . 8 4J2 CZ3 1 1
7 1108 1 1 6 . H H -0.708 3.731 -0.354 1.00 . A A . 8 4J2 H 1 1
7 1109 1 1 6 . HA H -3.566 3.175 0.645 1.00 . A A . 8 4J2 HA 1 1
7 1110 1 1 6 . HB1 H -1.137 1.303 1.009 1.00 . A A . 8 4J2 HB1 1 1
7 1111 1 1 6 . HB2 H -2.758 0.964 1.490 1.00 . A A . 8 4J2 HB2 1 1
7 1112 1 1 6 . HD1 H -3.759 3.016 3.099 1.00 . A A . 8 4J2 HD1 1 1
7 1113 1 1 6 . HD2 H 0.261 1.632 2.813 1.00 . A A . 8 4J2 HD2 1 1
7 1114 1 1 6 . HE1 H -3.411 3.684 5.447 1.00 . A A . 8 4J2 HE1 1 1
7 1115 1 1 6 . HE3 H 1.758 1.746 4.778 1.00 . A A . 8 4J2 HE3 1 1
7 1116 1 1 6 . HE4 H 2.100 2.336 7.133 1.00 . A A . 8 4J2 HE4 1 1
7 1117 1 1 6 . HZ2 H -1.908 3.784 7.442 1.00 . A A . 8 4J2 HZ2 1 1
7 1118 1 1 6 . HZ23 H 0.282 3.347 8.454 1.00 . A A . 8 4J2 HZ23 1 1
7 1119 1 1 6 . N N -1.627 3.897 0.077 1.00 . A A . 8 4J2 N 1 1
7 1120 1 1 6 . O O -4.039 1.732 -1.338 1.00 . A A . 8 4J2 O 1 1
7 1121 1 1 7 ARG C C -1.566 -0.931 -2.168 1.00 . A A . 9 ARG C 1 1
7 1122 1 1 7 ARG CA C -1.900 0.476 -2.754 1.00 . A A . 9 ARG CA 1 1
7 1123 1 1 7 ARG CB C -0.896 0.840 -3.882 1.00 . A A . 9 ARG CB 1 1
7 1124 1 1 7 ARG CD C -2.290 2.455 -5.430 1.00 . A A . 9 ARG CD 1 1
7 1125 1 1 7 ARG CG C -1.019 2.222 -4.582 1.00 . A A . 9 ARG CG 1 1
7 1126 1 1 7 ARG CZ C -3.797 4.009 -4.146 1.00 . A A . 9 ARG CZ 1 1
7 1127 1 1 7 ARG H H -0.926 1.666 -1.176 1.00 . A A . 9 ARG H 1 1
7 1128 1 1 7 ARG HA H -2.918 0.480 -3.197 1.00 . A A . 9 ARG HA 1 1
7 1129 1 1 7 ARG HB2 H 0.126 0.748 -3.472 1.00 . A A . 9 ARG HB2 1 1
7 1130 1 1 7 ARG HB3 H -0.943 0.055 -4.656 1.00 . A A . 9 ARG HB3 1 1
7 1131 1 1 7 ARG HD2 H -2.110 3.238 -6.192 1.00 . A A . 9 ARG HD2 1 1
7 1132 1 1 7 ARG HD3 H -2.519 1.551 -6.026 1.00 . A A . 9 ARG HD3 1 1
7 1133 1 1 7 ARG HG2 H -0.907 3.032 -3.835 1.00 . A A . 9 ARG HG2 1 1
7 1134 1 1 7 ARG HG3 H -0.141 2.341 -5.246 1.00 . A A . 9 ARG HG3 1 1
7 1135 1 1 7 ARG HH11 H -2.291 4.939 -4.979 1.00 . A A . 9 ARG HH11 1 1
7 1136 1 1 7 ARG HH12 H -3.465 5.965 -3.994 1.00 . A A . 9 ARG HH12 1 1
7 1137 1 1 7 ARG HH21 H -5.262 3.190 -3.206 1.00 . A A . 9 ARG HH21 1 1
7 1138 1 1 7 ARG HH22 H -5.079 5.017 -3.009 1.00 . A A . 9 ARG HH22 1 1
7 1139 1 1 7 ARG N N -1.814 1.465 -1.655 1.00 . A A . 9 ARG N 1 1
7 1140 1 1 7 ARG NE N -3.480 2.797 -4.605 1.00 . A A . 9 ARG NE 1 1
7 1141 1 1 7 ARG NH1 N -3.111 5.095 -4.391 1.00 . A A . 9 ARG NH1 1 1
7 1142 1 1 7 ARG NH2 N -4.851 4.105 -3.404 1.00 . A A . 9 ARG NH2 1 1
7 1143 1 1 7 ARG O O -0.506 -1.144 -1.565 1.00 . A A . 9 ARG O 1 1
7 1144 1 1 8 TRP C C -1.432 -4.178 -2.702 1.00 . A A . 10 TRP C 1 1
7 1145 1 1 8 TRP CA C -2.315 -3.261 -1.788 1.00 . A A . 10 TRP CA 1 1
7 1146 1 1 8 TRP CB C -3.742 -3.816 -1.532 1.00 . A A . 10 TRP CB 1 1
7 1147 1 1 8 TRP CD1 C -3.833 -6.399 -1.432 1.00 . A A . 10 TRP CD1 1 1
7 1148 1 1 8 TRP CD2 C -3.568 -5.423 0.544 1.00 . A A . 10 TRP CD2 1 1
7 1149 1 1 8 TRP CE2 C -3.490 -6.830 0.698 1.00 . A A . 10 TRP CE2 1 1
7 1150 1 1 8 TRP CE3 C -3.373 -4.563 1.650 1.00 . A A . 10 TRP CE3 1 1
7 1151 1 1 8 TRP CG C -3.769 -5.154 -0.794 1.00 . A A . 10 TRP CG 1 1
7 1152 1 1 8 TRP CH2 C -3.016 -6.525 3.051 1.00 . A A . 10 TRP CH2 1 1
7 1153 1 1 8 TRP CZ2 C -3.203 -7.386 1.966 1.00 . A A . 10 TRP CZ2 1 1
7 1154 1 1 8 TRP CZ3 C -3.102 -5.135 2.895 1.00 . A A . 10 TRP CZ3 1 1
7 1155 1 1 8 TRP H H -3.247 -1.649 -2.968 1.00 . A A . 10 TRP H 1 1
7 1156 1 1 8 TRP HA H -1.831 -3.174 -0.792 1.00 . A A . 10 TRP HA 1 1
7 1157 1 1 8 TRP HB2 H -4.337 -3.102 -0.940 1.00 . A A . 10 TRP HB2 1 1
7 1158 1 1 8 TRP HB3 H -4.288 -3.915 -2.488 1.00 . A A . 10 TRP HB3 1 1
7 1159 1 1 8 TRP HD1 H -3.904 -6.474 -2.506 1.00 . A A . 10 TRP HD1 1 1
7 1160 1 1 8 TRP HE1 H -3.558 -8.465 -0.730 1.00 . A A . 10 TRP HE1 1 1
7 1161 1 1 8 TRP HE3 H -3.419 -3.492 1.520 1.00 . A A . 10 TRP HE3 1 1
7 1162 1 1 8 TRP HH2 H -2.795 -6.938 4.025 1.00 . A A . 10 TRP HH2 1 1
7 1163 1 1 8 TRP HZ2 H -3.122 -8.457 2.090 1.00 . A A . 10 TRP HZ2 1 1
7 1164 1 1 8 TRP HZ3 H -2.941 -4.495 3.750 1.00 . A A . 10 TRP HZ3 1 1
7 1165 1 1 8 TRP N N -2.477 -1.895 -2.343 1.00 . A A . 10 TRP N 1 1
7 1166 1 1 8 TRP NE1 N -3.663 -7.464 -0.525 1.00 . A A . 10 TRP NE1 1 1
7 1167 1 1 8 TRP O O -1.588 -4.226 -3.927 1.00 . A A . 10 TRP O 1 1
7 1168 1 1 9 LYS C C -0.404 -7.235 -3.163 1.00 . A A . 11 LYS C 1 1
7 1169 1 1 9 LYS CA C 0.350 -5.924 -2.760 1.00 . A A . 11 LYS CA 1 1
7 1170 1 1 9 LYS CB C 1.565 -6.204 -1.829 1.00 . A A . 11 LYS CB 1 1
7 1171 1 1 9 LYS CD C 3.298 -4.422 -2.622 1.00 . A A . 11 LYS CD 1 1
7 1172 1 1 9 LYS CE C 4.156 -3.204 -2.230 1.00 . A A . 11 LYS CE 1 1
7 1173 1 1 9 LYS CG C 2.489 -5.020 -1.450 1.00 . A A . 11 LYS CG 1 1
7 1174 1 1 9 LYS H H -0.462 -4.793 -1.050 1.00 . A A . 11 LYS H 1 1
7 1175 1 1 9 LYS HA H 0.752 -5.467 -3.683 1.00 . A A . 11 LYS HA 1 1
7 1176 1 1 9 LYS HB2 H 1.185 -6.657 -0.892 1.00 . A A . 11 LYS HB2 1 1
7 1177 1 1 9 LYS HB3 H 2.185 -6.997 -2.283 1.00 . A A . 11 LYS HB3 1 1
7 1178 1 1 9 LYS HD2 H 3.963 -5.206 -3.031 1.00 . A A . 11 LYS HD2 1 1
7 1179 1 1 9 LYS HD3 H 2.631 -4.148 -3.461 1.00 . A A . 11 LYS HD3 1 1
7 1180 1 1 9 LYS HE2 H 4.773 -3.439 -1.339 1.00 . A A . 11 LYS HE2 1 1
7 1181 1 1 9 LYS HE3 H 4.880 -2.985 -3.040 1.00 . A A . 11 LYS HE3 1 1
