NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
|
|
627128 |
6fce   |
34222 | cing | 4-filtered-FRED | STAR | entry | full | 37 |
data_FRED_restraints_with_modified_coordinates_PDB_code_6fce
# This FRED archive file contains, for PDB entry <6fce>:
#
# - 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_6fce
_Assembly.Sf_category assembly
_Assembly.Entry_ID 1
_Assembly.ID 1
_Assembly.Name 6fce
_Assembly.Number_of_components 1
_Assembly.Organic_ligands .
_Assembly.Metal_ions .
_Assembly.Paramagnetic .
_Assembly.Thiol_state "not present"
_Assembly.Molecular_mass 851.95
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 $ACP_HIS_DPHE_ARG_TRP_ASP_NH2 A . 1 1
stop_
save_
save_ACP_HIS_DPHE_ARG_TRP_ASP_NH2
_Entity.Sf_category entity
_Entity.Entry_ID 1
_Entity.ID 1
_Entity.Name "ACP HIS DPHE ARG TRP ASP NH2"
_Entity.Type polymer
_Entity.Polymer_type polypeptide(L)
_Entity.Polymer_seq_one_letter_code XHXRWDX
_Entity.Number_of_monomers 7
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 AC5 $AC5 1 1
2 HIS . 1 1
3 . $. 1 1
4 ARG . 1 1
5 TRP . 1 1
6 ASP . 1 1
7 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
AC5 1 1 1 1
HIS 2 2 1 1
. 3 3 1 1
ARG 4 4 1 1
TRP 5 5 1 1
ASP 6 6 1 1
NH2 7 7 1 1
stop_
save_
save_AC5
_Chem_comp.Sf_category chem_comp
_Chem_comp.Entry_ID 1
_Chem_comp.ID AC5
_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_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
stop_
loop_
_Dist_constraint.Tree_node_member_constraint_ID
_Dist_constraint.Tree_node_member_node_ID
_Dist_constraint.Constraint_tree_node_member_ID
_Dist_constraint.Entity_assembly_ID
_Dist_constraint.Entity_ID
_Dist_constraint.Comp_index_ID
_Dist_constraint.Comp_ID
_Dist_constraint.Atom_ID
_Dist_constraint.Auth_asym_ID
_Dist_constraint.Auth_seq_ID
_Dist_constraint.Auth_comp_ID
_Dist_constraint.Auth_atom_ID
_Dist_constraint.Entry_ID
_Dist_constraint.Distance_constraint_list_ID
1 1 1 1 1 1 AC5 HB11 . 5 ACP QB1 1 1
1 1 1 1 1 1 AC5 HB12 . 5 ACP QB1 1 1
1 1 2 1 1 2 HIS H . 6 HIS HN 1 1
2 1 1 1 1 1 AC5 HB21 . 5 ACP QB2 1 1
2 1 1 1 1 1 AC5 HB22 . 5 ACP QB2 1 1
2 1 2 1 1 2 HIS H . 6 HIS HN 1 1
3 1 1 1 1 1 AC5 HB21 . 5 ACP QB2 1 1
3 1 1 1 1 1 AC5 HB22 . 5 ACP QB2 1 1
3 1 2 1 1 2 HIS HD2 . 6 HIS HD2 1 1
4 1 1 1 1 1 AC5 HB21 . 5 ACP HB21 1 1
4 1 2 1 1 2 HIS H . 6 HIS HN 1 1
5 1 1 1 1 1 AC5 HB22 . 5 ACP HB22 1 1
5 1 2 1 1 2 HIS H . 6 HIS HN 1 1
6 1 1 1 1 1 AC5 HG11 . 5 ACP QG1 1 1
6 1 1 1 1 1 AC5 HG12 . 5 ACP QG1 1 1
6 1 2 1 1 2 HIS H . 6 HIS HN 1 1
7 1 1 1 1 2 HIS H . 6 HIS HN 1 1
7 1 2 1 1 2 HIS QB . 6 HIS HB2 1 1
8 1 1 1 1 2 HIS H . 6 HIS HN 1 1
8 1 2 1 1 6 ASP QB . 10 ASP QB 1 1
9 1 1 1 1 2 HIS HA . 6 HIS HA 1 1
9 1 2 1 1 2 HIS HD2 . 6 HIS HD2 1 1
10 1 1 1 1 2 HIS QB . 6 HIS HB2 1 1
10 1 2 1 1 2 HIS HD2 . 6 HIS HD2 1 1
11 1 1 1 1 2 HIS QB . 6 HIS QB 1 1
11 1 2 1 1 5 TRP HE3 . 9 TRP HE3 1 1
12 1 1 1 1 4 ARG H . 8 ARG HN 1 1
12 1 2 1 1 5 TRP H . 9 TRP HN 1 1
13 1 1 1 1 4 ARG H . 8 ARG HN 1 1
13 1 2 1 1 6 ASP H . 10 ASP HN 1 1
14 1 1 1 1 4 ARG HA . 8 ARG HA 1 1
14 1 2 1 1 4 ARG QB . 8 ARG QB 1 1
15 1 1 1 1 4 ARG HA . 8 ARG HA 1 1
15 1 2 1 1 5 TRP H . 9 TRP HN 1 1
16 1 1 1 1 4 ARG HA . 8 ARG HA 1 1
16 1 2 1 1 6 ASP H . 10 ASP HN 1 1
17 1 1 1 1 4 ARG QB . 8 ARG QB 1 1
17 1 2 1 1 5 TRP HZ3 . 9 TRP HZ3 1 1
18 1 1 1 1 4 ARG HB2 . 8 ARG HB2 1 1
18 1 2 1 1 5 TRP H . 9 TRP HN 1 1
19 1 1 1 1 4 ARG HB2 . 8 ARG HB2 1 1
19 1 2 1 1 5 TRP HE3 . 9 TRP HE3 1 1
20 1 1 1 1 4 ARG HB3 . 8 ARG HB3 1 1
20 1 2 1 1 5 TRP H . 9 TRP HN 1 1
21 1 1 1 1 4 ARG HB3 . 8 ARG HB3 1 1
21 1 2 1 1 5 TRP HE3 . 9 TRP HE3 1 1
22 1 1 1 1 4 ARG QD . 8 ARG QD 1 1
22 1 2 1 1 5 TRP HE3 . 9 TRP HE3 1 1
23 1 1 1 1 4 ARG QD . 8 ARG QD 1 1
23 1 2 1 1 5 TRP HH2 . 9 TRP HH2 1 1
24 1 1 1 1 4 ARG QD . 8 ARG QD 1 1
24 1 2 1 1 5 TRP HZ2 . 9 TRP HZ2 1 1
25 1 1 1 1 4 ARG QD . 8 ARG QD 1 1
25 1 2 1 1 5 TRP HZ3 . 9 TRP HZ3 1 1
26 1 1 1 1 4 ARG QG . 8 ARG QG 1 1
26 1 2 1 1 5 TRP H . 9 TRP HN 1 1
27 1 1 1 1 4 ARG QG . 8 ARG QG 1 1
27 1 2 1 1 5 TRP HE3 . 9 TRP HE3 1 1
28 1 1 1 1 4 ARG QG . 8 ARG QG 1 1
28 1 2 1 1 5 TRP HZ2 . 9 TRP HZ2 1 1
29 1 1 1 1 4 ARG QG . 8 ARG QG 1 1
29 1 2 1 1 5 TRP HZ3 . 9 TRP HZ3 1 1
30 1 1 1 1 5 TRP H . 9 TRP HN 1 1
30 1 2 1 1 5 TRP QB . 9 TRP HB2 1 1
31 1 1 1 1 5 TRP H . 9 TRP HN 1 1
31 1 2 1 1 5 TRP HE3 . 9 TRP HE3 1 1
32 1 1 1 1 5 TRP HA . 9 TRP HA 1 1
32 1 2 1 1 5 TRP HD1 . 9 TRP HD1 1 1
33 1 1 1 1 5 TRP HA . 9 TRP HA 1 1
33 1 2 1 1 5 TRP HE3 . 9 TRP HE3 1 1
34 1 1 1 1 5 TRP QB . 9 TRP HB3 1 1
34 1 2 1 1 5 TRP HD1 . 9 TRP HD1 1 1
35 1 1 1 1 5 TRP QB . 9 TRP HB2 1 1
35 1 2 1 1 5 TRP HE3 . 9 TRP HE3 1 1
36 1 1 1 1 5 TRP QB . 9 TRP HB2 1 1
36 1 2 1 1 5 TRP HZ3 . 9 TRP HZ3 1 1
37 1 1 1 1 5 TRP QB . 9 TRP HB2 1 1
37 1 2 1 1 6 ASP H . 10 ASP HN 1 1
stop_
loop_
_Dist_constraint_value.Constraint_ID
_Dist_constraint_value.Tree_node_ID
_Dist_constraint_value.Source_experiment_ID
_Dist_constraint_value.Spectral_peak_ID
_Dist_constraint_value.Intensity_val
_Dist_constraint_value.Intensity_lower_val_err
_Dist_constraint_value.Intensity_upper_val_err
_Dist_constraint_value.Distance_val
_Dist_constraint_value.Distance_lower_bound_val
_Dist_constraint_value.Distance_upper_bound_val
_Dist_constraint_value.Entry_ID
_Dist_constraint_value.Distance_constraint_list_ID
1 1 . . . . . . . 3.53 1 1
2 1 . . . . . . . 3.12 1 1
3 1 . . . . . . . 5.34 1 1
4 1 . . . . . . . 3.7 1 1
5 1 . . . . . . . 3.7 1 1
6 1 . . . . . . . 5.79 1 1
7 1 . . . . . . . 3.05 1 1
8 1 . . . . . . . 4.64 1 1
9 1 . . . . . . . 4.38 1 1
10 1 . . . . . . . 3.36 1 1
11 1 . . . . . . . 4.68 1 1
12 1 . . . . . . . 3.27 1 1
13 1 . . . . . . . 4.33 1 1
14 1 . . . . . . . 2.66 1 1
15 1 . . . . . . . 2.99 1 1
16 1 . . . . . . . 3.73 1 1
17 1 . . . . . . . 5.34 1 1
18 1 . . . . . . . 3.89 1 1
19 1 . . . . . . . 5.5 1 1
20 1 . . . . . . . 3.89 1 1
21 1 . . . . . . . 5.5 1 1
22 1 . . . . . . . 6.38 1 1
23 1 . . . . . . . 6.38 1 1
24 1 . . . . . . . 6.38 1 1
25 1 . . . . . . . 5.73 1 1
26 1 . . . . . . . 5.02 1 1
27 1 . . . . . . . 5.34 1 1
28 1 . . . . . . . 5.34 1 1
29 1 . . . . . . . 5.34 1 1
30 1 . . . . . . . 3.11 1 1
31 1 . . . . . . . 3.67 1 1
32 1 . . . . . . . 3.02 1 1
33 1 . . . . . . . 3.79 1 1
34 1 . . . . . . . 3.48 1 1
35 1 . . . . . . . 3.27 1 1
36 1 . . . . . . . 5.07 1 1
37 1 . . . . . . . 3.55 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 AC5 C C -1.011 -4.404 2.323 1.00 . A A . 5 AC5 C 1 1
1 2 1 1 1 AC5 CA C -0.297 -5.290 1.209 1.00 . A A . 5 AC5 CA 1 1
1 3 1 1 1 AC5 CB1 C -1.287 -6.145 0.389 1.00 . A A . 5 AC5 CB1 1 1
1 4 1 1 1 AC5 CB2 C 0.514 -6.420 1.894 1.00 . A A . 5 AC5 CB2 1 1
1 5 1 1 1 AC5 CG1 C -0.631 -7.486 0.017 1.00 . A A . 5 AC5 CG1 1 1
1 6 1 1 1 AC5 CG2 C 0.570 -7.638 0.956 1.00 . A A . 5 AC5 CG2 1 1
1 7 1 1 1 AC5 HB11 H -1.653 -5.583 -0.489 1.00 . A A . 5 AC5 HB11 1 1
1 8 1 1 1 AC5 HB12 H -2.177 -6.343 1.005 1.00 . A A . 5 AC5 HB12 1 1
1 9 1 1 1 AC5 HB21 H 0.008 -6.736 2.829 1.00 . A A . 5 AC5 HB21 1 1
1 10 1 1 1 AC5 HB22 H 1.521 -6.085 2.215 1.00 . A A . 5 AC5 HB22 1 1
1 11 1 1 1 AC5 HG11 H -1.345 -8.326 0.119 1.00 . A A . 5 AC5 HG11 1 1
1 12 1 1 1 AC5 HG12 H -0.300 -7.482 -1.039 1.00 . A A . 5 AC5 HG12 1 1
1 13 1 1 1 AC5 HG21 H 1.513 -7.639 0.376 1.00 . A A . 5 AC5 HG21 1 1
1 14 1 1 1 AC5 HG22 H 0.546 -8.593 1.516 1.00 . A A . 5 AC5 HG22 1 1