7 1182 1 1 9 LYS HG2 H 1.888 -4.227 -0.964 1.00 . A A . 11 LYS HG2 1 1
7 1183 1 1 9 LYS HG3 H 3.189 -5.357 -0.662 1.00 . A A . 11 LYS HG3 1 1
7 1184 1 1 9 LYS HZ1 H 2.311 -1.988 -2.197 1.00 . A A . 11 LYS HZ1 1 1
7 1185 1 1 9 LYS N N -0.541 -4.953 -2.069 1.00 . A A . 11 LYS N 1 1
7 1186 1 1 9 LYS NZ N 3.315 -2.009 -1.997 1.00 . A A . 11 LYS NZ 1 1
7 1187 1 1 9 LYS O O -0.407 -8.257 -2.480 1.00 . A A . 11 LYS O 1 1
7 1188 1 1 10 NH2 HN1 H -1.627 -8.118 -4.404 1.00 . A A . 12 NH2 HN1 1 1
7 1189 1 1 10 NH2 HN2 H -1.282 -6.336 -4.696 1.00 . A A . 12 NH2 HN2 1 1
7 1190 1 1 10 NH2 N N -1.084 -7.259 -4.292 1.00 . A A . 12 NH2 N 1 1
8 1191 1 1 1 ACE C C 0.719 -4.200 1.089 1.00 . A A . 3 ACE C 1 1
8 1192 1 1 1 ACE CH3 C 1.053 -5.621 1.501 1.00 . A A . 3 ACE CH3 1 1
8 1193 1 1 1 ACE H1 H 1.340 -6.223 0.620 1.00 . A A . 3 ACE H1 1 1
8 1194 1 1 1 ACE H2 H 1.898 -5.646 2.211 1.00 . A A . 3 ACE H2 1 1
8 1195 1 1 1 ACE H3 H 0.185 -6.121 1.968 1.00 . A A . 3 ACE H3 1 1
8 1196 1 1 1 ACE O O 0.811 -3.852 -0.087 1.00 . A A . 3 ACE O 1 1
8 1197 1 1 2 NLE C C 1.050 -0.957 1.741 1.00 . A A . 4 NLE C 1 1
8 1198 1 1 2 NLE CA C -0.119 -1.988 1.823 1.00 . A A . 4 NLE CA 1 1
8 1199 1 1 2 NLE CB C -1.220 -1.585 2.832 1.00 . A A . 4 NLE CB 1 1
8 1200 1 1 2 NLE CD C -2.162 -1.248 5.174 1.00 . A A . 4 NLE CD 1 1
8 1201 1 1 2 NLE CE C -1.907 -1.375 6.677 1.00 . A A . 4 NLE CE 1 1
8 1202 1 1 2 NLE CG C -0.933 -1.666 4.348 1.00 . A A . 4 NLE CG 1 1
8 1203 1 1 2 NLE H H 0.249 -3.818 2.991 1.00 . A A . 4 NLE H 1 1
8 1204 1 1 2 NLE HA H -0.650 -1.977 0.847 1.00 . A A . 4 NLE HA 1 1
8 1205 1 1 2 NLE HB2 H -2.115 -2.176 2.598 1.00 . A A . 4 NLE HB2 1 1
8 1206 1 1 2 NLE HB3 H -1.531 -0.557 2.600 1.00 . A A . 4 NLE HB3 1 1
8 1207 1 1 2 NLE HD2 H -3.039 -1.867 4.899 1.00 . A A . 4 NLE HD2 1 1
8 1208 1 1 2 NLE HD3 H -2.445 -0.203 4.936 1.00 . A A . 4 NLE HD3 1 1
8 1209 1 1 2 NLE HE1 H -1.660 -2.415 6.962 1.00 . A A . 4 NLE HE1 1 1
8 1210 1 1 2 NLE HE2 H -1.071 -0.728 7.003 1.00 . A A . 4 NLE HE2 1 1
8 1211 1 1 2 NLE HE3 H -2.800 -1.079 7.258 1.00 . A A . 4 NLE HE3 1 1
8 1212 1 1 2 NLE HG2 H -0.071 -1.019 4.606 1.00 . A A . 4 NLE HG2 1 1
8 1213 1 1 2 NLE HG3 H -0.630 -2.694 4.627 1.00 . A A . 4 NLE HG3 1 1
8 1214 1 1 2 NLE N N 0.318 -3.388 2.066 1.00 . A A . 4 NLE N 1 1
8 1215 1 1 2 NLE O O 1.721 -0.641 2.729 1.00 . A A . 4 NLE O 1 1
8 1216 1 1 3 ASP C C 1.714 2.035 0.296 1.00 . A A . 5 ASP C 1 1
8 1217 1 1 3 ASP CA C 2.309 0.594 0.248 1.00 . A A . 5 ASP CA 1 1
8 1218 1 1 3 ASP CB C 2.902 0.295 -1.155 1.00 . A A . 5 ASP CB 1 1
8 1219 1 1 3 ASP CG C 3.785 -0.957 -1.244 1.00 . A A . 5 ASP CG 1 1
8 1220 1 1 3 ASP H H 0.640 -0.798 -0.202 1.00 . A A . 5 ASP H 1 1
8 1221 1 1 3 ASP HA H 3.131 0.511 0.991 1.00 . A A . 5 ASP HA 1 1
8 1222 1 1 3 ASP HB2 H 2.103 0.275 -1.922 1.00 . A A . 5 ASP HB2 1 1
8 1223 1 1 3 ASP HB3 H 3.542 1.139 -1.461 1.00 . A A . 5 ASP HB3 1 1
8 1224 1 1 3 ASP N N 1.248 -0.410 0.536 1.00 . A A . 5 ASP N 1 1
8 1225 1 1 3 ASP O O 0.745 2.328 -0.413 1.00 . A A . 5 ASP O 1 1
8 1226 1 1 3 ASP OD1 O 4.957 -0.908 -0.870 1.00 . A A . 5 ASP OD1 1 1
8 1227 1 1 4 TRP C C 1.711 5.177 -0.059 1.00 . A A . 6 TRP C 1 1
8 1228 1 1 4 TRP CA C 1.797 4.334 1.280 1.00 . A A . 6 TRP CA 1 1
8 1229 1 1 4 TRP CB C 2.712 5.004 2.347 1.00 . A A . 6 TRP CB 1 1
8 1230 1 1 4 TRP CD1 C 2.557 7.624 2.229 1.00 . A A . 6 TRP CD1 1 1
8 1231 1 1 4 TRP CD2 C 1.385 6.692 3.877 1.00 . A A . 6 TRP CD2 1 1
8 1232 1 1 4 TRP CE2 C 1.174 8.095 3.873 1.00 . A A . 6 TRP CE2 1 1
8 1233 1 1 4 TRP CE3 C 0.701 5.867 4.804 1.00 . A A . 6 TRP CE3 1 1
8 1234 1 1 4 TRP CG C 2.252 6.386 2.841 1.00 . A A . 6 TRP CG 1 1
8 1235 1 1 4 TRP CH2 C -0.382 7.853 5.708 1.00 . A A . 6 TRP CH2 1 1
8 1236 1 1 4 TRP CZ2 C 0.279 8.681 4.797 1.00 . A A . 6 TRP CZ2 1 1
8 1237 1 1 4 TRP CZ3 C -0.173 6.468 5.712 1.00 . A A . 6 TRP CZ3 1 1
8 1238 1 1 4 TRP H H 3.118 2.592 1.613 1.00 . A A . 6 TRP H 1 1
8 1239 1 1 4 TRP HA H 0.787 4.245 1.723 1.00 . A A . 6 TRP HA 1 1
8 1240 1 1 4 TRP HB2 H 2.808 4.346 3.233 1.00 . A A . 6 TRP HB2 1 1
8 1241 1 1 4 TRP HB3 H 3.744 5.090 1.953 1.00 . A A . 6 TRP HB3 1 1
8 1242 1 1 4 TRP HD1 H 3.151 7.724 1.332 1.00 . A A . 6 TRP HD1 1 1
8 1243 1 1 4 TRP HE1 H 1.917 9.692 2.608 1.00 . A A . 6 TRP HE1 1 1
8 1244 1 1 4 TRP HE3 H 0.848 4.800 4.808 1.00 . A A . 6 TRP HE3 1 1
8 1245 1 1 4 TRP HH2 H -1.070 8.288 6.420 1.00 . A A . 6 TRP HH2 1 1
8 1246 1 1 4 TRP HZ2 H 0.103 9.746 4.793 1.00 . A A . 6 TRP HZ2 1 1
8 1247 1 1 4 TRP HZ3 H -0.700 5.855 6.426 1.00 . A A . 6 TRP HZ3 1 1
8 1248 1 1 4 TRP N N 2.298 2.936 1.107 1.00 . A A . 6 TRP N 1 1
8 1249 1 1 4 TRP NE1 N 1.899 8.697 2.859 1.00 . A A . 6 TRP NE1 1 1
8 1250 1 1 4 TRP O O 2.688 5.149 -0.818 1.00 . A A . 6 TRP O 1 1
8 1251 1 1 5 PRO C C -1.753 5.192 0.558 1.00 . A A . 7 PRO C 1 1
8 1252 1 1 5 PRO CA C -0.546 6.198 0.517 1.00 . A A . 7 PRO CA 1 1
8 1253 1 1 5 PRO CB C -0.926 7.615 0.039 1.00 . A A . 7 PRO CB 1 1
8 1254 1 1 5 PRO CD C 0.598 6.762 -1.614 1.00 . A A . 7 PRO CD 1 1
8 1255 1 1 5 PRO CG C -0.663 7.613 -1.467 1.00 . A A . 7 PRO CG 1 1
8 1256 1 1 5 PRO HA H -0.217 6.297 1.565 1.00 . A A . 7 PRO HA 1 1
8 1257 1 1 5 PRO HB2 H -1.962 7.903 0.294 1.00 . A A . 7 PRO HB2 1 1
8 1258 1 1 5 PRO HB3 H -0.275 8.364 0.535 1.00 . A A . 7 PRO HB3 1 1
8 1259 1 1 5 PRO HD2 H 0.576 6.149 -2.536 1.00 . A A . 7 PRO HD2 1 1
8 1260 1 1 5 PRO HD3 H 1.501 7.402 -1.664 1.00 . A A . 7 PRO HD3 1 1
8 1261 1 1 5 PRO HG2 H -1.509 7.139 -2.000 1.00 . A A . 7 PRO HG2 1 1
8 1262 1 1 5 PRO HG3 H -0.544 8.630 -1.884 1.00 . A A . 7 PRO HG3 1 1
8 1263 1 1 5 PRO N N 0.612 5.925 -0.396 1.00 . A A . 7 PRO N 1 1
8 1264 1 1 5 PRO O O -2.824 5.546 1.059 1.00 . A A . 7 PRO O 1 1
8 1265 1 1 6 . C C -2.802 2.073 -1.065 1.00 . A A . 8 4J2 C 1 1
8 1266 1 1 6 . CA C -2.570 2.843 0.277 1.00 . A A . 8 4J2 CA 1 1
8 1267 1 1 6 . CB C -2.109 1.857 1.397 1.00 . A A . 8 4J2 CB 1 1
8 1268 1 1 6 . CD1 C -2.992 2.911 3.527 1.00 . A A . 8 4J2 CD1 1 1
8 1269 1 1 6 . CD2 C -0.725 2.081 3.506 1.00 . A A . 8 4J2 CD2 1 1
8 1270 1 1 6 . CE1 C -2.890 3.207 4.883 1.00 . A A . 8 4J2 CE1 1 1
8 1271 1 1 6 . CE2 C -0.603 2.341 4.869 1.00 . A A . 8 4J2 CE2 1 1
8 1272 1 1 6 . CE3 C 0.567 2.031 5.564 1.00 . A A . 8 4J2 CE3 1 1
8 1273 1 1 6 . CE4 C 0.658 2.288 6.927 1.00 . A A . 8 4J2 CE4 1 1
8 1274 1 1 6 . CG C -1.921 2.348 2.838 1.00 . A A . 8 4J2 CG 1 1
8 1275 1 1 6 . CZ1 C -1.713 2.919 5.576 1.00 . A A . 8 4J2 CZ1 1 1
8 1276 1 1 6 . CZ2 C -1.597 3.160 6.946 1.00 . A A . 8 4J2 CZ2 1 1
8 1277 1 1 6 . CZ3 C -0.416 2.849 7.614 1.00 . A A . 8 4J2 CZ3 1 1
8 1278 1 1 6 . H H -0.616 3.746 -0.217 1.00 . A A . 8 4J2 H 1 1
8 1279 1 1 6 . HA H -3.558 3.254 0.566 1.00 . A A . 8 4J2 HA 1 1
8 1280 1 1 6 . HB1 H -1.178 1.360 1.068 1.00 . A A . 8 4J2 HB1 1 1
8 1281 1 1 6 . HB2 H -2.833 1.024 1.435 1.00 . A A . 8 4J2 HB2 1 1
8 1282 1 1 6 . HD1 H -3.913 3.089 2.994 1.00 . A A . 8 4J2 HD1 1 1
8 1283 1 1 6 . HD2 H 0.089 1.616 2.967 1.00 . A A . 8 4J2 HD2 1 1
8 1284 1 1 6 . HE1 H -3.744 3.637 5.390 1.00 . A A . 8 4J2 HE1 1 1
8 1285 1 1 6 . HE3 H 1.412 1.584 5.056 1.00 . A A . 8 4J2 HE3 1 1
8 1286 1 1 6 . HE4 H 1.566 2.046 7.459 1.00 . A A . 8 4J2 HE4 1 1
8 1287 1 1 6 . HZ2 H -2.417 3.590 7.506 1.00 . A A . 8 4J2 HZ2 1 1
8 1288 1 1 6 . HZ23 H -0.333 3.040 8.674 1.00 . A A . 8 4J2 HZ23 1 1
8 1289 1 1 6 . N N -1.574 3.939 0.111 1.00 . A A . 8 4J2 N 1 1
8 1290 1 1 6 . O O -3.899 2.108 -1.624 1.00 . A A . 8 4J2 O 1 1
8 1291 1 1 7 ARG C C -1.502 -1.003 -2.179 1.00 . A A . 9 ARG C 1 1
8 1292 1 1 7 ARG CA C -1.860 0.426 -2.700 1.00 . A A . 9 ARG CA 1 1
8 1293 1 1 7 ARG CB C -0.890 0.862 -3.830 1.00 . A A . 9 ARG CB 1 1
8 1294 1 1 7 ARG CD C -0.567 3.448 -3.873 1.00 . A A . 9 ARG CD 1 1
8 1295 1 1 7 ARG CG C -1.190 2.205 -4.545 1.00 . A A . 9 ARG CG 1 1
8 1296 1 1 7 ARG CZ C -2.160 5.352 -4.249 1.00 . A A . 9 ARG CZ 1 1
8 1297 1 1 7 ARG H H -0.893 1.515 -1.040 1.00 . A A . 9 ARG H 1 1
8 1298 1 1 7 ARG HA H -2.885 0.423 -3.125 1.00 . A A . 9 ARG HA 1 1
8 1299 1 1 7 ARG HB2 H 0.149 0.836 -3.457 1.00 . A A . 9 ARG HB2 1 1
8 1300 1 1 7 ARG HB3 H -0.910 0.070 -4.601 1.00 . A A . 9 ARG HB3 1 1
8 1301 1 1 7 ARG HD2 H -0.763 3.484 -2.785 1.00 . A A . 9 ARG HD2 1 1
8 1302 1 1 7 ARG HD3 H 0.536 3.398 -3.946 1.00 . A A . 9 ARG HD3 1 1
8 1303 1 1 7 ARG HG2 H -0.811 2.160 -5.585 1.00 . A A . 9 ARG HG2 1 1
8 1304 1 1 7 ARG HG3 H -2.284 2.335 -4.656 1.00 . A A . 9 ARG HG3 1 1
8 1305 1 1 7 ARG HH11 H -2.812 4.078 -2.905 1.00 . A A . 9 ARG HH11 1 1
8 1306 1 1 7 ARG HH12 H -3.876 5.538 -3.248 1.00 . A A . 9 ARG HH12 1 1
8 1307 1 1 7 ARG HH21 H -1.654 6.653 -5.581 1.00 . A A . 9 ARG HH21 1 1
8 1308 1 1 7 ARG HH22 H -3.261 6.940 -4.713 1.00 . A A . 9 ARG HH22 1 1
8 1309 1 1 7 ARG N N -1.772 1.357 -1.551 1.00 . A A . 9 ARG N 1 1
8 1310 1 1 7 ARG NE N -1.028 4.700 -4.527 1.00 . A A . 9 ARG NE 1 1
8 1311 1 1 7 ARG NH1 N -3.042 4.962 -3.365 1.00 . A A . 9 ARG NH1 1 1
8 1312 1 1 7 ARG NH2 N -2.392 6.441 -4.906 1.00 . A A . 9 ARG NH2 1 1
8 1313 1 1 7 ARG O O -0.389 -1.251 -1.699 1.00 . A A . 9 ARG O 1 1
8 1314 1 1 8 TRP C C -1.613 -4.259 -2.807 1.00 . A A . 10 TRP C 1 1
8 1315 1 1 8 TRP CA C -2.288 -3.322 -1.753 1.00 . A A . 10 TRP CA 1 1
8 1316 1 1 8 TRP CB C -3.680 -3.822 -1.286 1.00 . A A . 10 TRP CB 1 1
8 1317 1 1 8 TRP CD1 C -4.021 -6.383 -1.453 1.00 . A A . 10 TRP CD1 1 1
8 1318 1 1 8 TRP CD2 C -3.371 -5.695 0.553 1.00 . A A . 10 TRP CD2 1 1
8 1319 1 1 8 TRP CE2 C -3.466 -7.110 0.547 1.00 . A A . 10 TRP CE2 1 1
8 1320 1 1 8 TRP CE3 C -2.973 -5.007 1.723 1.00 . A A . 10 TRP CE3 1 1
8 1321 1 1 8 TRP CG C -3.707 -5.240 -0.705 1.00 . A A . 10 TRP CG 1 1
8 1322 1 1 8 TRP CH2 C -2.758 -7.150 2.860 1.00 . A A . 10 TRP CH2 1 1
8 1323 1 1 8 TRP CZ2 C -3.152 -7.845 1.714 1.00 . A A . 10 TRP CZ2 1 1
8 1324 1 1 8 TRP CZ3 C -2.673 -5.751 2.865 1.00 . A A . 10 TRP CZ3 1 1
8 1325 1 1 8 TRP H H -3.278 -1.653 -2.806 1.00 . A A . 10 TRP H 1 1
8 1326 1 1 8 TRP HA H -1.663 -3.288 -0.836 1.00 . A A . 10 TRP HA 1 1
8 1327 1 1 8 TRP HB2 H -4.094 -3.138 -0.529 1.00 . A A . 10 TRP HB2 1 1
8 1328 1 1 8 TRP HB3 H -4.389 -3.776 -2.130 1.00 . A A . 10 TRP HB3 1 1
8 1329 1 1 8 TRP HD1 H -4.292 -6.320 -2.495 1.00 . A A . 10 TRP HD1 1 1
8 1330 1 1 8 TRP HE1 H -4.030 -8.537 -0.990 1.00 . A A . 10 TRP HE1 1 1