1 15 1 1 1 AC5 N N 0.636 -4.615 0.232 1.00 . A A . 5 AC5 N 1 1
1 16 1 1 1 AC5 O O -2.100 -4.714 2.817 1.00 . A A . 5 AC5 O 1 1
1 17 1 1 2 HIS C C -1.362 -0.938 3.092 1.00 . A A . 6 HIS C 1 1
1 18 1 1 2 HIS CA C -0.885 -2.314 3.694 1.00 . A A . 6 HIS CA 1 1
1 19 1 1 2 HIS CB C 0.229 -2.165 4.774 1.00 . A A . 6 HIS CB 1 1
1 20 1 1 2 HIS CD2 C -0.672 -2.506 7.169 1.00 . A A . 6 HIS CD2 1 1
1 21 1 1 2 HIS CE1 C -0.687 -0.521 7.838 1.00 . A A . 6 HIS CE1 1 1
1 22 1 1 2 HIS CG C -0.231 -1.673 6.138 1.00 . A A . 6 HIS CG 1 1
1 23 1 1 2 HIS H H 0.409 -3.177 2.054 1.00 . A A . 6 HIS H 1 1
1 24 1 1 2 HIS HA H -1.788 -2.723 4.185 1.00 . A A . 6 HIS HA 1 1
1 25 1 1 2 HIS HB2 H 0.745 -3.129 4.946 1.00 . A A . 6 HIS HB2 1 1
1 26 1 1 2 HIS HB3 H 1.029 -1.503 4.408 1.00 . A A . 6 HIS HB3 1 1
1 27 1 1 2 HIS HD1 H -0.030 0.491 6.025 1.00 . A A . 6 HIS HD1 1 1
1 28 1 1 2 HIS HD2 H -0.734 -3.579 7.070 1.00 . A A . 6 HIS HD2 1 1
1 29 1 1 2 HIS HE1 H -0.845 0.338 8.476 1.00 . A A . 6 HIS HE1 1 1
1 30 1 1 2 HIS N N -0.348 -3.322 2.728 1.00 . A A . 6 HIS N 1 1
1 31 1 1 2 HIS ND1 N -0.212 -0.362 6.563 1.00 . A A . 6 HIS ND1 1 1
1 32 1 1 2 HIS NE2 N -0.986 -1.776 8.307 1.00 . A A . 6 HIS NE2 1 1
1 33 1 1 2 HIS O O -1.830 -0.075 3.840 1.00 . A A . 6 HIS O 1 1
1 34 1 1 3 . C C -0.304 0.943 0.164 1.00 . A A . 7 DPN C 1 1
1 35 1 1 3 . CA C -1.493 0.608 1.124 1.00 . A A . 7 DPN CA 1 1
1 36 1 1 3 . CB C -2.867 0.562 0.409 1.00 . A A . 7 DPN CB 1 1
1 37 1 1 3 . CD1 C -4.029 2.794 0.799 1.00 . A A . 7 DPN CD1 1 1
1 38 1 1 3 . CD2 C -3.171 2.323 -1.409 1.00 . A A . 7 DPN CD2 1 1
1 39 1 1 3 . CE1 C -4.465 4.044 0.363 1.00 . A A . 7 DPN CE1 1 1
1 40 1 1 3 . CE2 C -3.607 3.574 -1.844 1.00 . A A . 7 DPN CE2 1 1
1 41 1 1 3 . CG C -3.378 1.926 -0.084 1.00 . A A . 7 DPN CG 1 1
1 42 1 1 3 . CZ C -4.252 4.431 -0.957 1.00 . A A . 7 DPN CZ 1 1
1 43 1 1 3 . H H -0.972 -1.548 1.241 1.00 . A A . 7 DPN H 1 1
1 44 1 1 3 . HA H -1.552 1.395 1.905 1.00 . A A . 7 DPN HA 1 1
1 45 1 1 3 . HB2 H -2.810 -0.157 -0.427 1.00 . A A . 7 DPN HB2 1 1
1 46 1 1 3 . HB3 H -3.629 0.126 1.087 1.00 . A A . 7 DPN HB3 1 1
1 47 1 1 3 . HD1 H -4.197 2.505 1.828 1.00 . A A . 7 DPN HD1 1 1
1 48 1 1 3 . HD2 H -2.665 1.667 -2.103 1.00 . A A . 7 DPN HD2 1 1
1 49 1 1 3 . HE1 H -4.968 4.711 1.047 1.00 . A A . 7 DPN HE1 1 1
1 50 1 1 3 . HE2 H -3.444 3.876 -2.869 1.00 . A A . 7 DPN HE2 1 1
1 51 1 1 3 . HZ H -4.593 5.400 -1.297 1.00 . A A . 7 DPN HZ 1 1
1 52 1 1 3 . N N -1.239 -0.708 1.773 1.00 . A A . 7 DPN N 1 1
1 53 1 1 3 . O O 0.143 0.113 -0.635 1.00 . A A . 7 DPN O 1 1
1 54 1 1 4 ARG C C 2.791 1.626 -0.223 1.00 . A A . 8 ARG C 1 1
1 55 1 1 4 ARG CA C 1.536 2.559 -0.385 1.00 . A A . 8 ARG CA 1 1
1 56 1 1 4 ARG CB C 1.845 4.041 -0.026 1.00 . A A . 8 ARG CB 1 1
1 57 1 1 4 ARG CD C 2.668 5.780 1.706 1.00 . A A . 8 ARG CD 1 1
1 58 1 1 4 ARG CG C 2.161 4.346 1.461 1.00 . A A . 8 ARG CG 1 1
1 59 1 1 4 ARG CZ C 4.062 5.671 3.801 1.00 . A A . 8 ARG CZ 1 1
1 60 1 1 4 ARG H H -0.297 2.808 0.862 1.00 . A A . 8 ARG H 1 1
1 61 1 1 4 ARG HA H 1.329 2.531 -1.464 1.00 . A A . 8 ARG HA 1 1
1 62 1 1 4 ARG HB2 H 2.691 4.375 -0.658 1.00 . A A . 8 ARG HB2 1 1
1 63 1 1 4 ARG HB3 H 0.996 4.670 -0.349 1.00 . A A . 8 ARG HB3 1 1
1 64 1 1 4 ARG HD2 H 3.555 6.008 1.076 1.00 . A A . 8 ARG HD2 1 1
1 65 1 1 4 ARG HD3 H 1.900 6.502 1.362 1.00 . A A . 8 ARG HD3 1 1
1 66 1 1 4 ARG HE H 2.265 6.511 3.738 1.00 . A A . 8 ARG HE 1 1
1 67 1 1 4 ARG HG2 H 1.257 4.160 2.071 1.00 . A A . 8 ARG HG2 1 1
1 68 1 1 4 ARG HG3 H 2.910 3.624 1.835 1.00 . A A . 8 ARG HG3 1 1
1 69 1 1 4 ARG HH11 H 5.859 4.766 3.818 1.00 . A A . 8 ARG HH11 1 1
1 70 1 1 4 ARG HH12 H 4.888 4.775 2.267 1.00 . A A . 8 ARG HH12 1 1
1 71 1 1 4 ARG HH21 H 3.399 6.522 5.470 1.00 . A A . 8 ARG HH21 1 1
1 72 1 1 4 ARG HH22 H 5.038 5.731 5.530 1.00 . A A . 8 ARG HH22 1 1
1 73 1 1 4 ARG N N 0.255 2.158 0.294 1.00 . A A . 8 ARG N 1 1
1 74 1 1 4 ARG NE N 2.946 6.018 3.153 1.00 . A A . 8 ARG NE 1 1
1 75 1 1 4 ARG NH1 N 5.049 5.013 3.246 1.00 . A A . 8 ARG NH1 1 1
1 76 1 1 4 ARG NH2 N 4.174 6.000 5.056 1.00 . A A . 8 ARG NH2 1 1
1 77 1 1 4 ARG O O 3.567 1.422 -1.158 1.00 . A A . 8 ARG O 1 1
1 78 1 1 5 TRP C C 3.931 -1.304 0.369 1.00 . A A . 9 TRP C 1 1
1 79 1 1 5 TRP CA C 3.868 -0.057 1.320 1.00 . A A . 9 TRP CA 1 1
1 80 1 1 5 TRP CB C 3.486 -0.519 2.754 1.00 . A A . 9 TRP CB 1 1
1 81 1 1 5 TRP CD1 C 4.662 0.879 4.688 1.00 . A A . 9 TRP CD1 1 1
1 82 1 1 5 TRP CD2 C 2.536 1.336 4.287 1.00 . A A . 9 TRP CD2 1 1
1 83 1 1 5 TRP CE2 C 2.988 2.166 5.334 1.00 . A A . 9 TRP CE2 1 1
1 84 1 1 5 TRP CE3 C 1.226 1.446 3.792 1.00 . A A . 9 TRP CE3 1 1
1 85 1 1 5 TRP CG C 3.564 0.524 3.884 1.00 . A A . 9 TRP CG 1 1
1 86 1 1 5 TRP CH2 C 0.802 3.215 5.403 1.00 . A A . 9 TRP CH2 1 1
1 87 1 1 5 TRP CZ2 C 2.104 3.116 5.911 1.00 . A A . 9 TRP CZ2 1 1
1 88 1 1 5 TRP CZ3 C 0.374 2.392 4.351 1.00 . A A . 9 TRP CZ3 1 1
1 89 1 1 5 TRP H H 2.152 1.292 1.592 1.00 . A A . 9 TRP H 1 1
1 90 1 1 5 TRP HA H 4.883 0.373 1.380 1.00 . A A . 9 TRP HA 1 1
1 91 1 1 5 TRP HB2 H 2.470 -0.957 2.730 1.00 . A A . 9 TRP HB2 1 1
1 92 1 1 5 TRP HB3 H 4.097 -1.370 3.052 1.00 . A A . 9 TRP HB3 1 1
1 93 1 1 5 TRP HD1 H 5.641 0.427 4.594 1.00 . A A . 9 TRP HD1 1 1
1 94 1 1 5 TRP HE1 H 4.890 2.264 6.384 1.00 . A A . 9 TRP HE1 1 1
1 95 1 1 5 TRP HE3 H 0.919 0.803 2.983 1.00 . A A . 9 TRP HE3 1 1
1 96 1 1 5 TRP HH2 H 0.114 3.932 5.826 1.00 . A A . 9 TRP HH2 1 1
1 97 1 1 5 TRP HZ2 H 2.432 3.752 6.719 1.00 . A A . 9 TRP HZ2 1 1
1 98 1 1 5 TRP HZ3 H -0.622 2.457 3.945 1.00 . A A . 9 TRP HZ3 1 1
1 99 1 1 5 TRP N N 2.924 1.039 0.970 1.00 . A A . 9 TRP N 1 1
1 100 1 1 5 TRP NE1 N 4.324 1.903 5.606 1.00 . A A . 9 TRP NE1 1 1
1 101 1 1 5 TRP O O 4.996 -1.908 0.236 1.00 . A A . 9 TRP O 1 1
1 102 1 1 6 ASP C C 3.592 -2.574 -2.598 1.00 . A A . 10 ASP C 1 1
1 103 1 1 6 ASP CA C 2.779 -2.797 -1.278 1.00 . A A . 10 ASP CA 1 1
1 104 1 1 6 ASP CB C 1.294 -3.133 -1.619 1.00 . A A . 10 ASP CB 1 1
1 105 1 1 6 ASP CG C 0.332 -3.523 -0.484 1.00 . A A . 10 ASP CG 1 1
1 106 1 1 6 ASP H H 2.003 -1.073 -0.127 1.00 . A A . 10 ASP H 1 1
1 107 1 1 6 ASP HA H 3.233 -3.692 -0.810 1.00 . A A . 10 ASP HA 1 1
1 108 1 1 6 ASP HB2 H 0.843 -2.268 -2.144 1.00 . A A . 10 ASP HB2 1 1
1 109 1 1 6 ASP HB3 H 1.261 -3.948 -2.366 1.00 . A A . 10 ASP HB3 1 1
1 110 1 1 6 ASP N N 2.811 -1.691 -0.276 1.00 . A A . 10 ASP N 1 1
1 111 1 1 6 ASP O O 4.116 -3.522 -3.177 1.00 . A A . 10 ASP O 1 1
1 112 1 1 6 ASP OD1 O -0.672 -2.847 -0.275 1.00 . A A . 10 ASP OD1 1 1
1 113 1 1 7 NH2 HN1 H 4.372 -1.391 -3.943 1.00 . A A . 11 NH2 HN1 1 1
1 114 1 1 7 NH2 HN2 H 3.466 -0.583 -2.561 1.00 . A A . 11 NH2 HN2 1 1
1 115 1 1 7 NH2 N N 3.728 -1.382 -3.149 1.00 . A A . 11 NH2 N 1 1
2 116 1 1 1 AC5 C C -0.801 -4.440 2.488 1.00 . A A . 5 AC5 C 1 1
2 117 1 1 1 AC5 CA C -0.167 -5.285 1.287 1.00 . A A . 5 AC5 CA 1 1
2 118 1 1 1 AC5 CB1 C -1.253 -6.051 0.477 1.00 . A A . 5 AC5 CB1 1 1
2 119 1 1 1 AC5 CB2 C 0.671 -6.450 1.890 1.00 . A A . 5 AC5 CB2 1 1
2 120 1 1 1 AC5 CG1 C -1.125 -7.549 0.781 1.00 . A A . 5 AC5 CG1 1 1
2 121 1 1 1 AC5 CG2 C 0.358 -7.720 1.088 1.00 . A A . 5 AC5 CG2 1 1
2 122 1 1 1 AC5 HB11 H -1.142 -5.881 -0.610 1.00 . A A . 5 AC5 HB11 1 1
2 123 1 1 1 AC5 HB12 H -2.265 -5.672 0.709 1.00 . A A . 5 AC5 HB12 1 1