8 1331 1 1 8 TRP HE3 H -2.916 -3.931 1.727 1.00 . A A . 10 TRP HE3 1 1
8 1332 1 1 8 TRP HH2 H -2.517 -7.700 3.758 1.00 . A A . 10 TRP HH2 1 1
8 1333 1 1 8 TRP HZ2 H -3.217 -8.924 1.718 1.00 . A A . 10 TRP HZ2 1 1
8 1334 1 1 8 TRP HZ3 H -2.371 -5.238 3.767 1.00 . A A . 10 TRP HZ3 1 1
8 1335 1 1 8 TRP N N -2.458 -1.938 -2.267 1.00 . A A . 10 TRP N 1 1
8 1336 1 1 8 TRP NE1 N -3.877 -7.565 -0.697 1.00 . A A . 10 TRP NE1 1 1
8 1337 1 1 8 TRP O O -2.139 -4.500 -3.898 1.00 . A A . 10 TRP O 1 1
8 1338 1 1 9 LYS C C -0.174 -7.289 -2.794 1.00 . A A . 11 LYS C 1 1
8 1339 1 1 9 LYS CA C 0.258 -5.850 -3.216 1.00 . A A . 11 LYS CA 1 1
8 1340 1 1 9 LYS CB C 1.775 -5.594 -3.017 1.00 . A A . 11 LYS CB 1 1
8 1341 1 1 9 LYS CD C 3.755 -3.929 -3.313 1.00 . A A . 11 LYS CD 1 1
8 1342 1 1 9 LYS CE C 3.914 -3.345 -1.893 1.00 . A A . 11 LYS CE 1 1
8 1343 1 1 9 LYS CG C 2.323 -4.329 -3.726 1.00 . A A . 11 LYS CG 1 1
8 1344 1 1 9 LYS H H -0.102 -4.479 -1.518 1.00 . A A . 11 LYS H 1 1
8 1345 1 1 9 LYS HA H 0.049 -5.725 -4.297 1.00 . A A . 11 LYS HA 1 1
8 1346 1 1 9 LYS HB2 H 1.994 -5.560 -1.933 1.00 . A A . 11 LYS HB2 1 1
8 1347 1 1 9 LYS HB3 H 2.342 -6.466 -3.385 1.00 . A A . 11 LYS HB3 1 1
8 1348 1 1 9 LYS HD2 H 4.423 -4.804 -3.420 1.00 . A A . 11 LYS HD2 1 1
8 1349 1 1 9 LYS HD3 H 4.148 -3.192 -4.041 1.00 . A A . 11 LYS HD3 1 1
8 1350 1 1 9 LYS HE2 H 3.524 -4.057 -1.141 1.00 . A A . 11 LYS HE2 1 1
8 1351 1 1 9 LYS HE3 H 4.995 -3.252 -1.673 1.00 . A A . 11 LYS HE3 1 1
8 1352 1 1 9 LYS HG2 H 2.300 -4.491 -4.819 1.00 . A A . 11 LYS HG2 1 1
8 1353 1 1 9 LYS HG3 H 1.649 -3.468 -3.551 1.00 . A A . 11 LYS HG3 1 1
8 1354 1 1 9 LYS HZ1 H 2.199 -1.959 -1.907 1.00 . A A . 11 LYS HZ1 1 1
8 1355 1 1 9 LYS N N -0.477 -4.839 -2.411 1.00 . A A . 11 LYS N 1 1
8 1356 1 1 9 LYS NZ N 3.208 -2.050 -1.746 1.00 . A A . 11 LYS NZ 1 1
8 1357 1 1 9 LYS O O 0.326 -7.892 -1.846 1.00 . A A . 11 LYS O 1 1
8 1358 1 1 10 NH2 HN1 H -1.403 -8.793 -3.057 1.00 . A A . 12 NH2 HN1 1 1
8 1359 1 1 10 NH2 HN2 H -1.665 -7.318 -4.124 1.00 . A A . 12 NH2 HN2 1 1
8 1360 1 1 10 NH2 N N -1.130 -7.897 -3.470 1.00 . A A . 12 NH2 N 1 1
9 1361 1 1 1 ACE C C 0.173 -4.778 1.689 1.00 . A A . 3 ACE C 1 1
9 1362 1 1 1 ACE CH3 C 0.621 -5.971 2.509 1.00 . A A . 3 ACE CH3 1 1
9 1363 1 1 1 ACE H1 H 0.214 -5.928 3.536 1.00 . A A . 3 ACE H1 1 1
9 1364 1 1 1 ACE H2 H 0.259 -6.910 2.052 1.00 . A A . 3 ACE H2 1 1
9 1365 1 1 1 ACE H3 H 1.722 -6.032 2.568 1.00 . A A . 3 ACE H3 1 1
9 1366 1 1 1 ACE O O -0.510 -4.932 0.679 1.00 . A A . 3 ACE O 1 1
9 1367 1 1 2 NLE C C 1.213 -1.205 1.551 1.00 . A A . 4 NLE C 1 1
9 1368 1 1 2 NLE CA C 0.105 -2.303 1.557 1.00 . A A . 4 NLE CA 1 1
9 1369 1 1 2 NLE CB C -1.193 -1.831 2.263 1.00 . A A . 4 NLE CB 1 1
9 1370 1 1 2 NLE CD C -2.595 -1.279 4.333 1.00 . A A . 4 NLE CD 1 1
9 1371 1 1 2 NLE CE C -2.611 -1.145 5.859 1.00 . A A . 4 NLE CE 1 1
9 1372 1 1 2 NLE CG C -1.212 -1.700 3.806 1.00 . A A . 4 NLE CG 1 1
9 1373 1 1 2 NLE H H 0.938 -3.600 3.094 1.00 . A A . 4 NLE H 1 1
9 1374 1 1 2 NLE HA H -0.169 -2.490 0.499 1.00 . A A . 4 NLE HA 1 1
9 1375 1 1 2 NLE HB2 H -1.996 -2.515 1.954 1.00 . A A . 4 NLE HB2 1 1
9 1376 1 1 2 NLE HB3 H -1.479 -0.866 1.822 1.00 . A A . 4 NLE HB3 1 1
9 1377 1 1 2 NLE HD2 H -3.363 -2.013 4.018 1.00 . A A . 4 NLE HD2 1 1
9 1378 1 1 2 NLE HD3 H -2.898 -0.317 3.878 1.00 . A A . 4 NLE HD3 1 1
9 1379 1 1 2 NLE HE1 H -2.368 -2.101 6.359 1.00 . A A . 4 NLE HE1 1 1
9 1380 1 1 2 NLE HE2 H -1.883 -0.389 6.210 1.00 . A A . 4 NLE HE2 1 1
9 1381 1 1 2 NLE HE3 H -3.607 -0.829 6.222 1.00 . A A . 4 NLE HE3 1 1
9 1382 1 1 2 NLE HG2 H -0.443 -0.973 4.131 1.00 . A A . 4 NLE HG2 1 1
9 1383 1 1 2 NLE HG3 H -0.925 -2.662 4.271 1.00 . A A . 4 NLE HG3 1 1
9 1384 1 1 2 NLE N N 0.565 -3.587 2.144 1.00 . A A . 4 NLE N 1 1
9 1385 1 1 2 NLE O O 1.861 -0.935 2.568 1.00 . A A . 4 NLE O 1 1
9 1386 1 1 3 ASP C C 1.741 1.949 0.276 1.00 . A A . 5 ASP C 1 1
9 1387 1 1 3 ASP CA C 2.406 0.538 0.220 1.00 . A A . 5 ASP CA 1 1
9 1388 1 1 3 ASP CB C 3.151 0.352 -1.128 1.00 . A A . 5 ASP CB 1 1
9 1389 1 1 3 ASP CG C 4.080 -0.863 -1.213 1.00 . A A . 5 ASP CG 1 1
9 1390 1 1 3 ASP H H 0.708 -0.785 -0.337 1.00 . A A . 5 ASP H 1 1
9 1391 1 1 3 ASP HA H 3.173 0.469 1.022 1.00 . A A . 5 ASP HA 1 1
9 1392 1 1 3 ASP HB2 H 2.440 0.371 -1.971 1.00 . A A . 5 ASP HB2 1 1
9 1393 1 1 3 ASP HB3 H 3.790 1.232 -1.303 1.00 . A A . 5 ASP HB3 1 1
9 1394 1 1 3 ASP N N 1.395 -0.545 0.394 1.00 . A A . 5 ASP N 1 1
9 1395 1 1 3 ASP O O 0.765 2.221 -0.435 1.00 . A A . 5 ASP O 1 1
9 1396 1 1 3 ASP OD1 O 5.122 -0.886 -0.558 1.00 . A A . 5 ASP OD1 1 1
9 1397 1 1 4 TRP C C 1.741 5.107 -0.038 1.00 . A A . 6 TRP C 1 1
9 1398 1 1 4 TRP CA C 1.781 4.245 1.287 1.00 . A A . 6 TRP CA 1 1
9 1399 1 1 4 TRP CB C 2.666 4.886 2.398 1.00 . A A . 6 TRP CB 1 1
9 1400 1 1 4 TRP CD1 C 2.518 7.507 2.337 1.00 . A A . 6 TRP CD1 1 1
9 1401 1 1 4 TRP CD2 C 1.328 6.542 3.951 1.00 . A A . 6 TRP CD2 1 1
9 1402 1 1 4 TRP CE2 C 1.121 7.945 3.977 1.00 . A A . 6 TRP CE2 1 1
9 1403 1 1 4 TRP CE3 C 0.630 5.698 4.851 1.00 . A A . 6 TRP CE3 1 1
9 1404 1 1 4 TRP CG C 2.205 6.257 2.917 1.00 . A A . 6 TRP CG 1 1
9 1405 1 1 4 TRP CH2 C -0.462 7.664 5.785 1.00 . A A . 6 TRP CH2 1 1
9 1406 1 1 4 TRP CZ2 C 0.214 8.511 4.903 1.00 . A A . 6 TRP CZ2 1 1
9 1407 1 1 4 TRP CZ3 C -0.255 6.280 5.759 1.00 . A A . 6 TRP CZ3 1 1
9 1408 1 1 4 TRP H H 3.134 2.526 1.599 1.00 . A A . 6 TRP H 1 1
9 1409 1 1 4 TRP HA H 0.755 4.144 1.688 1.00 . A A . 6 TRP HA 1 1
9 1410 1 1 4 TRP HB2 H 2.733 4.205 3.270 1.00 . A A . 6 TRP HB2 1 1
9 1411 1 1 4 TRP HB3 H 3.710 4.976 2.037 1.00 . A A . 6 TRP HB3 1 1
9 1412 1 1 4 TRP HD1 H 3.118 7.627 1.445 1.00 . A A . 6 TRP HD1 1 1
9 1413 1 1 4 TRP HE1 H 1.877 9.568 2.755 1.00 . A A . 6 TRP HE1 1 1
9 1414 1 1 4 TRP HE3 H 0.775 4.630 4.832 1.00 . A A . 6 TRP HE3 1 1
9 1415 1 1 4 TRP HH2 H -1.159 8.084 6.496 1.00 . A A . 6 TRP HH2 1 1
9 1416 1 1 4 TRP HZ2 H 0.040 9.577 4.921 1.00 . A A . 6 TRP HZ2 1 1
9 1417 1 1 4 TRP HZ3 H -0.796 5.650 6.450 1.00 . A A . 6 TRP HZ3 1 1
9 1418 1 1 4 TRP N N 2.299 2.856 1.103 1.00 . A A . 6 TRP N 1 1
9 1419 1 1 4 TRP NE1 N 1.857 8.568 2.985 1.00 . A A . 6 TRP NE1 1 1
9 1420 1 1 4 TRP O O 2.728 5.065 -0.784 1.00 . A A . 6 TRP O 1 1
9 1421 1 1 5 PRO C C -1.689 5.190 0.641 1.00 . A A . 7 PRO C 1 1
9 1422 1 1 5 PRO CA C -0.490 6.195 0.520 1.00 . A A . 7 PRO CA 1 1
9 1423 1 1 5 PRO CB C -0.904 7.573 -0.032 1.00 . A A . 7 PRO CB 1 1
9 1424 1 1 5 PRO CD C 0.679 6.710 -1.612 1.00 . A A . 7 PRO CD 1 1
9 1425 1 1 5 PRO CG C -0.623 7.505 -1.533 1.00 . A A . 7 PRO CG 1 1
9 1426 1 1 5 PRO HA H -0.150 6.356 1.555 1.00 . A A . 7 PRO HA 1 1
9 1427 1 1 5 PRO HB2 H -1.951 7.845 0.198 1.00 . A A . 7 PRO HB2 1 1
9 1428 1 1 5 PRO HB3 H -0.281 8.364 0.433 1.00 . A A . 7 PRO HB3 1 1
9 1429 1 1 5 PRO HD2 H 0.731 6.089 -2.527 1.00 . A A . 7 PRO HD2 1 1
9 1430 1 1 5 PRO HD3 H 1.557 7.385 -1.618 1.00 . A A . 7 PRO HD3 1 1
9 1431 1 1 5 PRO HG2 H -1.437 6.964 -2.053 1.00 . A A . 7 PRO HG2 1 1
9 1432 1 1 5 PRO HG3 H -0.542 8.504 -2.002 1.00 . A A . 7 PRO HG3 1 1
9 1433 1 1 5 PRO N N 0.668 5.885 -0.384 1.00 . A A . 7 PRO N 1 1
9 1434 1 1 5 PRO O O -2.669 5.507 1.318 1.00 . A A . 7 PRO O 1 1
9 1435 1 1 6 . C C -3.019 2.258 -1.167 1.00 . A A . 8 4J2 C 1 1
9 1436 1 1 6 . CA C -2.634 2.918 0.195 1.00 . A A . 8 4J2 CA 1 1
9 1437 1 1 6 . CB C -2.140 1.805 1.174 1.00 . A A . 8 4J2 CB 1 1
9 1438 1 1 6 . CD1 C -2.893 2.661 3.437 1.00 . A A . 8 4J2 CD1 1 1
9 1439 1 1 6 . CD2 C -0.628 1.863 3.207 1.00 . A A . 8 4J2 CD2 1 1
9 1440 1 1 6 . CE1 C -2.697 2.885 4.796 1.00 . A A . 8 4J2 CE1 1 1
9 1441 1 1 6 . CE2 C -0.406 2.059 4.567 1.00 . A A . 8 4J2 CE2 1 1
9 1442 1 1 6 . CE3 C 0.818 1.736 5.155 1.00 . A A . 8 4J2 CE3 1 1
9 1443 1 1 6 . CE4 C 1.009 1.932 6.519 1.00 . A A . 8 4J2 CE4 1 1
9 1444 1 1 6 . CG C -1.866 2.161 2.640 1.00 . A A . 8 4J2 CG 1 1
9 1445 1 1 6 . CZ1 C -1.466 2.585 5.383 1.00 . A A . 8 4J2 CZ1 1 1
9 1446 1 1 6 . CZ2 C -1.248 2.767 6.750 1.00 . A A . 8 4J2 CZ2 1 1
9 1447 1 1 6 . CZ3 C -0.015 2.445 7.310 1.00 . A A . 8 4J2 CZ3 1 1
9 1448 1 1 6 . H H -0.692 3.809 -0.388 1.00 . A A . 8 4J2 H 1 1
9 1449 1 1 6 . HA H -3.577 3.339 0.598 1.00 . A A . 8 4J2 HA 1 1
9 1450 1 1 6 . HB1 H -1.247 1.317 0.742 1.00 . A A . 8 4J2 HB1 1 1
9 1451 1 1 6 . HB2 H -2.882 0.989 1.178 1.00 . A A . 8 4J2 HB2 1 1
9 1452 1 1 6 . HD1 H -3.854 2.843 2.981 1.00 . A A . 8 4J2 HD1 1 1
9 1453 1 1 6 . HD2 H 0.143 1.430 2.588 1.00 . A A . 8 4J2 HD2 1 1
9 1454 1 1 6 . HE1 H -3.517 3.271 5.386 1.00 . A A . 8 4J2 HE1 1 1
9 1455 1 1 6 . HE3 H 1.627 1.326 4.565 1.00 . A A . 8 4J2 HE3 1 1
9 1456 1 1 6 . HE4 H 1.959 1.682 6.969 1.00 . A A . 8 4J2 HE4 1 1
9 1457 1 1 6 . HZ2 H -2.028 3.157 7.390 1.00 . A A . 8 4J2 HZ2 1 1
9 1458 1 1 6 . HZ23 H 0.146 2.590 8.369 1.00 . A A . 8 4J2 HZ23 1 1
9 1459 1 1 6 . N N -1.605 3.989 0.048 1.00 . A A . 8 4J2 N 1 1
9 1460 1 1 6 . O O -4.204 2.148 -1.494 1.00 . A A . 8 4J2 O 1 1
9 1461 1 1 7 ARG C C -1.963 -0.793 -2.050 1.00 . A A . 9 ARG C 1 1
9 1462 1 1 7 ARG CA C -2.222 0.562 -2.797 1.00 . A A . 9 ARG CA 1 1
9 1463 1 1 7 ARG CB C -1.293 0.734 -4.027 1.00 . A A . 9 ARG CB 1 1
9 1464 1 1 7 ARG CD C 1.113 0.153 -4.886 1.00 . A A . 9 ARG CD 1 1
9 1465 1 1 7 ARG CG C 0.243 0.763 -3.771 1.00 . A A . 9 ARG CG 1 1
9 1466 1 1 7 ARG CZ C 1.478 -2.157 -5.796 1.00 . A A . 9 ARG CZ 1 1
9 1467 1 1 7 ARG H H -1.123 1.802 -1.414 1.00 . A A . 9 ARG H 1 1
9 1468 1 1 7 ARG HA H -3.267 0.560 -3.173 1.00 . A A . 9 ARG HA 1 1
9 1469 1 1 7 ARG HB2 H -1.521 -0.105 -4.699 1.00 . A A . 9 ARG HB2 1 1
9 1470 1 1 7 ARG HB3 H -1.600 1.622 -4.605 1.00 . A A . 9 ARG HB3 1 1
9 1471 1 1 7 ARG HD2 H 0.878 0.629 -5.859 1.00 . A A . 9 ARG HD2 1 1
9 1472 1 1 7 ARG HD3 H 2.181 0.365 -4.683 1.00 . A A . 9 ARG HD3 1 1
9 1473 1 1 7 ARG HG2 H 0.560 1.805 -3.572 1.00 . A A . 9 ARG HG2 1 1
9 1474 1 1 7 ARG HG3 H 0.469 0.225 -2.833 1.00 . A A . 9 ARG HG3 1 1
9 1475 1 1 7 ARG HH11 H 2.657 -0.825 -6.614 1.00 . A A . 9 ARG HH11 1 1
9 1476 1 1 7 ARG HH12 H 2.779 -2.549 -7.251 1.00 . A A . 9 ARG HH12 1 1
9 1477 1 1 7 ARG HH21 H 0.294 -3.539 -5.135 1.00 . A A . 9 ARG HH21 1 1
9 1478 1 1 7 ARG HH22 H 1.496 -4.034 -6.451 1.00 . A A . 9 ARG HH22 1 1
9 1479 1 1 7 ARG N N -2.026 1.717 -1.891 1.00 . A A . 9 ARG N 1 1
9 1480 1 1 7 ARG NE N 0.889 -1.317 -4.951 1.00 . A A . 9 ARG NE 1 1
9 1481 1 1 7 ARG NH1 N 2.409 -1.815 -6.647 1.00 . A A . 9 ARG NH1 1 1