2 124 1 1 1 AC5 HB21 H 0.376 -6.638 2.943 1.00 . A A . 5 AC5 HB21 1 1
2 125 1 1 1 AC5 HB22 H 1.756 -6.235 1.952 1.00 . A A . 5 AC5 HB22 1 1
2 126 1 1 1 AC5 HG11 H -1.740 -7.818 1.664 1.00 . A A . 5 AC5 HG11 1 1
2 127 1 1 1 AC5 HG12 H -1.468 -8.189 -0.056 1.00 . A A . 5 AC5 HG12 1 1
2 128 1 1 1 AC5 HG21 H 0.954 -7.763 0.154 1.00 . A A . 5 AC5 HG21 1 1
2 129 1 1 1 AC5 HG22 H 0.572 -8.650 1.652 1.00 . A A . 5 AC5 HG22 1 1
2 130 1 1 1 AC5 N N 0.757 -4.618 0.294 1.00 . A A . 5 AC5 N 1 1
2 131 1 1 1 AC5 O O -1.747 -4.868 3.155 1.00 . A A . 5 AC5 O 1 1
2 132 1 1 2 HIS C C -1.255 -0.903 3.262 1.00 . A A . 6 HIS C 1 1
2 133 1 1 2 HIS CA C -0.756 -2.305 3.797 1.00 . A A . 6 HIS CA 1 1
2 134 1 1 2 HIS CB C 0.395 -2.201 4.845 1.00 . A A . 6 HIS CB 1 1
2 135 1 1 2 HIS CD2 C -0.030 -2.733 7.343 1.00 . A A . 6 HIS CD2 1 1
2 136 1 1 2 HIS CE1 C -0.601 -0.831 8.015 1.00 . A A . 6 HIS CE1 1 1
2 137 1 1 2 HIS CG C -0.012 -1.840 6.266 1.00 . A A . 6 HIS CG 1 1
2 138 1 1 2 HIS H H 0.365 -3.044 1.971 1.00 . A A . 6 HIS H 1 1
2 139 1 1 2 HIS HA H -1.647 -2.734 4.295 1.00 . A A . 6 HIS HA 1 1
2 140 1 1 2 HIS HB2 H 0.953 -3.158 4.914 1.00 . A A . 6 HIS HB2 1 1
2 141 1 1 2 HIS HB3 H 1.156 -1.484 4.507 1.00 . A A . 6 HIS HB3 1 1
2 142 1 1 2 HIS HD1 H -0.665 0.207 6.112 1.00 . A A . 6 HIS HD1 1 1
2 143 1 1 2 HIS HD2 H 0.224 -3.780 7.253 1.00 . A A . 6 HIS HD2 1 1
2 144 1 1 2 HIS HE1 H -0.992 -0.057 8.662 1.00 . A A . 6 HIS HE1 1 1
2 145 1 1 2 HIS N N -0.237 -3.267 2.769 1.00 . A A . 6 HIS N 1 1
2 146 1 1 2 HIS ND1 N -0.349 -0.577 6.694 1.00 . A A . 6 HIS ND1 1 1
2 147 1 1 2 HIS NE2 N -0.415 -2.095 8.514 1.00 . A A . 6 HIS NE2 1 1
2 148 1 1 2 HIS O O -1.633 -0.034 4.052 1.00 . A A . 6 HIS O 1 1
2 149 1 1 3 . C C -0.322 1.048 0.358 1.00 . A A . 7 DPN C 1 1
2 150 1 1 3 . CA C -1.492 0.687 1.339 1.00 . A A . 7 DPN CA 1 1
2 151 1 1 3 . CB C -2.888 0.670 0.667 1.00 . A A . 7 DPN CB 1 1
2 152 1 1 3 . CD1 C -3.218 2.485 -1.092 1.00 . A A . 7 DPN CD1 1 1
2 153 1 1 3 . CD2 C -4.021 2.900 1.148 1.00 . A A . 7 DPN CD2 1 1
2 154 1 1 3 . CE1 C -3.652 3.752 -1.481 1.00 . A A . 7 DPN CE1 1 1
2 155 1 1 3 . CE2 C -4.457 4.164 0.757 1.00 . A A . 7 DPN CE2 1 1
2 156 1 1 3 . CG C -3.398 2.052 0.226 1.00 . A A . 7 DPN CG 1 1
2 157 1 1 3 . CZ C -4.270 4.589 -0.556 1.00 . A A . 7 DPN CZ 1 1
2 158 1 1 3 . H H -1.009 -1.480 1.383 1.00 . A A . 7 DPN H 1 1
2 159 1 1 3 . HA H -1.524 1.455 2.142 1.00 . A A . 7 DPN HA 1 1
2 160 1 1 3 . HB2 H -2.866 -0.027 -0.189 1.00 . A A . 7 DPN HB2 1 1
2 161 1 1 3 . HB3 H -3.633 0.225 1.356 1.00 . A A . 7 DPN HB3 1 1
2 162 1 1 3 . HD1 H -2.741 1.842 -1.819 1.00 . A A . 7 DPN HD1 1 1
2 163 1 1 3 . HD2 H -4.178 2.576 2.169 1.00 . A A . 7 DPN HD2 1 1
2 164 1 1 3 . HE1 H -3.520 4.078 -2.503 1.00 . A A . 7 DPN HE1 1 1
2 165 1 1 3 . HE2 H -4.949 4.812 1.469 1.00 . A A . 7 DPN HE2 1 1
2 166 1 1 3 . HZ H -4.620 5.566 -0.862 1.00 . A A . 7 DPN HZ 1 1
2 167 1 1 3 . N N -1.239 -0.649 1.944 1.00 . A A . 7 DPN N 1 1
2 168 1 1 3 . O O 0.137 0.231 -0.447 1.00 . A A . 7 DPN O 1 1
2 169 1 1 4 ARG C C 2.800 1.784 -0.046 1.00 . A A . 8 ARG C 1 1
2 170 1 1 4 ARG CA C 1.505 2.675 -0.196 1.00 . A A . 8 ARG CA 1 1
2 171 1 1 4 ARG CB C 1.794 4.151 0.196 1.00 . A A . 8 ARG CB 1 1
2 172 1 1 4 ARG CD C 2.958 5.683 1.935 1.00 . A A . 8 ARG CD 1 1
2 173 1 1 4 ARG CG C 2.108 4.421 1.694 1.00 . A A . 8 ARG CG 1 1
2 174 1 1 4 ARG CZ C 4.370 5.126 3.943 1.00 . A A . 8 ARG CZ 1 1
2 175 1 1 4 ARG H H -0.363 2.915 1.016 1.00 . A A . 8 ARG H 1 1
2 176 1 1 4 ARG HA H 1.300 2.652 -1.277 1.00 . A A . 8 ARG HA 1 1
2 177 1 1 4 ARG HB2 H 2.635 4.495 -0.437 1.00 . A A . 8 ARG HB2 1 1
2 178 1 1 4 ARG HB3 H 0.944 4.783 -0.119 1.00 . A A . 8 ARG HB3 1 1
2 179 1 1 4 ARG HD2 H 3.840 5.709 1.259 1.00 . A A . 8 ARG HD2 1 1
2 180 1 1 4 ARG HD3 H 2.369 6.579 1.644 1.00 . A A . 8 ARG HD3 1 1
2 181 1 1 4 ARG HE H 2.886 6.435 4.003 1.00 . A A . 8 ARG HE 1 1
2 182 1 1 4 ARG HG2 H 1.159 4.477 2.263 1.00 . A A . 8 ARG HG2 1 1
2 183 1 1 4 ARG HG3 H 2.625 3.543 2.121 1.00 . A A . 8 ARG HG3 1 1
2 184 1 1 4 ARG HH11 H 5.799 3.725 3.862 1.00 . A A . 8 ARG HH11 1 1
2 185 1 1 4 ARG HH12 H 4.828 4.082 2.352 1.00 . A A . 8 ARG HH12 1 1
2 186 1 1 4 ARG HH21 H 5.385 4.823 5.610 1.00 . A A . 8 ARG HH21 1 1
2 187 1 1 4 ARG HH22 H 4.044 6.056 5.658 1.00 . A A . 8 ARG HH22 1 1
2 188 1 1 4 ARG N N 0.229 2.265 0.491 1.00 . A A . 8 ARG N 1 1
2 189 1 1 4 ARG NE N 3.370 5.792 3.367 1.00 . A A . 8 ARG NE 1 1
2 190 1 1 4 ARG NH1 N 5.103 4.244 3.323 1.00 . A A . 8 ARG NH1 1 1
2 191 1 1 4 ARG NH2 N 4.626 5.363 5.188 1.00 . A A . 8 ARG NH2 1 1
2 192 1 1 4 ARG O O 3.700 1.801 -0.883 1.00 . A A . 8 ARG O 1 1
2 193 1 1 5 TRP C C 3.984 -1.224 0.336 1.00 . A A . 9 TRP C 1 1
2 194 1 1 5 TRP CA C 3.876 -0.019 1.340 1.00 . A A . 9 TRP CA 1 1
2 195 1 1 5 TRP CB C 3.519 -0.548 2.758 1.00 . A A . 9 TRP CB 1 1
2 196 1 1 5 TRP CD1 C 4.753 0.657 4.778 1.00 . A A . 9 TRP CD1 1 1
2 197 1 1 5 TRP CD2 C 2.655 1.251 4.406 1.00 . A A . 9 TRP CD2 1 1
2 198 1 1 5 TRP CE2 C 3.133 1.952 5.532 1.00 . A A . 9 TRP CE2 1 1
2 199 1 1 5 TRP CE3 C 1.345 1.442 3.938 1.00 . A A . 9 TRP CE3 1 1
2 200 1 1 5 TRP CG C 3.649 0.433 3.935 1.00 . A A . 9 TRP CG 1 1
2 201 1 1 5 TRP CH2 C 0.973 3.041 5.726 1.00 . A A . 9 TRP CH2 1 1
2 202 1 1 5 TRP CZ2 C 2.274 2.851 6.217 1.00 . A A . 9 TRP CZ2 1 1
2 203 1 1 5 TRP CZ3 C 0.524 2.347 4.594 1.00 . A A . 9 TRP CZ3 1 1
2 204 1 1 5 TRP H H 1.984 1.093 1.566 1.00 . A A . 9 TRP H 1 1
2 205 1 1 5 TRP HA H 4.875 0.448 1.407 1.00 . A A . 9 TRP HA 1 1
2 206 1 1 5 TRP HB2 H 2.497 -0.978 2.741 1.00 . A A . 9 TRP HB2 1 1
2 207 1 1 5 TRP HB3 H 4.126 -1.425 2.994 1.00 . A A . 9 TRP HB3 1 1
2 208 1 1 5 TRP HD1 H 5.689 0.126 4.674 1.00 . A A . 9 TRP HD1 1 1
2 209 1 1 5 TRP HE1 H 4.946 1.718 6.682 1.00 . A A . 9 TRP HE1 1 1
2 210 1 1 5 TRP HE3 H 1.006 0.870 3.088 1.00 . A A . 9 TRP HE3 1 1
2 211 1 1 5 TRP HH2 H 0.296 3.713 6.233 1.00 . A A . 9 TRP HH2 1 1
2 212 1 1 5 TRP HZ2 H 2.611 3.373 7.100 1.00 . A A . 9 TRP HZ2 1 1
2 213 1 1 5 TRP HZ3 H -0.476 2.467 4.207 1.00 . A A . 9 TRP HZ3 1 1
2 214 1 1 5 TRP N N 2.864 1.035 1.051 1.00 . A A . 9 TRP N 1 1
2 215 1 1 5 TRP NE1 N 4.460 1.615 5.783 1.00 . A A . 9 TRP NE1 1 1
2 216 1 1 5 TRP O O 5.062 -1.808 0.220 1.00 . A A . 9 TRP O 1 1
2 217 1 1 6 ASP C C 3.700 -2.697 -2.594 1.00 . A A . 10 ASP C 1 1
2 218 1 1 6 ASP CA C 2.875 -2.800 -1.264 1.00 . A A . 10 ASP CA 1 1
2 219 1 1 6 ASP CB C 1.392 -3.160 -1.569 1.00 . A A . 10 ASP CB 1 1
2 220 1 1 6 ASP CG C 0.462 -3.516 -0.402 1.00 . A A . 10 ASP CG 1 1
2 221 1 1 6 ASP H H 2.057 -1.045 -0.187 1.00 . A A . 10 ASP H 1 1
2 222 1 1 6 ASP HA H 3.332 -3.657 -0.729 1.00 . A A . 10 ASP HA 1 1
2 223 1 1 6 ASP HB2 H 0.922 -2.325 -2.123 1.00 . A A . 10 ASP HB2 1 1
2 224 1 1 6 ASP HB3 H 1.354 -4.005 -2.283 1.00 . A A . 10 ASP HB3 1 1
2 225 1 1 6 ASP N N 2.893 -1.620 -0.346 1.00 . A A . 10 ASP N 1 1
2 226 1 1 6 ASP O O 4.203 -3.696 -3.100 1.00 . A A . 10 ASP O 1 1
2 227 1 1 6 ASP OD1 O -0.503 -2.803 -0.145 1.00 . A A . 10 ASP OD1 1 1
2 228 1 1 7 NH2 HN1 H 4.523 -1.654 -4.017 1.00 . A A . 11 NH2 HN1 1 1
2 229 1 1 7 NH2 HN2 H 3.625 -0.713 -2.713 1.00 . A A . 11 NH2 HN2 1 1
2 230 1 1 7 NH2 N N 3.866 -1.560 -3.237 1.00 . A A . 11 NH2 N 1 1
3 231 1 1 1 AC5 C C -1.160 -4.349 2.199 1.00 . A A . 5 AC5 C 1 1