9 1482 1 1 7 ARG NH2 N 1.087 -3.390 -5.774 1.00 . A A . 9 ARG NH2 1 1
9 1483 1 1 7 ARG O O -1.184 -0.867 -1.092 1.00 . A A . 9 ARG O 1 1
9 1484 1 1 8 TRP C C -1.355 -4.051 -2.824 1.00 . A A . 10 TRP C 1 1
9 1485 1 1 8 TRP CA C -2.392 -3.237 -1.977 1.00 . A A . 10 TRP CA 1 1
9 1486 1 1 8 TRP CB C -3.802 -3.884 -1.898 1.00 . A A . 10 TRP CB 1 1
9 1487 1 1 8 TRP CD1 C -3.837 -6.469 -1.839 1.00 . A A . 10 TRP CD1 1 1
9 1488 1 1 8 TRP CD2 C -3.789 -5.517 0.165 1.00 . A A . 10 TRP CD2 1 1
9 1489 1 1 8 TRP CE2 C -3.720 -6.925 0.311 1.00 . A A . 10 TRP CE2 1 1
9 1490 1 1 8 TRP CE3 C -3.761 -4.671 1.299 1.00 . A A . 10 TRP CE3 1 1
9 1491 1 1 8 TRP CG C -3.842 -5.233 -1.185 1.00 . A A . 10 TRP CG 1 1
9 1492 1 1 8 TRP CH2 C -3.557 -6.648 2.709 1.00 . A A . 10 TRP CH2 1 1
9 1493 1 1 8 TRP CZ2 C -3.598 -7.496 1.600 1.00 . A A . 10 TRP CZ2 1 1
9 1494 1 1 8 TRP CZ3 C -3.640 -5.257 2.561 1.00 . A A . 10 TRP CZ3 1 1
9 1495 1 1 8 TRP H H -3.060 -1.723 -3.427 1.00 . A A . 10 TRP H 1 1
9 1496 1 1 8 TRP HA H -2.023 -3.165 -0.933 1.00 . A A . 10 TRP HA 1 1
9 1497 1 1 8 TRP HB2 H -4.503 -3.218 -1.370 1.00 . A A . 10 TRP HB2 1 1
9 1498 1 1 8 TRP HB3 H -4.228 -3.991 -2.911 1.00 . A A . 10 TRP HB3 1 1
9 1499 1 1 8 TRP HD1 H -3.834 -6.535 -2.917 1.00 . A A . 10 TRP HD1 1 1
9 1500 1 1 8 TRP HE1 H -3.758 -8.552 -1.127 1.00 . A A . 10 TRP HE1 1 1
9 1501 1 1 8 TRP HE3 H -3.827 -3.600 1.184 1.00 . A A . 10 TRP HE3 1 1
9 1502 1 1 8 TRP HH2 H -3.462 -7.071 3.699 1.00 . A A . 10 TRP HH2 1 1
9 1503 1 1 8 TRP HZ2 H -3.533 -8.568 1.721 1.00 . A A . 10 TRP HZ2 1 1
9 1504 1 1 8 TRP HZ3 H -3.606 -4.625 3.438 1.00 . A A . 10 TRP HZ3 1 1
9 1505 1 1 8 TRP N N -2.597 -1.871 -2.527 1.00 . A A . 10 TRP N 1 1
9 1506 1 1 8 TRP NE1 N -3.756 -7.546 -0.930 1.00 . A A . 10 TRP NE1 1 1
9 1507 1 1 8 TRP O O -1.369 -4.038 -4.060 1.00 . A A . 10 TRP O 1 1
9 1508 1 1 9 LYS C C -0.024 -7.008 -3.393 1.00 . A A . 11 LYS C 1 1
9 1509 1 1 9 LYS CA C 0.538 -5.682 -2.784 1.00 . A A . 11 LYS CA 1 1
9 1510 1 1 9 LYS CB C 1.685 -5.947 -1.768 1.00 . A A . 11 LYS CB 1 1
9 1511 1 1 9 LYS CD C 3.523 -4.280 -2.534 1.00 . A A . 11 LYS CD 1 1
9 1512 1 1 9 LYS CE C 4.452 -3.113 -2.153 1.00 . A A . 11 LYS CE 1 1
9 1513 1 1 9 LYS CG C 2.589 -4.748 -1.392 1.00 . A A . 11 LYS CG 1 1
9 1514 1 1 9 LYS H H -0.529 -4.718 -1.109 1.00 . A A . 11 LYS H 1 1
9 1515 1 1 9 LYS HA H 0.987 -5.142 -3.634 1.00 . A A . 11 LYS HA 1 1
9 1516 1 1 9 LYS HB2 H 1.250 -6.368 -0.841 1.00 . A A . 11 LYS HB2 1 1
9 1517 1 1 9 LYS HB3 H 2.333 -6.755 -2.153 1.00 . A A . 11 LYS HB3 1 1
9 1518 1 1 9 LYS HD2 H 4.150 -5.132 -2.855 1.00 . A A . 11 LYS HD2 1 1
9 1519 1 1 9 LYS HD3 H 2.937 -4.004 -3.432 1.00 . A A . 11 LYS HD3 1 1
9 1520 1 1 9 LYS HE2 H 5.010 -3.359 -1.227 1.00 . A A . 11 LYS HE2 1 1
9 1521 1 1 9 LYS HE3 H 5.225 -2.981 -2.936 1.00 . A A . 11 LYS HE3 1 1
9 1522 1 1 9 LYS HG2 H 1.965 -3.906 -1.034 1.00 . A A . 11 LYS HG2 1 1
9 1523 1 1 9 LYS HG3 H 3.205 -5.031 -0.516 1.00 . A A . 11 LYS HG3 1 1
9 1524 1 1 9 LYS HZ1 H 2.794 -1.700 -2.495 1.00 . A A . 11 LYS HZ1 1 1
9 1525 1 1 9 LYS N N -0.478 -4.801 -2.138 1.00 . A A . 11 LYS N 1 1
9 1526 1 1 9 LYS NZ N 3.690 -1.854 -2.019 1.00 . A A . 11 LYS NZ 1 1
9 1527 1 1 9 LYS O O 0.202 -7.314 -4.560 1.00 . A A . 11 LYS O 1 1
9 1528 1 1 10 NH2 HN1 H -1.077 -7.510 -1.772 1.00 . A A . 12 NH2 HN1 1 1
9 1529 1 1 10 NH2 HN2 H -1.089 -8.647 -3.220 1.00 . A A . 12 NH2 HN2 1 1
9 1530 1 1 10 NH2 N N -0.734 -7.858 -2.673 1.00 . A A . 12 NH2 N 1 1
10 1531 1 1 1 ACE C C 0.415 -4.477 1.872 1.00 . A A . 3 ACE C 1 1
10 1532 1 1 1 ACE CH3 C 0.931 -5.720 2.571 1.00 . A A . 3 ACE CH3 1 1
10 1533 1 1 1 ACE H1 H 0.404 -5.895 3.526 1.00 . A A . 3 ACE H1 1 1
10 1534 1 1 1 ACE H2 H 0.768 -6.612 1.939 1.00 . A A . 3 ACE H2 1 1
10 1535 1 1 1 ACE H3 H 2.015 -5.649 2.773 1.00 . A A . 3 ACE H3 1 1
10 1536 1 1 1 ACE O O -0.079 -4.550 0.749 1.00 . A A . 3 ACE O 1 1
10 1537 1 1 2 NLE C C 1.240 -1.069 1.742 1.00 . A A . 4 NLE C 1 1
10 1538 1 1 2 NLE CA C 0.047 -2.035 2.048 1.00 . A A . 4 NLE CA 1 1
10 1539 1 1 2 NLE CB C -0.892 -1.371 3.085 1.00 . A A . 4 NLE CB 1 1
10 1540 1 1 2 NLE CD C -3.081 -1.286 4.464 1.00 . A A . 4 NLE CD 1 1
10 1541 1 1 2 NLE CE C -2.502 -1.050 5.866 1.00 . A A . 4 NLE CE 1 1
10 1542 1 1 2 NLE CG C -2.170 -2.111 3.534 1.00 . A A . 4 NLE CG 1 1
10 1543 1 1 2 NLE H H 0.916 -3.435 3.503 1.00 . A A . 4 NLE H 1 1
10 1544 1 1 2 NLE HA H -0.556 -2.181 1.128 1.00 . A A . 4 NLE HA 1 1
10 1545 1 1 2 NLE HB2 H -1.234 -0.430 2.638 1.00 . A A . 4 NLE HB2 1 1
10 1546 1 1 2 NLE HB3 H -0.296 -1.075 3.963 1.00 . A A . 4 NLE HB3 1 1
10 1547 1 1 2 NLE HD2 H -4.052 -1.809 4.567 1.00 . A A . 4 NLE HD2 1 1
10 1548 1 1 2 NLE HD3 H -3.327 -0.314 3.994 1.00 . A A . 4 NLE HD3 1 1
10 1549 1 1 2 NLE HE1 H -2.257 -2.001 6.375 1.00 . A A . 4 NLE HE1 1 1
10 1550 1 1 2 NLE HE2 H -1.579 -0.440 5.835 1.00 . A A . 4 NLE HE2 1 1
10 1551 1 1 2 NLE HE3 H -3.220 -0.509 6.508 1.00 . A A . 4 NLE HE3 1 1
10 1552 1 1 2 NLE HG2 H -1.909 -3.073 4.014 1.00 . A A . 4 NLE HG2 1 1
10 1553 1 1 2 NLE HG3 H -2.752 -2.371 2.635 1.00 . A A . 4 NLE HG3 1 1
10 1554 1 1 2 NLE N N 0.534 -3.342 2.559 1.00 . A A . 4 NLE N 1 1