3 232 1 1 1 AC5 CA C -0.394 -5.246 1.124 1.00 . A A . 5 AC5 CA 1 1
3 233 1 1 1 AC5 CB1 C -1.366 -6.079 0.265 1.00 . A A . 5 AC5 CB1 1 1
3 234 1 1 1 AC5 CB2 C 0.373 -6.401 1.821 1.00 . A A . 5 AC5 CB2 1 1
3 235 1 1 1 AC5 CG1 C -1.718 -7.368 1.027 1.00 . A A . 5 AC5 CG1 1 1
3 236 1 1 1 AC5 CG2 C -0.654 -7.505 2.120 1.00 . A A . 5 AC5 CG2 1 1
3 237 1 1 1 AC5 HB11 H -0.888 -6.344 -0.693 1.00 . A A . 5 AC5 HB11 1 1
3 238 1 1 1 AC5 HB12 H -2.251 -5.470 0.007 1.00 . A A . 5 AC5 HB12 1 1
3 239 1 1 1 AC5 HB21 H 0.900 -6.069 2.736 1.00 . A A . 5 AC5 HB21 1 1
3 240 1 1 1 AC5 HB22 H 1.155 -6.835 1.166 1.00 . A A . 5 AC5 HB22 1 1
3 241 1 1 1 AC5 HG11 H -2.728 -7.298 1.476 1.00 . A A . 5 AC5 HG11 1 1
3 242 1 1 1 AC5 HG12 H -1.730 -8.245 0.351 1.00 . A A . 5 AC5 HG12 1 1
3 243 1 1 1 AC5 HG21 H -0.195 -8.512 2.144 1.00 . A A . 5 AC5 HG21 1 1
3 244 1 1 1 AC5 HG22 H -1.111 -7.342 3.117 1.00 . A A . 5 AC5 HG22 1 1
3 245 1 1 1 AC5 N N 0.580 -4.562 0.194 1.00 . A A . 5 AC5 N 1 1
3 246 1 1 1 AC5 O O -2.323 -4.566 2.552 1.00 . A A . 5 AC5 O 1 1
3 247 1 1 2 HIS C C -1.470 -0.941 3.003 1.00 . A A . 6 HIS C 1 1
3 248 1 1 2 HIS CA C -1.012 -2.308 3.631 1.00 . A A . 6 HIS CA 1 1
3 249 1 1 2 HIS CB C 0.079 -2.083 4.716 1.00 . A A . 6 HIS CB 1 1
3 250 1 1 2 HIS CD2 C 1.361 -4.082 5.767 1.00 . A A . 6 HIS CD2 1 1
3 251 1 1 2 HIS CE1 C 0.026 -4.590 7.301 1.00 . A A . 6 HIS CE1 1 1
3 252 1 1 2 HIS CG C 0.266 -3.211 5.728 1.00 . A A . 6 HIS CG 1 1
3 253 1 1 2 HIS H H 0.402 -3.247 2.157 1.00 . A A . 6 HIS H 1 1
3 254 1 1 2 HIS HA H -1.920 -2.696 4.125 1.00 . A A . 6 HIS HA 1 1
3 255 1 1 2 HIS HB2 H 1.047 -1.835 4.243 1.00 . A A . 6 HIS HB2 1 1
3 256 1 1 2 HIS HB3 H -0.154 -1.178 5.288 1.00 . A A . 6 HIS HB3 1 1
3 257 1 1 2 HIS HD1 H -1.524 -3.096 6.972 1.00 . A A . 6 HIS HD1 1 1
3 258 1 1 2 HIS HD2 H 2.191 -4.029 5.083 1.00 . A A . 6 HIS HD2 1 1
3 259 1 1 2 HIS HE1 H -0.408 -5.111 8.145 1.00 . A A . 6 HIS HE1 1 1
3 260 1 1 2 HIS N N -0.457 -3.336 2.703 1.00 . A A . 6 HIS N 1 1
3 261 1 1 2 HIS ND1 N -0.623 -3.522 6.737 1.00 . A A . 6 HIS ND1 1 1
3 262 1 1 2 HIS NE2 N 1.232 -5.008 6.795 1.00 . A A . 6 HIS NE2 1 1
3 263 1 1 2 HIS O O -1.968 -0.084 3.737 1.00 . A A . 6 HIS O 1 1
3 264 1 1 3 . C C -0.286 0.949 0.132 1.00 . A A . 7 DPN C 1 1
3 265 1 1 3 . CA C -1.514 0.612 1.040 1.00 . A A . 7 DPN CA 1 1
3 266 1 1 3 . CB C -2.857 0.571 0.268 1.00 . A A . 7 DPN CB 1 1
3 267 1 1 3 . CD1 C -3.076 2.328 -1.566 1.00 . A A . 7 DPN CD1 1 1
3 268 1 1 3 . CD2 C -4.029 2.807 0.602 1.00 . A A . 7 DPN CD2 1 1
3 269 1 1 3 . CE1 C -3.488 3.578 -2.022 1.00 . A A . 7 DPN CE1 1 1
3 270 1 1 3 . CE2 C -4.442 4.056 0.143 1.00 . A A . 7 DPN CE2 1 1
3 271 1 1 3 . CG C -3.341 1.935 -0.249 1.00 . A A . 7 DPN CG 1 1
3 272 1 1 3 . CZ C -4.170 4.441 -1.168 1.00 . A A . 7 DPN CZ 1 1
3 273 1 1 3 . H H -1.024 -1.550 1.163 1.00 . A A . 7 DPN H 1 1
3 274 1 1 3 . HA H -1.605 1.396 1.823 1.00 . A A . 7 DPN HA 1 1
3 275 1 1 3 . HB2 H -2.764 -0.150 -0.565 1.00 . A A . 7 DPN HB2 1 1
3 276 1 1 3 . HB3 H -3.648 0.138 0.913 1.00 . A A . 7 DPN HB3 1 1
3 277 1 1 3 . HD1 H -2.541 1.670 -2.236 1.00 . A A . 7 DPN HD1 1 1
3 278 1 1 3 . HD2 H -4.243 2.519 1.622 1.00 . A A . 7 DPN HD2 1 1
3 279 1 1 3 . HE1 H -3.280 3.878 -3.039 1.00 . A A . 7 DPN HE1 1 1
3 280 1 1 3 . HE2 H -4.973 4.727 0.805 1.00 . A A . 7 DPN HE2 1 1
3 281 1 1 3 . HZ H -4.494 5.410 -1.522 1.00 . A A . 7 DPN HZ 1 1
3 282 1 1 3 . N N -1.289 -0.707 1.692 1.00 . A A . 7 DPN N 1 1
3 283 1 1 3 . O O 0.174 0.129 -0.671 1.00 . A A . 7 DPN O 1 1
3 284 1 1 4 ARG C C 2.820 1.624 -0.203 1.00 . A A . 8 ARG C 1 1
3 285 1 1 4 ARG CA C 1.569 2.566 -0.352 1.00 . A A . 8 ARG CA 1 1
3 286 1 1 4 ARG CB C 1.877 4.039 0.042 1.00 . A A . 8 ARG CB 1 1
3 287 1 1 4 ARG CD C 2.663 5.750 1.814 1.00 . A A . 8 ARG CD 1 1
3 288 1 1 4 ARG CG C 2.204 4.306 1.534 1.00 . A A . 8 ARG CG 1 1
3 289 1 1 4 ARG CZ C 4.110 5.647 3.872 1.00 . A A . 8 ARG CZ 1 1
3 290 1 1 4 ARG H H -0.279 2.796 0.873 1.00 . A A . 8 ARG H 1 1
3 291 1 1 4 ARG HA H 1.372 2.566 -1.434 1.00 . A A . 8 ARG HA 1 1
3 292 1 1 4 ARG HB2 H 2.718 4.392 -0.587 1.00 . A A . 8 ARG HB2 1 1
3 293 1 1 4 ARG HB3 H 1.024 4.674 -0.259 1.00 . A A . 8 ARG HB3 1 1
3 294 1 1 4 ARG HD2 H 3.524 6.032 1.173 1.00 . A A . 8 ARG HD2 1 1
3 295 1 1 4 ARG HD3 H 1.859 6.451 1.511 1.00 . A A . 8 ARG HD3 1 1
3 296 1 1 4 ARG HE H 2.272 6.394 3.877 1.00 . A A . 8 ARG HE 1 1
3 297 1 1 4 ARG HG2 H 1.317 4.069 2.151 1.00 . A A . 8 ARG HG2 1 1
3 298 1 1 4 ARG HG3 H 2.985 3.599 1.873 1.00 . A A . 8 ARG HG3 1 1
3 299 1 1 4 ARG HH11 H 5.129 5.710 5.576 1.00 . A A . 8 ARG HH11 1 1
3 300 1 1 4 ARG HH12 H 3.452 6.420 5.579 1.00 . A A . 8 ARG HH12 1 1
3 301 1 1 4 ARG HH21 H 5.951 4.834 3.817 1.00 . A A . 8 ARG HH21 1 1
3 302 1 1 4 ARG HH22 H 4.937 4.833 2.293 1.00 . A A . 8 ARG HH22 1 1
3 303 1 1 4 ARG N N 0.280 2.156 0.304 1.00 . A A . 8 ARG N 1 1
3 304 1 1 4 ARG NE N 2.962 5.955 3.261 1.00 . A A . 8 ARG NE 1 1
3 305 1 1 4 ARG NH1 N 4.240 5.947 5.132 1.00 . A A . 8 ARG NH1 1 1
3 306 1 1 4 ARG NH2 N 5.114 5.055 3.275 1.00 . A A . 8 ARG NH2 1 1
3 307 1 1 4 ARG O O 3.605 1.446 -1.136 1.00 . A A . 8 ARG O 1 1
3 308 1 1 5 TRP C C 3.935 -1.331 0.335 1.00 . A A . 9 TRP C 1 1
3 309 1 1 5 TRP CA C 3.890 -0.094 1.300 1.00 . A A . 9 TRP CA 1 1
3 310 1 1 5 TRP CB C 3.532 -0.576 2.734 1.00 . A A . 9 TRP CB 1 1
3 311 1 1 5 TRP CD1 C 4.699 0.856 4.648 1.00 . A A . 9 TRP CD1 1 1
3 312 1 1 5 TRP CD2 C 2.551 1.244 4.283 1.00 . A A . 9 TRP CD2 1 1
3 313 1 1 5 TRP CE2 C 3.001 2.106 5.305 1.00 . A A . 9 TRP CE2 1 1
3 314 1 1 5 TRP CE3 C 1.234 1.319 3.798 1.00 . A A . 9 TRP CE3 1 1
3 315 1 1 5 TRP CG C 3.597 0.459 3.871 1.00 . A A . 9 TRP CG 1 1
3 316 1 1 5 TRP CH2 C 0.797 3.120 5.371 1.00 . A A . 9 TRP CH2 1 1
3 317 1 1 5 TRP CZ2 C 2.108 3.055 5.867 1.00 . A A . 9 TRP CZ2 1 1
3 318 1 1 5 TRP CZ3 C 0.374 2.263 4.344 1.00 . A A . 9 TRP CZ3 1 1
3 319 1 1 5 TRP H H 2.170 1.247 1.600 1.00 . A A . 9 TRP H 1 1
3 320 1 1 5 TRP HA H 4.905 0.336 1.348 1.00 . A A . 9 TRP HA 1 1
3 321 1 1 5 TRP HB2 H 2.526 -1.036 2.715 1.00 . A A . 9 TRP HB2 1 1
3 322 1 1 5 TRP HB3 H 4.166 -1.418 3.016 1.00 . A A . 9 TRP HB3 1 1
3 323 1 1 5 TRP HD1 H 5.692 0.442 4.535 1.00 . A A . 9 TRP HD1 1 1
3 324 1 1 5 TRP HE1 H 4.920 2.279 6.313 1.00 . A A . 9 TRP HE1 1 1
3 325 1 1 5 TRP HE3 H 0.934 0.659 2.999 1.00 . A A . 9 TRP HE3 1 1
3 326 1 1 5 TRP HH2 H 0.103 3.836 5.781 1.00 . A A . 9 TRP HH2 1 1
3 327 1 1 5 TRP HZ2 H 2.434 3.719 6.654 1.00 . A A . 9 TRP HZ2 1 1
3 328 1 1 5 TRP HZ3 H -0.625 2.309 3.939 1.00 . A A . 9 TRP HZ3 1 1
3 329 1 1 5 TRP N N 2.941 1.005 0.973 1.00 . A A . 9 TRP N 1 1
3 330 1 1 5 TRP NE1 N 4.348 1.883 5.559 1.00 . A A . 9 TRP NE1 1 1
3 331 1 1 5 TRP O O 4.992 -1.948 0.195 1.00 . A A . 9 TRP O 1 1
3 332 1 1 6 ASP C C 3.576 -2.578 -2.635 1.00 . A A . 10 ASP C 1 1
3 333 1 1 6 ASP CA C 2.754 -2.794 -1.317 1.00 . A A . 10 ASP CA 1 1
3 334 1 1 6 ASP CB C 1.267 -3.098 -1.665 1.00 . A A . 10 ASP CB 1 1
3 335 1 1 6 ASP CG C 0.284 -3.482 -0.546 1.00 . A A . 10 ASP CG 1 1
3 336 1 1 6 ASP H H 2.017 -1.056 -0.158 1.00 . A A . 10 ASP H 1 1
3 337 1 1 6 ASP HA H 3.192 -3.700 -0.857 1.00 . A A . 10 ASP HA 1 1
3 338 1 1 6 ASP HB2 H 0.835 -2.218 -2.185 1.00 . A A . 10 ASP HB2 1 1
3 339 1 1 6 ASP HB3 H 1.219 -3.903 -2.421 1.00 . A A . 10 ASP HB3 1 1
3 340 1 1 6 ASP N N 2.809 -1.696 -0.310 1.00 . A A . 10 ASP N 1 1
3 341 1 1 6 ASP O O 4.096 -3.530 -3.211 1.00 . A A . 10 ASP O 1 1
3 342 1 1 6 ASP OD1 O -0.740 -2.821 -0.380 1.00 . A A . 10 ASP OD1 1 1
3 343 1 1 7 NH2 HN1 H 4.371 -1.400 -3.975 1.00 . A A . 11 NH2 HN1 1 1
3 344 1 1 7 NH2 HN2 H 3.463 -0.585 -2.599 1.00 . A A . 11 NH2 HN2 1 1
3 345 1 1 7 NH2 N N 3.723 -1.387 -3.185 1.00 . A A . 11 NH2 N 1 1
4 346 1 1 1 AC5 C C -1.029 -4.387 2.343 1.00 . A A . 5 AC5 C 1 1
4 347 1 1 1 AC5 CA C -0.323 -5.273 1.221 1.00 . A A . 5 AC5 CA 1 1
4 348 1 1 1 AC5 CB1 C -1.371 -6.047 0.375 1.00 . A A . 5 AC5 CB1 1 1
4 349 1 1 1 AC5 CB2 C 0.474 -6.428 1.902 1.00 . A A . 5 AC5 CB2 1 1
4 350 1 1 1 AC5 CG1 C -1.398 -7.498 0.866 1.00 . A A . 5 AC5 CG1 1 1
4 351 1 1 1 AC5 CG2 C 0.059 -7.749 1.237 1.00 . A A . 5 AC5 CG2 1 1
4 352 1 1 1 AC5 HB11 H -1.105 -6.032 -0.698 1.00 . A A . 5 AC5 HB11 1 1
4 353 1 1 1 AC5 HB12 H -2.361 -5.560 0.425 1.00 . A A . 5 AC5 HB12 1 1
4 354 1 1 1 AC5 HB21 H 0.228 -6.502 2.980 1.00 . A A . 5 AC5 HB21 1 1
4 355 1 1 1 AC5 HB22 H 1.573 -6.289 1.889 1.00 . A A . 5 AC5 HB22 1 1
4 356 1 1 1 AC5 HG11 H -2.053 -7.596 1.755 1.00 . A A . 5 AC5 HG11 1 1
4 357 1 1 1 AC5 HG12 H -1.776 -8.204 0.103 1.00 . A A . 5 AC5 HG12 1 1
4 358 1 1 1 AC5 HG21 H 0.668 -7.939 0.329 1.00 . A A . 5 AC5 HG21 1 1
4 359 1 1 1 AC5 HG22 H 0.186 -8.623 1.903 1.00 . A A . 5 AC5 HG22 1 1
4 360 1 1 1 AC5 N N 0.635 -4.609 0.260 1.00 . A A . 5 AC5 N 1 1
4 361 1 1 1 AC5 O O -2.091 -4.728 2.874 1.00 . A A . 5 AC5 O 1 1
4 362 1 1 2 HIS C C -1.468 -0.897 2.970 1.00 . A A . 6 HIS C 1 1
4 363 1 1 2 HIS CA C -0.971 -2.239 3.620 1.00 . A A . 6 HIS CA 1 1
4 364 1 1 2 HIS CB C 0.132 -1.968 4.682 1.00 . A A . 6 HIS CB 1 1
4 365 1 1 2 HIS CD2 C 1.454 -3.929 5.756 1.00 . A A . 6 HIS CD2 1 1
4 366 1 1 2 HIS CE1 C 0.156 -4.407 7.331 1.00 . A A . 6 HIS CE1 1 1
4 367 1 1 2 HIS CG C 0.351 -3.066 5.719 1.00 . A A . 6 HIS CG 1 1
4 368 1 1 2 HIS H H 0.373 -3.110 2.055 1.00 . A A . 6 HIS H 1 1
4 369 1 1 2 HIS HA H -1.864 -2.634 4.135 1.00 . A A . 6 HIS HA 1 1
4 370 1 1 2 HIS HB2 H 1.089 -1.720 4.186 1.00 . A A . 6 HIS HB2 1 1
4 371 1 1 2 HIS HB3 H -0.106 -1.051 5.232 1.00 . A A . 6 HIS HB3 1 1
4 372 1 1 2 HIS HD1 H -1.414 -2.936 6.996 1.00 . A A . 6 HIS HD1 1 1
4 373 1 1 2 HIS HD2 H 2.266 -3.892 5.051 1.00 . A A . 6 HIS HD2 1 1
4 374 1 1 2 HIS HE1 H -0.256 -4.910 8.195 1.00 . A A . 6 HIS HE1 1 1
4 375 1 1 2 HIS N N -0.404 -3.266 2.699 1.00 . A A . 6 HIS N 1 1
4 376 1 1 2 HIS ND1 N -0.512 -3.358 6.755 1.00 . A A . 6 HIS ND1 1 1
4 377 1 1 2 HIS NE2 N 1.354 -4.829 6.809 1.00 . A A . 6 HIS NE2 1 1
4 378 1 1 2 HIS O O -1.947 -0.023 3.697 1.00 . A A . 6 HIS O 1 1
4 379 1 1 3 . C C -0.394 0.963 0.068 1.00 . A A . 7 DPN C 1 1
4 380 1 1 3 . CA C -1.619 0.594 0.963 1.00 . A A . 7 DPN CA 1 1
4 381 1 1 3 . CB C -2.943 0.480 0.168 1.00 . A A . 7 DPN CB 1 1
4 382 1 1 3 . CD1 C -4.235 2.657 0.453 1.00 . A A . 7 DPN CD1 1 1
4 383 1 1 3 . CD2 C -3.189 2.220 -1.681 1.00 . A A . 7 DPN CD2 1 1
4 384 1 1 3 . CE1 C -4.693 3.884 -0.025 1.00 . A A . 7 DPN CE1 1 1
4 385 1 1 3 . CE2 C -3.645 3.447 -2.156 1.00 . A A . 7 DPN CE2 1 1
4 386 1 1 3 . CG C -3.478 1.818 -0.372 1.00 . A A . 7 DPN CG 1 1
4 387 1 1 3 . CZ C -4.397 4.278 -1.327 1.00 . A A . 7 DPN CZ 1 1
4 388 1 1 3 . H H -1.064 -1.551 1.135 1.00 . A A . 7 DPN H 1 1
4 389 1 1 3 . HA H -1.766 1.389 1.723 1.00 . A A . 7 DPN HA 1 1
4 390 1 1 3 . HB2 H -2.799 -0.240 -0.656 1.00 . A A . 7 DPN HB2 1 1
4 391 1 1 3 . HB3 H -3.727 0.015 0.801 1.00 . A A . 7 DPN HB3 1 1
4 392 1 1 3 . HD1 H -4.469 2.364 1.466 1.00 . A A . 7 DPN HD1 1 1
4 393 1 1 3 . HD2 H -2.599 1.588 -2.328 1.00 . A A . 7 DPN HD2 1 1
4 394 1 1 3 . HE1 H -5.278 4.529 0.615 1.00 . A A . 7 DPN HE1 1 1
4 395 1 1 3 . HE2 H -3.417 3.753 -3.166 1.00 . A A . 7 DPN HE2 1 1
4 396 1 1 3 . HZ H -4.754 5.228 -1.698 1.00 . A A . 7 DPN HZ 1 1
4 397 1 1 3 . N N -1.346 -0.702 1.645 1.00 . A A . 7 DPN N 1 1
4 398 1 1 3 . O O 0.020 0.201 -0.813 1.00 . A A . 7 DPN O 1 1
4 399 1 1 4 ARG C C 2.685 1.576 -0.310 1.00 . A A . 8 ARG C 1 1
4 400 1 1 4 ARG CA C 1.483 2.590 -0.327 1.00 . A A . 8 ARG CA 1 1
4 401 1 1 4 ARG CB C 1.974 3.945 0.284 1.00 . A A . 8 ARG CB 1 1
4 402 1 1 4 ARG CD C 1.591 6.329 1.258 1.00 . A A . 8 ARG CD 1 1
4 403 1 1 4 ARG CG C 0.952 5.027 0.734 1.00 . A A . 8 ARG CG 1 1
4 404 1 1 4 ARG CZ C 3.160 6.972 3.112 1.00 . A A . 8 ARG CZ 1 1
4 405 1 1 4 ARG H H -0.311 2.717 0.989 1.00 . A A . 8 ARG H 1 1
4 406 1 1 4 ARG HA H 1.251 2.741 -1.394 1.00 . A A . 8 ARG HA 1 1
4 407 1 1 4 ARG HB2 H 2.605 3.726 1.166 1.00 . A A . 8 ARG HB2 1 1
4 408 1 1 4 ARG HB3 H 2.679 4.403 -0.438 1.00 . A A . 8 ARG HB3 1 1
4 409 1 1 4 ARG HD2 H 2.242 6.752 0.467 1.00 . A A . 8 ARG HD2 1 1
4 410 1 1 4 ARG HD3 H 0.789 7.073 1.435 1.00 . A A . 8 ARG HD3 1 1
4 411 1 1 4 ARG HE H 2.345 5.167 2.960 1.00 . A A . 8 ARG HE 1 1
4 412 1 1 4 ARG HG2 H 0.282 5.269 -0.113 1.00 . A A . 8 ARG HG2 1 1
4 413 1 1 4 ARG HG3 H 0.283 4.623 1.520 1.00 . A A . 8 ARG HG3 1 1
4 414 1 1 4 ARG HH11 H 4.475 7.259 4.572 1.00 . A A . 8 ARG HH11 1 1
4 415 1 1 4 ARG HH12 H 3.772 5.590 4.392 1.00 . A A . 8 ARG HH12 1 1
4 416 1 1 4 ARG HH21 H 3.922 8.829 3.235 1.00 . A A . 8 ARG HH21 1 1
4 417 1 1 4 ARG HH22 H 2.698 8.466 1.923 1.00 . A A . 8 ARG HH22 1 1
4 418 1 1 4 ARG N N 0.210 2.133 0.332 1.00 . A A . 8 ARG N 1 1
4 419 1 1 4 ARG NE N 2.354 6.091 2.519 1.00 . A A . 8 ARG NE 1 1
4 420 1 1 4 ARG NH1 N 3.858 6.574 4.134 1.00 . A A . 8 ARG NH1 1 1
4 421 1 1 4 ARG NH2 N 3.284 8.216 2.722 1.00 . A A . 8 ARG NH2 1 1
4 422 1 1 4 ARG O O 3.358 1.324 -1.311 1.00 . A A . 8 ARG O 1 1
4 423 1 1 5 TRP C C 3.961 -1.326 0.363 1.00 . A A . 9 TRP C 1 1
4 424 1 1 5 TRP CA C 3.914 -0.018 1.225 1.00 . A A . 9 TRP CA 1 1
4 425 1 1 5 TRP CB C 3.661 -0.362 2.724 1.00 . A A . 9 TRP CB 1 1
4 426 1 1 5 TRP CD1 C 4.784 1.426 4.349 1.00 . A A . 9 TRP CD1 1 1
4 427 1 1 5 TRP CD2 C 2.588 1.556 4.097 1.00 . A A . 9 TRP CD2 1 1
4 428 1 1 5 TRP CE2 C 3.017 2.630 4.908 1.00 . A A . 9 TRP CE2 1 1
4 429 1 1 5 TRP CE3 C 1.249 1.464 3.671 1.00 . A A . 9 TRP CE3 1 1
4 430 1 1 5 TRP CG C 3.679 0.800 3.742 1.00 . A A . 9 TRP CG 1 1
4 431 1 1 5 TRP CH2 C 0.758 3.512 4.882 1.00 . A A . 9 TRP CH2 1 1
4 432 1 1 5 TRP CZ2 C 2.086 3.626 5.304 1.00 . A A . 9 TRP CZ2 1 1
4 433 1 1 5 TRP CZ3 C 0.350 2.444 4.072 1.00 . A A . 9 TRP CZ3 1 1
4 434 1 1 5 TRP H H 2.213 1.318 1.574 1.00 . A A . 9 TRP H 1 1
4 435 1 1 5 TRP HA H 4.906 0.462 1.165 1.00 . A A . 9 TRP HA 1 1
4 436 1 1 5 TRP HB2 H 2.699 -0.902 2.808 1.00 . A A . 9 TRP HB2 1 1
4 437 1 1 5 TRP HB3 H 4.377 -1.114 3.054 1.00 . A A . 9 TRP HB3 1 1
4 438 1 1 5 TRP HD1 H 5.807 1.107 4.204 1.00 . A A . 9 TRP HD1 1 1
4 439 1 1 5 TRP HE1 H 4.983 3.156 5.692 1.00 . A A . 9 TRP HE1 1 1
4 440 1 1 5 TRP HE3 H 0.968 0.670 2.996 1.00 . A A . 9 TRP HE3 1 1
4 441 1 1 5 TRP HH2 H 0.035 4.259 5.179 1.00 . A A . 9 TRP HH2 1 1
4 442 1 1 5 TRP HZ2 H 2.393 4.467 5.905 1.00 . A A . 9 TRP HZ2 1 1
4 443 1 1 5 TRP HZ3 H -0.668 2.355 3.725 1.00 . A A . 9 TRP HZ3 1 1
4 444 1 1 5 TRP N N 2.893 1.003 0.878 1.00 . A A . 9 TRP N 1 1
4 445 1 1 5 TRP NE1 N 4.393 2.568 5.090 1.00 . A A . 9 TRP NE1 1 1
4 446 1 1 5 TRP O O 5.017 -1.958 0.275 1.00 . A A . 9 TRP O 1 1
4 447 1 1 6 ASP C C 3.625 -2.630 -2.578 1.00 . A A . 10 ASP C 1 1