10 1555 1 1 2 NLE O O 2.052 -0.754 2.619 1.00 . A A . 4 NLE O 1 1
10 1556 1 1 3 ASP C C 1.664 1.920 0.192 1.00 . A A . 5 ASP C 1 1
10 1557 1 1 3 ASP CA C 2.285 0.490 0.100 1.00 . A A . 5 ASP CA 1 1
10 1558 1 1 3 ASP CB C 2.747 0.198 -1.353 1.00 . A A . 5 ASP CB 1 1
10 1559 1 1 3 ASP CG C 3.793 -0.915 -1.484 1.00 . A A . 5 ASP CG 1 1
10 1560 1 1 3 ASP H H 0.508 -0.828 -0.094 1.00 . A A . 5 ASP H 1 1
10 1561 1 1 3 ASP HA H 3.182 0.447 0.754 1.00 . A A . 5 ASP HA 1 1
10 1562 1 1 3 ASP HB2 H 1.877 0.026 -2.017 1.00 . A A . 5 ASP HB2 1 1
10 1563 1 1 3 ASP HB3 H 3.224 1.101 -1.773 1.00 . A A . 5 ASP HB3 1 1
10 1564 1 1 3 ASP N N 1.297 -0.549 0.510 1.00 . A A . 5 ASP N 1 1
10 1565 1 1 3 ASP O O 0.660 2.207 -0.467 1.00 . A A . 5 ASP O 1 1
10 1566 1 1 3 ASP OD1 O 4.959 -0.704 -1.148 1.00 . A A . 5 ASP OD1 1 1
10 1567 1 1 4 TRP C C 1.737 5.061 -0.205 1.00 . A A . 6 TRP C 1 1
10 1568 1 1 4 TRP CA C 1.820 4.235 1.144 1.00 . A A . 6 TRP CA 1 1
10 1569 1 1 4 TRP CB C 2.774 4.891 2.187 1.00 . A A . 6 TRP CB 1 1
10 1570 1 1 4 TRP CD1 C 2.685 7.512 2.018 1.00 . A A . 6 TRP CD1 1 1
10 1571 1 1 4 TRP CD2 C 1.563 6.650 3.737 1.00 . A A . 6 TRP CD2 1 1
10 1572 1 1 4 TRP CE2 C 1.390 8.057 3.710 1.00 . A A . 6 TRP CE2 1 1
10 1573 1 1 4 TRP CE3 C 0.899 5.866 4.711 1.00 . A A . 6 TRP CE3 1 1
10 1574 1 1 4 TRP CG C 2.374 6.296 2.670 1.00 . A A . 6 TRP CG 1 1
10 1575 1 1 4 TRP CH2 C -0.091 7.898 5.615 1.00 . A A . 6 TRP CH2 1 1
10 1576 1 1 4 TRP CZ2 C 0.552 8.688 4.658 1.00 . A A . 6 TRP CZ2 1 1
10 1577 1 1 4 TRP CZ3 C 0.081 6.509 5.641 1.00 . A A . 6 TRP CZ3 1 1
10 1578 1 1 4 TRP H H 3.134 2.481 1.437 1.00 . A A . 6 TRP H 1 1
10 1579 1 1 4 TRP HA H 0.814 4.180 1.602 1.00 . A A . 6 TRP HA 1 1
10 1580 1 1 4 TRP HB2 H 2.861 4.242 3.080 1.00 . A A . 6 TRP HB2 1 1
10 1581 1 1 4 TRP HB3 H 3.801 4.936 1.775 1.00 . A A . 6 TRP HB3 1 1
10 1582 1 1 4 TRP HD1 H 3.236 7.577 1.091 1.00 . A A . 6 TRP HD1 1 1
10 1583 1 1 4 TRP HE1 H 2.118 9.605 2.377 1.00 . A A . 6 TRP HE1 1 1
10 1584 1 1 4 TRP HE3 H 1.020 4.795 4.734 1.00 . A A . 6 TRP HE3 1 1
10 1585 1 1 4 TRP HH2 H -0.736 8.367 6.345 1.00 . A A . 6 TRP HH2 1 1
10 1586 1 1 4 TRP HZ2 H 0.404 9.757 4.638 1.00 . A A . 6 TRP HZ2 1 1
10 1587 1 1 4 TRP HZ3 H -0.432 5.925 6.391 1.00 . A A . 6 TRP HZ3 1 1
10 1588 1 1 4 TRP N N 2.286 2.825 0.975 1.00 . A A . 6 TRP N 1 1
10 1589 1 1 4 TRP NE1 N 2.085 8.618 2.652 1.00 . A A . 6 TRP NE1 1 1
10 1590 1 1 4 TRP O O 2.690 4.981 -0.989 1.00 . A A . 6 TRP O 1 1
10 1591 1 1 5 PRO C C -1.670 5.214 0.584 1.00 . A A . 7 PRO C 1 1
10 1592 1 1 5 PRO CA C -0.456 6.195 0.412 1.00 . A A . 7 PRO CA 1 1
10 1593 1 1 5 PRO CB C -0.862 7.574 -0.147 1.00 . A A . 7 PRO CB 1 1
10 1594 1 1 5 PRO CD C 0.642 6.649 -1.770 1.00 . A A . 7 PRO CD 1 1
10 1595 1 1 5 PRO CG C -0.638 7.475 -1.657 1.00 . A A . 7 PRO CG 1 1
10 1596 1 1 5 PRO HA H -0.078 6.364 1.433 1.00 . A A . 7 PRO HA 1 1
10 1597 1 1 5 PRO HB2 H -1.892 7.872 0.116 1.00 . A A . 7 PRO HB2 1 1
10 1598 1 1 5 PRO HB3 H -0.204 8.358 0.281 1.00 . A A . 7 PRO HB3 1 1
10 1599 1 1 5 PRO HD2 H 0.643 6.008 -2.674 1.00 . A A . 7 PRO HD2 1 1
10 1600 1 1 5 PRO HD3 H 1.533 7.305 -1.828 1.00 . A A . 7 PRO HD3 1 1
10 1601 1 1 5 PRO HG2 H -1.483 6.944 -2.136 1.00 . A A . 7 PRO HG2 1 1
10 1602 1 1 5 PRO HG3 H -0.554 8.463 -2.146 1.00 . A A . 7 PRO HG3 1 1
10 1603 1 1 5 PRO N N 0.663 5.850 -0.526 1.00 . A A . 7 PRO N 1 1
10 1604 1 1 5 PRO O O -2.631 5.562 1.272 1.00 . A A . 7 PRO O 1 1
10 1605 1 1 6 . C C -2.986 2.151 -1.056 1.00 . A A . 8 4J2 C 1 1
10 1606 1 1 6 . CA C -2.627 2.925 0.255 1.00 . A A . 8 4J2 CA 1 1
10 1607 1 1 6 . CB C -2.126 1.910 1.329 1.00 . A A . 8 4J2 CB 1 1
10 1608 1 1 6 . CD1 C -2.892 2.939 3.518 1.00 . A A . 8 4J2 CD1 1 1
10 1609 1 1 6 . CD2 C -0.627 2.121 3.363 1.00 . A A . 8 4J2 CD2 1 1
10 1610 1 1 6 . CE1 C -2.717 3.223 4.869 1.00 . A A . 8 4J2 CE1 1 1
10 1611 1 1 6 . CE2 C -0.432 2.362 4.719 1.00 . A A . 8 4J2 CE2 1 1
10 1612 1 1 6 . CE3 C 0.773 2.042 5.347 1.00 . A A . 8 4J2 CE3 1 1
10 1613 1 1 6 . CE4 C 0.939 2.288 6.706 1.00 . A A . 8 4J2 CE4 1 1
10 1614 1 1 6 . CG C -1.858 2.386 2.764 1.00 . A A . 8 4J2 CG 1 1
10 1615 1 1 6 . CZ1 C -1.502 2.933 5.492 1.00 . A A . 8 4J2 CZ1 1 1
10 1616 1 1 6 . CZ2 C -1.309 3.164 6.855 1.00 . A A . 8 4J2 CZ2 1 1
10 1617 1 1 6 . CZ3 C -0.095 2.846 7.455 1.00 . A A . 8 4J2 CZ3 1 1
10 1618 1 1 6 . H H -0.713 3.794 -0.428 1.00 . A A . 8 4J2 H 1 1
10 1619 1 1 6 . HA H -3.578 3.370 0.610 1.00 . A A . 8 4J2 HA 1 1
10 1620 1 1 6 . HB1 H -1.228 1.395 0.943 1.00 . A A . 8 4J2 HB1 1 1
10 1621 1 1 6 . HB2 H -2.859 1.088 1.400 1.00 . A A . 8 4J2 HB2 1 1
10 1622 1 1 6 . HD1 H -3.840 3.122 3.037 1.00 . A A . 8 4J2 HD1 1 1
10 1623 1 1 6 . HD2 H 0.158 1.663 2.774 1.00 . A A . 8 4J2 HD2 1 1
10 1624 1 1 6 . HE1 H -3.542 3.648 5.424 1.00 . A A . 8 4J2 HE1 1 1
10 1625 1 1 6 . HE3 H 1.590 1.600 4.790 1.00 . A A . 8 4J2 HE3 1 1
10 1626 1 1 6 . HE4 H 1.875 2.041 7.186 1.00 . A A . 8 4J2 HE4 1 1
10 1627 1 1 6 . HZ2 H -2.097 3.591 7.463 1.00 . A A . 8 4J2 HZ2 1 1
10 1628 1 1 6 . HZ23 H 0.047 3.030 8.510 1.00 . A A . 8 4J2 HZ23 1 1
10 1629 1 1 6 . N N -1.613 3.995 0.024 1.00 . A A . 8 4J2 N 1 1