4 448 1 1 6 ASP CA C 2.801 -2.839 -1.260 1.00 . A A . 10 ASP CA 1 1
4 449 1 1 6 ASP CB C 1.317 -3.158 -1.608 1.00 . A A . 10 ASP CB 1 1
4 450 1 1 6 ASP CG C 0.340 -3.529 -0.482 1.00 . A A . 10 ASP CG 1 1
4 451 1 1 6 ASP H H 2.066 -1.056 -0.165 1.00 . A A . 10 ASP H 1 1
4 452 1 1 6 ASP HA H 3.245 -3.734 -0.784 1.00 . A A . 10 ASP HA 1 1
4 453 1 1 6 ASP HB2 H 0.880 -2.292 -2.143 1.00 . A A . 10 ASP HB2 1 1
4 454 1 1 6 ASP HB3 H 1.279 -3.978 -2.350 1.00 . A A . 10 ASP HB3 1 1
4 455 1 1 6 ASP N N 2.841 -1.725 -0.269 1.00 . A A . 10 ASP N 1 1
4 456 1 1 6 ASP O O 4.176 -3.578 -3.128 1.00 . A A . 10 ASP O 1 1
4 457 1 1 6 ASP OD1 O -0.674 -2.855 -0.305 1.00 . A A . 10 ASP OD1 1 1
4 458 1 1 7 NH2 HN1 H 4.388 -1.459 -3.944 1.00 . A A . 11 NH2 HN1 1 1
4 459 1 1 7 NH2 HN2 H 3.444 -0.637 -2.595 1.00 . A A . 11 NH2 HN2 1 1
4 460 1 1 7 NH2 N N 3.738 -1.447 -3.156 1.00 . A A . 11 NH2 N 1 1
5 461 1 1 1 AC5 C C -0.921 -4.461 2.411 1.00 . A A . 5 AC5 C 1 1
5 462 1 1 1 AC5 CA C -0.253 -5.327 1.254 1.00 . A A . 5 AC5 CA 1 1
5 463 1 1 1 AC5 CB1 C -1.314 -6.124 0.443 1.00 . A A . 5 AC5 CB1 1 1
5 464 1 1 1 AC5 CB2 C 0.589 -6.462 1.910 1.00 . A A . 5 AC5 CB2 1 1
5 465 1 1 1 AC5 CG1 C -1.213 -7.601 0.841 1.00 . A A . 5 AC5 CG1 1 1
5 466 1 1 1 AC5 CG2 C 0.266 -7.768 1.172 1.00 . A A . 5 AC5 CG2 1 1
5 467 1 1 1 AC5 HB11 H -1.144 -6.026 -0.645 1.00 . A A . 5 AC5 HB11 1 1
5 468 1 1 1 AC5 HB12 H -2.328 -5.717 0.602 1.00 . A A . 5 AC5 HB12 1 1
5 469 1 1 1 AC5 HB21 H 0.308 -6.600 2.975 1.00 . A A . 5 AC5 HB21 1 1
5 470 1 1 1 AC5 HB22 H 1.675 -6.249 1.946 1.00 . A A . 5 AC5 HB22 1 1
5 471 1 1 1 AC5 HG11 H -1.839 -7.805 1.732 1.00 . A A . 5 AC5 HG11 1 1
5 472 1 1 1 AC5 HG12 H -1.554 -8.286 0.042 1.00 . A A . 5 AC5 HG12 1 1
5 473 1 1 1 AC5 HG21 H 0.870 -7.860 0.247 1.00 . A A . 5 AC5 HG21 1 1
5 474 1 1 1 AC5 HG22 H 0.468 -8.668 1.785 1.00 . A A . 5 AC5 HG22 1 1
5 475 1 1 1 AC5 N N 0.666 -4.651 0.260 1.00 . A A . 5 AC5 N 1 1
5 476 1 1 1 AC5 O O -1.926 -4.847 3.017 1.00 . A A . 5 AC5 O 1 1
5 477 1 1 2 HIS C C -1.333 -0.941 3.120 1.00 . A A . 6 HIS C 1 1
5 478 1 1 2 HIS CA C -0.845 -2.320 3.707 1.00 . A A . 6 HIS CA 1 1
5 479 1 1 2 HIS CB C 0.283 -2.173 4.772 1.00 . A A . 6 HIS CB 1 1
5 480 1 1 2 HIS CD2 C -0.539 -2.587 7.183 1.00 . A A . 6 HIS CD2 1 1
5 481 1 1 2 HIS CE1 C -0.636 -0.613 7.879 1.00 . A A . 6 HIS CE1 1 1
5 482 1 1 2 HIS CG C -0.166 -1.719 6.152 1.00 . A A . 6 HIS CG 1 1
5 483 1 1 2 HIS H H 0.364 -3.132 1.977 1.00 . A A . 6 HIS H 1 1
5 484 1 1 2 HIS HA H -1.743 -2.734 4.202 1.00 . A A . 6 HIS HA 1 1
5 485 1 1 2 HIS HB2 H 0.820 -3.131 4.916 1.00 . A A . 6 HIS HB2 1 1
5 486 1 1 2 HIS HB3 H 1.066 -1.490 4.412 1.00 . A A . 6 HIS HB3 1 1
5 487 1 1 2 HIS HD1 H -0.081 0.451 6.059 1.00 . A A . 6 HIS HD1 1 1
5 488 1 1 2 HIS HD2 H -0.551 -3.661 7.071 1.00 . A A . 6 HIS HD2 1 1
5 489 1 1 2 HIS HE1 H -0.820 0.231 8.530 1.00 . A A . 6 HIS HE1 1 1
5 490 1 1 2 HIS N N -0.315 -3.314 2.723 1.00 . A A . 6 HIS N 1 1
5 491 1 1 2 HIS ND1 N -0.199 -0.416 6.595 1.00 . A A . 6 HIS ND1 1 1
5 492 1 1 2 HIS NE2 N -0.861 -1.888 8.338 1.00 . A A . 6 HIS NE2 1 1
5 493 1 1 2 HIS O O -1.777 -0.077 3.880 1.00 . A A . 6 HIS O 1 1
5 494 1 1 3 . C C -0.309 0.940 0.191 1.00 . A A . 7 DPN C 1 1
5 495 1 1 3 . CA C -1.493 0.612 1.158 1.00 . A A . 7 DPN CA 1 1
5 496 1 1 3 . CB C -2.874 0.584 0.458 1.00 . A A . 7 DPN CB 1 1
5 497 1 1 3 . CD1 C -3.178 2.359 -1.348 1.00 . A A . 7 DPN CD1 1 1
5 498 1 1 3 . CD2 C -4.008 2.827 0.873 1.00 . A A . 7 DPN CD2 1 1
5 499 1 1 3 . CE1 C -3.604 3.617 -1.771 1.00 . A A . 7 DPN CE1 1 1
5 500 1 1 3 . CE2 C -4.434 4.084 0.448 1.00 . A A . 7 DPN CE2 1 1
5 501 1 1 3 . CG C -3.375 1.957 -0.022 1.00 . A A . 7 DPN CG 1 1
5 502 1 1 3 . CZ C -4.231 4.478 -0.873 1.00 . A A . 7 DPN CZ 1 1
5 503 1 1 3 . H H -0.986 -1.547 1.258 1.00 . A A . 7 DPN H 1 1
5 504 1 1 3 . HA H -1.537 1.395 1.946 1.00 . A A . 7 DPN HA 1 1
5 505 1 1 3 . HB2 H -2.833 -0.130 -0.384 1.00 . A A . 7 DPN HB2 1 1
5 506 1 1 3 . HB3 H -3.633 0.152 1.141 1.00 . A A . 7 DPN HB3 1 1
5 507 1 1 3 . HD1 H -2.685 1.703 -2.051 1.00 . A A . 7 DPN HD1 1 1
5 508 1 1 3 . HD2 H -4.170 2.532 1.901 1.00 . A A . 7 DPN HD2 1 1
5 509 1 1 3 . HE1 H -3.447 3.923 -2.794 1.00 . A A . 7 DPN HE1 1 1
5 510 1 1 3 . HE2 H -4.924 4.753 1.141 1.00 . A A . 7 DPN HE2 1 1
5 511 1 1 3 . HZ H -4.563 5.452 -1.204 1.00 . A A . 7 DPN HZ 1 1
5 512 1 1 3 . N N -1.246 -0.709 1.798 1.00 . A A . 7 DPN N 1 1
5 513 1 1 3 . O O 0.127 0.107 -0.612 1.00 . A A . 7 DPN O 1 1
5 514 1 1 4 ARG C C 2.787 1.612 -0.225 1.00 . A A . 8 ARG C 1 1
5 515 1 1 4 ARG CA C 1.532 2.548 -0.374 1.00 . A A . 8 ARG CA 1 1
5 516 1 1 4 ARG CB C 1.850 4.029 -0.019 1.00 . A A . 8 ARG CB 1 1
5 517 1 1 4 ARG CD C 2.693 5.765 1.707 1.00 . A A . 8 ARG CD 1 1
5 518 1 1 4 ARG CG C 2.182 4.332 1.466 1.00 . A A . 8 ARG CG 1 1
5 519 1 1 4 ARG CZ C 4.107 5.653 3.788 1.00 . A A . 8 ARG CZ 1 1
5 520 1 1 4 ARG H H -0.288 2.805 0.887 1.00 . A A . 8 ARG H 1 1
5 521 1 1 4 ARG HA H 1.316 2.521 -1.452 1.00 . A A . 8 ARG HA 1 1
5 522 1 1 4 ARG HB2 H 2.691 4.361 -0.659 1.00 . A A . 8 ARG HB2 1 1
5 523 1 1 4 ARG HB3 H 0.999 4.662 -0.332 1.00 . A A . 8 ARG HB3 1 1
5 524 1 1 4 ARG HD2 H 3.572 5.994 1.068 1.00 . A A . 8 ARG HD2 1 1
5 525 1 1 4 ARG HD3 H 1.921 6.488 1.373 1.00 . A A . 8 ARG HD3 1 1
5 526 1 1 4 ARG HE H 2.310 6.495 3.744 1.00 . A A . 8 ARG HE 1 1
5 527 1 1 4 ARG HG2 H 1.283 4.145 2.085 1.00 . A A . 8 ARG HG2 1 1
5 528 1 1 4 ARG HG3 H 2.934 3.609 1.831 1.00 . A A . 8 ARG HG3 1 1
5 529 1 1 4 ARG HH11 H 4.917 4.759 2.244 1.00 . A A . 8 ARG HH11 1 1
5 530 1 1 4 ARG HH12 H 5.904 4.747 3.784 1.00 . A A . 8 ARG HH12 1 1
5 531 1 1 4 ARG HH21 H 3.463 6.502 5.464 1.00 . A A . 8 ARG HH21 1 1
5 532 1 1 4 ARG HH22 H 5.101 5.710 5.506 1.00 . A A . 8 ARG HH22 1 1
5 533 1 1 4 ARG N N 0.257 2.153 0.316 1.00 . A A . 8 ARG N 1 1
5 534 1 1 4 ARG NE N 2.986 6.002 3.151 1.00 . A A . 8 ARG NE 1 1
5 535 1 1 4 ARG NH1 N 5.089 4.996 3.223 1.00 . A A . 8 ARG NH1 1 1
5 536 1 1 4 ARG NH2 N 4.233 5.980 5.042 1.00 . A A . 8 ARG NH2 1 1
5 537 1 1 4 ARG O O 3.554 1.407 -1.167 1.00 . A A . 8 ARG O 1 1
5 538 1 1 5 TRP C C 3.937 -1.315 0.358 1.00 . A A . 9 TRP C 1 1
5 539 1 1 5 TRP CA C 3.881 -0.069 1.308 1.00 . A A . 9 TRP CA 1 1
5 540 1 1 5 TRP CB C 3.511 -0.530 2.747 1.00 . A A . 9 TRP CB 1 1
5 541 1 1 5 TRP CD1 C 4.708 0.869 4.667 1.00 . A A . 9 TRP CD1 1 1
5 542 1 1 5 TRP CD2 C 2.576 1.325 4.289 1.00 . A A . 9 TRP CD2 1 1
5 543 1 1 5 TRP CE2 C 3.041 2.154 5.331 1.00 . A A . 9 TRP CE2 1 1
5 544 1 1 5 TRP CE3 C 1.261 1.435 3.807 1.00 . A A . 9 TRP CE3 1 1
5 545 1 1 5 TRP CG C 3.602 0.514 3.875 1.00 . A A . 9 TRP CG 1 1
5 546 1 1 5 TRP CH2 C 0.855 3.203 5.422 1.00 . A A . 9 TRP CH2 1 1
5 547 1 1 5 TRP CZ2 C 2.162 3.103 5.916 1.00 . A A . 9 TRP CZ2 1 1
5 548 1 1 5 TRP CZ3 C 0.417 2.380 4.375 1.00 . A A . 9 TRP CZ3 1 1
5 549 1 1 5 TRP H H 2.166 1.279 1.596 1.00 . A A . 9 TRP H 1 1
5 550 1 1 5 TRP HA H 4.895 0.365 1.358 1.00 . A A . 9 TRP HA 1 1
5 551 1 1 5 TRP HB2 H 2.496 -0.970 2.732 1.00 . A A . 9 TRP HB2 1 1
5 552 1 1 5 TRP HB3 H 4.128 -1.382 3.038 1.00 . A A . 9 TRP HB3 1 1
5 553 1 1 5 TRP HD1 H 5.685 0.417 4.563 1.00 . A A . 9 TRP HD1 1 1
5 554 1 1 5 TRP HE1 H 4.952 2.251 6.362 1.00 . A A . 9 TRP HE1 1 1
5 555 1 1 5 TRP HE3 H 0.947 0.791 3.000 1.00 . A A . 9 TRP HE3 1 1
5 556 1 1 5 TRP HH2 H 0.172 3.920 5.852 1.00 . A A . 9 TRP HH2 1 1
5 557 1 1 5 TRP HZ2 H 2.500 3.739 6.722 1.00 . A A . 9 TRP HZ2 1 1
5 558 1 1 5 TRP HZ3 H -0.583 2.447 3.978 1.00 . A A . 9 TRP HZ3 1 1
5 559 1 1 5 TRP N N 2.929 1.024 0.965 1.00 . A A . 9 TRP N 1 1
5 560 1 1 5 TRP NE1 N 4.379 1.891 5.590 1.00 . A A . 9 TRP NE1 1 1
5 561 1 1 5 TRP O O 5.004 -1.918 0.217 1.00 . A A . 9 TRP O 1 1
5 562 1 1 6 ASP C C 3.571 -2.588 -2.607 1.00 . A A . 10 ASP C 1 1
5 563 1 1 6 ASP CA C 2.775 -2.814 -1.276 1.00 . A A . 10 ASP CA 1 1
5 564 1 1 6 ASP CB C 1.291 -3.163 -1.598 1.00 . A A . 10 ASP CB 1 1
5 565 1 1 6 ASP CG C 0.346 -3.560 -0.452 1.00 . A A . 10 ASP CG 1 1
5 566 1 1 6 ASP H H 2.009 -1.086 -0.125 1.00 . A A . 10 ASP H 1 1
5 567 1 1 6 ASP HA H 3.244 -3.706 -0.815 1.00 . A A . 10 ASP HA 1 1
5 568 1 1 6 ASP HB2 H 0.827 -2.302 -2.120 1.00 . A A . 10 ASP HB2 1 1
5 569 1 1 6 ASP HB3 H 1.255 -3.979 -2.346 1.00 . A A . 10 ASP HB3 1 1
5 570 1 1 6 ASP N N 2.814 -1.707 -0.277 1.00 . A A . 10 ASP N 1 1
5 571 1 1 6 ASP O O 4.092 -3.532 -3.194 1.00 . A A . 10 ASP O 1 1
5 572 1 1 6 ASP OD1 O -0.660 -2.890 -0.230 1.00 . A A . 10 ASP OD1 1 1
5 573 1 1 7 NH2 HN1 H 4.330 -1.399 -3.960 1.00 . A A . 11 NH2 HN1 1 1
5 574 1 1 7 NH2 HN2 H 3.439 -0.596 -2.567 1.00 . A A . 11 NH2 HN2 1 1
5 575 1 1 7 NH2 N N 3.695 -1.393 -3.159 1.00 . A A . 11 NH2 N 1 1
6 576 1 1 1 AC5 C C -1.010 -4.429 2.335 1.00 . A A . 5 AC5 C 1 1
6 577 1 1 1 AC5 CA C -0.299 -5.289 1.198 1.00 . A A . 5 AC5 CA 1 1
6 578 1 1 1 AC5 CB1 C -1.340 -6.058 0.340 1.00 . A A . 5 AC5 CB1 1 1
6 579 1 1 1 AC5 CB2 C 0.509 -6.450 1.859 1.00 . A A . 5 AC5 CB2 1 1
6 580 1 1 1 AC5 CG1 C -1.353 -7.517 0.805 1.00 . A A . 5 AC5 CG1 1 1
6 581 1 1 1 AC5 CG2 C 0.107 -7.761 1.169 1.00 . A A . 5 AC5 CG2 1 1
6 582 1 1 1 AC5 HB11 H -1.078 -6.018 -0.733 1.00 . A A . 5 AC5 HB11 1 1
6 583 1 1 1 AC5 HB12 H -2.335 -5.583 0.402 1.00 . A A . 5 AC5 HB12 1 1
6 584 1 1 1 AC5 HB21 H 0.259 -6.545 2.936 1.00 . A A . 5 AC5 HB21 1 1
6 585 1 1 1 AC5 HB22 H 1.606 -6.300 1.851 1.00 . A A . 5 AC5 HB22 1 1
6 586 1 1 1 AC5 HG11 H -2.005 -7.639 1.691 1.00 . A A . 5 AC5 HG11 1 1
6 587 1 1 1 AC5 HG12 H -1.723 -8.213 0.026 1.00 . A A . 5 AC5 HG12 1 1
6 588 1 1 1 AC5 HG21 H 0.717 -7.928 0.259 1.00 . A A . 5 AC5 HG21 1 1
6 589 1 1 1 AC5 HG22 H 0.242 -8.647 1.819 1.00 . A A . 5 AC5 HG22 1 1
6 590 1 1 1 AC5 N N 0.655 -4.605 0.246 1.00 . A A . 5 AC5 N 1 1
6 591 1 1 1 AC5 O O -2.068 -4.789 2.863 1.00 . A A . 5 AC5 O 1 1
6 592 1 1 2 HIS C C -1.452 -0.941 3.034 1.00 . A A . 6 HIS C 1 1
6 593 1 1 2 HIS CA C -0.969 -2.304 3.653 1.00 . A A . 6 HIS CA 1 1
6 594 1 1 2 HIS CB C 0.122 -2.069 4.735 1.00 . A A . 6 HIS CB 1 1
6 595 1 1 2 HIS CD2 C 1.424 -4.065 5.766 1.00 . A A . 6 HIS CD2 1 1
6 596 1 1 2 HIS CE1 C 0.105 -4.589 7.308 1.00 . A A . 6 HIS CE1 1 1
6 597 1 1 2 HIS CG C 0.325 -3.199 5.740 1.00 . A A . 6 HIS CG 1 1
6 598 1 1 2 HIS H H 0.379 -3.132 2.068 1.00 . A A . 6 HIS H 1 1
6 599 1 1 2 HIS HA H -1.871 -2.708 4.146 1.00 . A A . 6 HIS HA 1 1
6 600 1 1 2 HIS HB2 H 1.086 -1.808 4.259 1.00 . A A . 6 HIS HB2 1 1
6 601 1 1 2 HIS HB3 H -0.121 -1.168 5.309 1.00 . A A . 6 HIS HB3 1 1
6 602 1 1 2 HIS HD1 H -1.455 -3.102 6.999 1.00 . A A . 6 HIS HD1 1 1
6 603 1 1 2 HIS HD2 H 2.246 -4.007 5.071 1.00 . A A . 6 HIS HD2 1 1
6 604 1 1 2 HIS HE1 H -0.319 -5.117 8.151 1.00 . A A . 6 HIS HE1 1 1
6 605 1 1 2 HIS N N -0.395 -3.308 2.708 1.00 . A A . 6 HIS N 1 1
6 606 1 1 2 HIS ND1 N -0.552 -3.519 6.756 1.00 . A A . 6 HIS ND1 1 1
6 607 1 1 2 HIS NE2 N 1.309 -4.998 6.789 1.00 . A A . 6 HIS NE2 1 1
6 608 1 1 2 HIS O O -1.938 -0.086 3.779 1.00 . A A . 6 HIS O 1 1
6 609 1 1 3 . C C -0.317 0.955 0.159 1.00 . A A . 7 DPN C 1 1
6 610 1 1 3 . CA C -1.540 0.613 1.073 1.00 . A A . 7 DPN CA 1 1
6 611 1 1 3 . CB C -2.886 0.569 0.307 1.00 . A A . 7 DPN CB 1 1
6 612 1 1 3 . CD1 C -3.120 2.333 -1.519 1.00 . A A . 7 DPN CD1 1 1
6 613 1 1 3 . CD2 C -4.063 2.801 0.656 1.00 . A A . 7 DPN CD2 1 1
6 614 1 1 3 . CE1 C -3.541 3.583 -1.968 1.00 . A A . 7 DPN CE1 1 1
6 615 1 1 3 . CE2 C -4.484 4.051 0.204 1.00 . A A . 7 DPN CE2 1 1
6 616 1 1 3 . CG C -3.377 1.935 -0.202 1.00 . A A . 7 DPN CG 1 1
6 617 1 1 3 . CZ C -4.221 4.441 -1.107 1.00 . A A . 7 DPN CZ 1 1
6 618 1 1 3 . H H -1.028 -1.545 1.186 1.00 . A A . 7 DPN H 1 1
6 619 1 1 3 . HA H -1.630 1.394 1.856 1.00 . A A . 7 DPN HA 1 1
6 620 1 1 3 . HB2 H -2.796 -0.147 -0.528 1.00 . A A . 7 DPN HB2 1 1
6 621 1 1 3 . HB3 H -3.673 0.132 0.954 1.00 . A A . 7 DPN HB3 1 1
6 622 1 1 3 . HD1 H -2.587 1.679 -2.194 1.00 . A A . 7 DPN HD1 1 1
6 623 1 1 3 . HD2 H -4.271 2.510 1.676 1.00 . A A . 7 DPN HD2 1 1
6 624 1 1 3 . HE1 H -3.339 3.887 -2.985 1.00 . A A . 7 DPN HE1 1 1
6 625 1 1 3 . HE2 H -5.014 4.717 0.869 1.00 . A A . 7 DPN HE2 1 1
6 626 1 1 3 . HZ H -4.549 5.409 -1.458 1.00 . A A . 7 DPN HZ 1 1
6 627 1 1 3 . N N -1.307 -0.708 1.718 1.00 . A A . 7 DPN N 1 1
6 628 1 1 3 . O O 0.132 0.142 -0.657 1.00 . A A . 7 DPN O 1 1
6 629 1 1 4 ARG C C 2.792 1.652 -0.202 1.00 . A A . 8 ARG C 1 1
6 630 1 1 4 ARG CA C 1.529 2.575 -0.342 1.00 . A A . 8 ARG CA 1 1
6 631 1 1 4 ARG CB C 1.828 4.054 0.027 1.00 . A A . 8 ARG CB 1 1
6 632 1 1 4 ARG CD C 2.579 5.815 1.807 1.00 . A A . 8 ARG CD 1 1
6 633 1 1 4 ARG CG C 2.199 4.352 1.507 1.00 . A A . 8 ARG CG 1 1
6 634 1 1 4 ARG CZ C 4.556 7.300 1.377 1.00 . A A . 8 ARG CZ 1 1
6 635 1 1 4 ARG H H -0.293 2.793 0.923 1.00 . A A . 8 ARG H 1 1
6 636 1 1 4 ARG HA H 1.318 2.556 -1.420 1.00 . A A . 8 ARG HA 1 1
6 637 1 1 4 ARG HB2 H 2.644 4.410 -0.631 1.00 . A A . 8 ARG HB2 1 1
6 638 1 1 4 ARG HB3 H 0.958 4.675 -0.258 1.00 . A A . 8 ARG HB3 1 1
6 639 1 1 4 ARG HD2 H 1.813 6.498 1.386 1.00 . A A . 8 ARG HD2 1 1
6 640 1 1 4 ARG HD3 H 2.557 5.966 2.907 1.00 . A A . 8 ARG HD3 1 1
6 641 1 1 4 ARG HE H 4.478 5.400 0.795 1.00 . A A . 8 ARG HE 1 1
6 642 1 1 4 ARG HG2 H 1.331 4.082 2.139 1.00 . A A . 8 ARG HG2 1 1
6 643 1 1 4 ARG HG3 H 3.007 3.676 1.851 1.00 . A A . 8 ARG HG3 1 1
6 644 1 1 4 ARG HH11 H 6.209 8.323 0.951 1.00 . A A . 8 ARG HH11 1 1
6 645 1 1 4 ARG HH12 H 6.141 6.585 0.414 1.00 . A A . 8 ARG HH12 1 1
6 646 1 1 4 ARG HH21 H 4.574 9.213 1.996 1.00 . A A . 8 ARG HH21 1 1
6 647 1 1 4 ARG HH22 H 3.098 8.191 2.342 1.00 . A A . 8 ARG HH22 1 1
6 648 1 1 4 ARG N N 0.253 2.159 0.335 1.00 . A A . 8 ARG N 1 1
6 649 1 1 4 ARG NE N 3.938 6.124 1.277 1.00 . A A . 8 ARG NE 1 1
6 650 1 1 4 ARG NH1 N 5.748 7.415 0.866 1.00 . A A . 8 ARG NH1 1 1
6 651 1 1 4 ARG NH2 N 4.031 8.349 1.963 1.00 . A A . 8 ARG NH2 1 1
6 652 1 1 4 ARG O O 3.588 1.506 -1.131 1.00 . A A . 8 ARG O 1 1
6 653 1 1 5 TRP C C 3.970 -1.295 0.336 1.00 . A A . 9 TRP C 1 1
6 654 1 1 5 TRP CA C 3.909 -0.049 1.285 1.00 . A A . 9 TRP CA 1 1
6 655 1 1 5 TRP CB C 3.607 -0.515 2.738 1.00 . A A . 9 TRP CB 1 1
6 656 1 1 5 TRP CD1 C 4.792 1.055 4.528 1.00 . A A . 9 TRP CD1 1 1
6 657 1 1 5 TRP CD2 C 2.609 1.318 4.262 1.00 . A A . 9 TRP CD2 1 1
6 658 1 1 5 TRP CE2 C 3.074 2.281 5.182 1.00 . A A . 9 TRP CE2 1 1
6 659 1 1 5 TRP CE3 C 1.273 1.327 3.819 1.00 . A A . 9 TRP CE3 1 1
6 660 1 1 5 TRP CG C 3.668 0.550 3.846 1.00 . A A . 9 TRP CG 1 1
6 661 1 1 5 TRP CH2 C 0.857 3.259 5.233 1.00 . A A . 9 TRP CH2 1 1
6 662 1 1 5 TRP CZ2 C 2.186 3.270 5.676 1.00 . A A . 9 TRP CZ2 1 1
6 663 1 1 5 TRP CZ3 C 0.413 2.301 4.311 1.00 . A A . 9 TRP CZ3 1 1