10 1630 1 1 6 . O O -4.163 2.033 -1.403 1.00 . A A . 8 4J2 O 1 1
10 1631 1 1 7 ARG C C -1.826 -0.921 -1.978 1.00 . A A . 9 ARG C 1 1
10 1632 1 1 7 ARG CA C -2.170 0.435 -2.675 1.00 . A A . 9 ARG CA 1 1
10 1633 1 1 7 ARG CB C -1.243 0.728 -3.881 1.00 . A A . 9 ARG CB 1 1
10 1634 1 1 7 ARG CD C -2.585 -0.215 -5.930 1.00 . A A . 9 ARG CD 1 1
10 1635 1 1 7 ARG CG C -1.296 -0.251 -5.079 1.00 . A A . 9 ARG CG 1 1
10 1636 1 1 7 ARG CZ C -4.023 -2.253 -5.607 1.00 . A A . 9 ARG CZ 1 1
10 1637 1 1 7 ARG H H -1.073 1.670 -1.247 1.00 . A A . 9 ARG H 1 1
10 1638 1 1 7 ARG HA H -3.219 0.418 -3.036 1.00 . A A . 9 ARG HA 1 1
10 1639 1 1 7 ARG HB2 H -1.455 1.745 -4.262 1.00 . A A . 9 ARG HB2 1 1
10 1640 1 1 7 ARG HB3 H -0.199 0.763 -3.520 1.00 . A A . 9 ARG HB3 1 1
10 1641 1 1 7 ARG HD2 H -2.912 0.834 -6.071 1.00 . A A . 9 ARG HD2 1 1
10 1642 1 1 7 ARG HD3 H -2.371 -0.558 -6.962 1.00 . A A . 9 ARG HD3 1 1
10 1643 1 1 7 ARG HG2 H -0.446 0.013 -5.734 1.00 . A A . 9 ARG HG2 1 1
10 1644 1 1 7 ARG HG3 H -1.076 -1.284 -4.747 1.00 . A A . 9 ARG HG3 1 1
10 1645 1 1 7 ARG HH11 H -2.472 -2.606 -6.745 1.00 . A A . 9 ARG HH11 1 1
10 1646 1 1 7 ARG HH12 H -3.644 -4.001 -6.484 1.00 . A A . 9 ARG HH12 1 1
10 1647 1 1 7 ARG HH21 H -5.593 -2.034 -4.502 1.00 . A A . 9 ARG HH21 1 1
10 1648 1 1 7 ARG HH22 H -5.353 -3.691 -5.282 1.00 . A A . 9 ARG HH22 1 1
10 1649 1 1 7 ARG N N -1.979 1.550 -1.718 1.00 . A A . 9 ARG N 1 1
10 1650 1 1 7 ARG NE N -3.715 -0.984 -5.339 1.00 . A A . 9 ARG NE 1 1
10 1651 1 1 7 ARG NH1 N -3.323 -3.038 -6.382 1.00 . A A . 9 ARG NH1 1 1
10 1652 1 1 7 ARG NH2 N -5.088 -2.732 -5.051 1.00 . A A . 9 ARG NH2 1 1
10 1653 1 1 7 ARG O O -0.923 -1.022 -1.139 1.00 . A A . 9 ARG O 1 1
10 1654 1 1 8 TRP C C -1.309 -4.164 -2.719 1.00 . A A . 10 TRP C 1 1
10 1655 1 1 8 TRP CA C -2.314 -3.347 -1.838 1.00 . A A . 10 TRP CA 1 1
10 1656 1 1 8 TRP CB C -3.713 -4.008 -1.714 1.00 . A A . 10 TRP CB 1 1
10 1657 1 1 8 TRP CD1 C -3.801 -6.592 -1.865 1.00 . A A . 10 TRP CD1 1 1
10 1658 1 1 8 TRP CD2 C -3.486 -5.810 0.187 1.00 . A A . 10 TRP CD2 1 1
10 1659 1 1 8 TRP CE2 C -3.422 -7.224 0.208 1.00 . A A . 10 TRP CE2 1 1
10 1660 1 1 8 TRP CE3 C -3.253 -5.059 1.362 1.00 . A A . 10 TRP CE3 1 1
10 1661 1 1 8 TRP CG C -3.716 -5.413 -1.113 1.00 . A A . 10 TRP CG 1 1
10 1662 1 1 8 TRP CH2 C -2.893 -7.144 2.569 1.00 . A A . 10 TRP CH2 1 1
10 1663 1 1 8 TRP CZ2 C -3.115 -7.900 1.413 1.00 . A A . 10 TRP CZ2 1 1
10 1664 1 1 8 TRP CZ3 C -2.963 -5.744 2.543 1.00 . A A . 10 TRP CZ3 1 1
10 1665 1 1 8 TRP H H -3.031 -1.801 -3.256 1.00 . A A . 10 TRP H 1 1
10 1666 1 1 8 TRP HA H -1.908 -3.276 -0.807 1.00 . A A . 10 TRP HA 1 1
10 1667 1 1 8 TRP HB2 H -4.381 -3.382 -1.098 1.00 . A A . 10 TRP HB2 1 1
10 1668 1 1 8 TRP HB3 H -4.199 -4.043 -2.704 1.00 . A A . 10 TRP HB3 1 1
10 1669 1 1 8 TRP HD1 H -3.897 -6.571 -2.939 1.00 . A A . 10 TRP HD1 1 1
10 1670 1 1 8 TRP HE1 H -3.526 -8.716 -1.363 1.00 . A A . 10 TRP HE1 1 1
10 1671 1 1 8 TRP HE3 H -3.270 -3.980 1.328 1.00 . A A . 10 TRP HE3 1 1
10 1672 1 1 8 TRP HH2 H -2.654 -7.648 3.495 1.00 . A A . 10 TRP HH2 1 1
10 1673 1 1 8 TRP HZ2 H -3.045 -8.977 1.436 1.00 . A A . 10 TRP HZ2 1 1
10 1674 1 1 8 TRP HZ3 H -2.767 -5.181 3.443 1.00 . A A . 10 TRP HZ3 1 1
10 1675 1 1 8 TRP N N -2.542 -1.978 -2.368 1.00 . A A . 10 TRP N 1 1
10 1676 1 1 8 TRP NE1 N -3.626 -7.740 -1.064 1.00 . A A . 10 TRP NE1 1 1
10 1677 1 1 8 TRP O O -1.363 -4.153 -3.954 1.00 . A A . 10 TRP O 1 1
10 1678 1 1 9 LYS C C -0.267 -7.207 -3.197 1.00 . A A . 11 LYS C 1 1
10 1679 1 1 9 LYS CA C 0.473 -5.910 -2.727 1.00 . A A . 11 LYS CA 1 1
10 1680 1 1 9 LYS CB C 1.646 -6.225 -1.754 1.00 . A A . 11 LYS CB 1 1
10 1681 1 1 9 LYS CD C 3.457 -4.503 -2.501 1.00 . A A . 11 LYS CD 1 1
10 1682 1 1 9 LYS CE C 4.261 -3.245 -2.123 1.00 . A A . 11 LYS CE 1 1
10 1683 1 1 9 LYS CG C 2.585 -5.061 -1.352 1.00 . A A . 11 LYS CG 1 1
10 1684 1 1 9 LYS H H -0.407 -4.803 -1.033 1.00 . A A . 11 LYS H 1 1
10 1685 1 1 9 LYS HA H 0.916 -5.437 -3.622 1.00 . A A . 11 LYS HA 1 1
10 1686 1 1 9 LYS HB2 H 1.223 -6.664 -0.830 1.00 . A A . 11 LYS HB2 1 1
10 1687 1 1 9 LYS HB3 H 2.260 -7.034 -2.184 1.00 . A A . 11 LYS HB3 1 1
10 1688 1 1 9 LYS HD2 H 4.160 -5.292 -2.828 1.00 . A A . 11 LYS HD2 1 1
10 1689 1 1 9 LYS HD3 H 2.843 -4.284 -3.394 1.00 . A A . 11 LYS HD3 1 1
10 1690 1 1 9 LYS HE2 H 4.843 -3.423 -1.195 1.00 . A A . 11 LYS HE2 1 1
10 1691 1 1 9 LYS HE3 H 5.014 -3.035 -2.908 1.00 . A A . 11 LYS HE3 1 1
10 1692 1 1 9 LYS HG2 H 1.984 -4.250 -0.899 1.00 . A A . 11 LYS HG2 1 1
10 1693 1 1 9 LYS HG3 H 3.246 -5.404 -0.532 1.00 . A A . 11 LYS HG3 1 1
10 1694 1 1 9 LYS HZ1 H 2.358 -2.129 -2.140 1.00 . A A . 11 LYS HZ1 1 1
10 1695 1 1 9 LYS N N -0.442 -4.946 -2.057 1.00 . A A . 11 LYS N 1 1
10 1696 1 1 9 LYS NZ N 3.367 -2.077 -1.976 1.00 . A A . 11 LYS NZ 1 1
10 1697 1 1 9 LYS O O -0.332 -8.235 -2.525 1.00 . A A . 11 LYS O 1 1
10 1698 1 1 10 NH2 HN1 H -1.011 -6.288 -4.792 1.00 . A A . 12 NH2 HN1 1 1
10 1699 1 1 10 NH2 HN2 H -1.387 -8.075 -4.552 1.00 . A A . 12 NH2 HN2 1 1
10 1700 1 1 10 NH2 N N -0.861 -7.214 -4.374 1.00 . A A . 12 NH2 N 1 1
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