6 664 1 1 5 TRP H H 2.154 1.248 1.603 1.00 . A A . 9 TRP H 1 1
6 665 1 1 5 TRP HA H 4.911 0.415 1.294 1.00 . A A . 9 TRP HA 1 1
6 666 1 1 5 TRP HB2 H 2.616 -1.011 2.757 1.00 . A A . 9 TRP HB2 1 1
6 667 1 1 5 TRP HB3 H 4.278 -1.326 3.019 1.00 . A A . 9 TRP HB3 1 1
6 668 1 1 5 TRP HD1 H 5.802 0.706 4.361 1.00 . A A . 9 TRP HD1 1 1
6 669 1 1 5 TRP HE1 H 5.057 2.699 5.972 1.00 . A A . 9 TRP HE1 1 1
6 670 1 1 5 TRP HE3 H 0.968 0.612 3.072 1.00 . A A . 9 TRP HE3 1 1
6 671 1 1 5 TRP HH2 H 0.166 4.007 5.596 1.00 . A A . 9 TRP HH2 1 1
6 672 1 1 5 TRP HZ2 H 2.532 4.025 6.367 1.00 . A A . 9 TRP HZ2 1 1
6 673 1 1 5 TRP HZ3 H -0.599 2.296 3.938 1.00 . A A . 9 TRP HZ3 1 1
6 674 1 1 5 TRP N N 2.916 1.014 0.962 1.00 . A A . 9 TRP N 1 1
6 675 1 1 5 TRP NE1 N 4.442 2.131 5.376 1.00 . A A . 9 TRP NE1 1 1
6 676 1 1 5 TRP O O 5.038 -1.894 0.193 1.00 . A A . 9 TRP O 1 1
6 677 1 1 6 ASP C C 3.614 -2.606 -2.610 1.00 . A A . 10 ASP C 1 1
6 678 1 1 6 ASP CA C 2.802 -2.807 -1.285 1.00 . A A . 10 ASP CA 1 1
6 679 1 1 6 ASP CB C 1.316 -3.134 -1.615 1.00 . A A . 10 ASP CB 1 1
6 680 1 1 6 ASP CG C 0.354 -3.515 -0.478 1.00 . A A . 10 ASP CG 1 1
6 681 1 1 6 ASP H H 2.042 -1.071 -0.134 1.00 . A A . 10 ASP H 1 1
6 682 1 1 6 ASP HA H 3.252 -3.700 -0.809 1.00 . A A . 10 ASP HA 1 1
6 683 1 1 6 ASP HB2 H 0.867 -2.269 -2.142 1.00 . A A . 10 ASP HB2 1 1
6 684 1 1 6 ASP HB3 H 1.273 -3.951 -2.359 1.00 . A A . 10 ASP HB3 1 1
6 685 1 1 6 ASP N N 2.846 -1.689 -0.296 1.00 . A A . 10 ASP N 1 1
6 686 1 1 6 ASP O O 4.149 -3.560 -3.166 1.00 . A A . 10 ASP O 1 1
6 687 1 1 6 ASP OD1 O -0.657 -2.844 -0.280 1.00 . A A . 10 ASP OD1 1 1
6 688 1 1 7 NH2 HN1 H 4.380 -1.443 -3.981 1.00 . A A . 11 NH2 HN1 1 1
6 689 1 1 7 NH2 HN2 H 3.455 -0.617 -2.620 1.00 . A A . 11 NH2 HN2 1 1
6 690 1 1 7 NH2 N N 3.733 -1.425 -3.188 1.00 . A A . 11 NH2 N 1 1
7 691 1 1 1 AC5 C C -1.143 -4.475 1.898 1.00 . A A . 5 AC5 C 1 1
7 692 1 1 1 AC5 CA C -0.023 -5.317 1.148 1.00 . A A . 5 AC5 CA 1 1
7 693 1 1 1 AC5 CB1 C -0.572 -6.613 0.534 1.00 . A A . 5 AC5 CB1 1 1
7 694 1 1 1 AC5 CB2 C 0.991 -5.934 2.156 1.00 . A A . 5 AC5 CB2 1 1
7 695 1 1 1 AC5 CG1 C 0.548 -7.664 0.476 1.00 . A A . 5 AC5 CG1 1 1
7 696 1 1 1 AC5 CG2 C 1.483 -7.298 1.631 1.00 . A A . 5 AC5 CG2 1 1
7 697 1 1 1 AC5 HB11 H -1.027 -6.393 -0.445 1.00 . A A . 5 AC5 HB11 1 1
7 698 1 1 1 AC5 HB12 H -1.376 -6.989 1.185 1.00 . A A . 5 AC5 HB12 1 1
7 699 1 1 1 AC5 HB21 H 0.494 -6.104 3.131 1.00 . A A . 5 AC5 HB21 1 1
7 700 1 1 1 AC5 HB22 H 1.831 -5.250 2.394 1.00 . A A . 5 AC5 HB22 1 1
7 701 1 1 1 AC5 HG11 H 0.156 -8.698 0.555 1.00 . A A . 5 AC5 HG11 1 1
7 702 1 1 1 AC5 HG12 H 1.084 -7.602 -0.490 1.00 . A A . 5 AC5 HG12 1 1
7 703 1 1 1 AC5 HG21 H 2.532 -7.241 1.282 1.00 . A A . 5 AC5 HG21 1 1
7 704 1 1 1 AC5 HG22 H 1.461 -8.066 2.429 1.00 . A A . 5 AC5 HG22 1 1
7 705 1 1 1 AC5 N N 0.802 -4.615 0.103 1.00 . A A . 5 AC5 N 1 1
7 706 1 1 1 AC5 O O -2.317 -4.836 2.008 1.00 . A A . 5 AC5 O 1 1
7 707 1 1 2 HIS C C -1.463 -0.957 3.042 1.00 . A A . 6 HIS C 1 1
7 708 1 1 2 HIS CA C -1.470 -2.488 3.375 1.00 . A A . 6 HIS CA 1 1
7 709 1 1 2 HIS CB C -1.007 -2.856 4.811 1.00 . A A . 6 HIS CB 1 1
7 710 1 1 2 HIS CD2 C 1.148 -1.648 5.597 1.00 . A A . 6 HIS CD2 1 1
7 711 1 1 2 HIS CE1 C 2.466 -3.269 5.689 1.00 . A A . 6 HIS CE1 1 1
7 712 1 1 2 HIS CG C 0.477 -2.794 5.185 1.00 . A A . 6 HIS CG 1 1
7 713 1 1 2 HIS H H 0.319 -3.340 2.348 1.00 . A A . 6 HIS H 1 1
7 714 1 1 2 HIS HA H -2.545 -2.753 3.322 1.00 . A A . 6 HIS HA 1 1
7 715 1 1 2 HIS HB2 H -1.564 -2.205 5.495 1.00 . A A . 6 HIS HB2 1 1
7 716 1 1 2 HIS HB3 H -1.367 -3.869 5.026 1.00 . A A . 6 HIS HB3 1 1
7 717 1 1 2 HIS HD1 H 1.117 -4.878 5.126 1.00 . A A . 6 HIS HD1 1 1
7 718 1 1 2 HIS HD2 H 0.666 -0.689 5.646 1.00 . A A . 6 HIS HD2 1 1
7 719 1 1 2 HIS HE1 H 3.359 -3.849 5.886 1.00 . A A . 6 HIS HE1 1 1
7 720 1 1 2 HIS N N -0.694 -3.348 2.442 1.00 . A A . 6 HIS N 1 1
7 721 1 1 2 HIS ND1 N 1.327 -3.881 5.233 1.00 . A A . 6 HIS ND1 1 1
7 722 1 1 2 HIS NE2 N 2.466 -1.920 5.934 1.00 . A A . 6 HIS NE2 1 1
7 723 1 1 2 HIS O O -1.448 -0.109 3.939 1.00 . A A . 6 HIS O 1 1
7 724 1 1 3 . C C -0.362 1.014 0.247 1.00 . A A . 7 DPN C 1 1
7 725 1 1 3 . CA C -1.543 0.791 1.249 1.00 . A A . 7 DPN CA 1 1
7 726 1 1 3 . CB C -2.940 1.089 0.639 1.00 . A A . 7 DPN CB 1 1
7 727 1 1 3 . CD1 C -3.576 3.450 1.351 1.00 . A A . 7 DPN CD1 1 1
7 728 1 1 3 . CD2 C -3.024 3.066 -0.969 1.00 . A A . 7 DPN CD2 1 1
7 729 1 1 3 . CE1 C -3.771 4.803 1.080 1.00 . A A . 7 DPN CE1 1 1
7 730 1 1 3 . CE2 C -3.220 4.419 -1.238 1.00 . A A . 7 DPN CE2 1 1
7 731 1 1 3 . CG C -3.199 2.574 0.329 1.00 . A A . 7 DPN CG 1 1
7 732 1 1 3 . CZ C -3.593 5.287 -0.215 1.00 . A A . 7 DPN CZ 1 1
7 733 1 1 3 . H H -1.401 -1.425 1.141 1.00 . A A . 7 DPN H 1 1
7 734 1 1 3 . HA H -1.409 1.483 2.105 1.00 . A A . 7 DPN HA 1 1
7 735 1 1 3 . HB2 H -3.081 0.470 -0.267 1.00 . A A . 7 DPN HB2 1 1
7 736 1 1 3 . HB3 H -3.732 0.736 1.328 1.00 . A A . 7 DPN HB3 1 1
7 737 1 1 3 . HD1 H -3.714 3.089 2.361 1.00 . A A . 7 DPN HD1 1 1
7 738 1 1 3 . HD2 H -2.726 2.405 -1.771 1.00 . A A . 7 DPN HD2 1 1
7 739 1 1 3 . HE1 H -4.065 5.478 1.872 1.00 . A A . 7 DPN HE1 1 1
7 740 1 1 3 . HE2 H -3.083 4.795 -2.242 1.00 . A A . 7 DPN HE2 1 1
7 741 1 1 3 . HZ H -3.748 6.335 -0.424 1.00 . A A . 7 DPN HZ 1 1
7 742 1 1 3 . N N -1.542 -0.611 1.748 1.00 . A A . 7 DPN N 1 1
7 743 1 1 3 . O O -0.025 0.153 -0.573 1.00 . A A . 7 DPN O 1 1
7 744 1 1 4 ARG C C 2.753 1.490 -0.337 1.00 . A A . 8 ARG C 1 1
7 745 1 1 4 ARG CA C 1.551 2.500 -0.411 1.00 . A A . 8 ARG CA 1 1
7 746 1 1 4 ARG CB C 1.968 3.957 -0.058 1.00 . A A . 8 ARG CB 1 1
7 747 1 1 4 ARG CD C 2.894 5.644 1.675 1.00 . A A . 8 ARG CD 1 1
7 748 1 1 4 ARG CG C 2.530 4.186 1.369 1.00 . A A . 8 ARG CG 1 1
7 749 1 1 4 ARG CZ C 3.892 6.798 3.668 1.00 . A A . 8 ARG CZ 1 1
7 750 1 1 4 ARG H H -0.155 2.859 0.972 1.00 . A A . 8 ARG H 1 1
7 751 1 1 4 ARG HA H 1.269 2.495 -1.474 1.00 . A A . 8 ARG HA 1 1
7 752 1 1 4 ARG HB2 H 2.725 4.286 -0.794 1.00 . A A . 8 ARG HB2 1 1
7 753 1 1 4 ARG HB3 H 1.104 4.630 -0.227 1.00 . A A . 8 ARG HB3 1 1
7 754 1 1 4 ARG HD2 H 3.623 6.018 0.925 1.00 . A A . 8 ARG HD2 1 1
7 755 1 1 4 ARG HD3 H 1.990 6.284 1.595 1.00 . A A . 8 ARG HD3 1 1
7 756 1 1 4 ARG HE H 3.588 4.837 3.591 1.00 . A A . 8 ARG HE 1 1
7 757 1 1 4 ARG HG2 H 1.789 3.825 2.108 1.00 . A A . 8 ARG HG2 1 1
7 758 1 1 4 ARG HG3 H 3.423 3.544 1.505 1.00 . A A . 8 ARG HG3 1 1
7 759 1 1 4 ARG HH11 H 4.722 7.529 5.320 1.00 . A A . 8 ARG HH11 1 1
7 760 1 1 4 ARG HH12 H 4.461 5.729 5.238 1.00 . A A . 8 ARG HH12 1 1
7 761 1 1 4 ARG HH21 H 4.171 8.790 3.687 1.00 . A A . 8 ARG HH21 1 1
7 762 1 1 4 ARG HH22 H 3.418 8.020 2.207 1.00 . A A . 8 ARG HH22 1 1
7 763 1 1 4 ARG N N 0.300 2.180 0.357 1.00 . A A . 8 ARG N 1 1
7 764 1 1 4 ARG NE N 3.471 5.697 3.047 1.00 . A A . 8 ARG NE 1 1
7 765 1 1 4 ARG NH1 N 4.401 6.676 4.859 1.00 . A A . 8 ARG NH1 1 1
7 766 1 1 4 ARG NH2 N 3.825 7.998 3.144 1.00 . A A . 8 ARG NH2 1 1
7 767 1 1 4 ARG O O 3.474 1.270 -1.312 1.00 . A A . 8 ARG O 1 1
7 768 1 1 5 TRP C C 3.933 -1.460 0.231 1.00 . A A . 9 TRP C 1 1
7 769 1 1 5 TRP CA C 3.893 -0.195 1.157 1.00 . A A . 9 TRP CA 1 1
7 770 1 1 5 TRP CB C 3.611 -0.606 2.629 1.00 . A A . 9 TRP CB 1 1
7 771 1 1 5 TRP CD1 C 4.960 0.925 4.337 1.00 . A A . 9 TRP CD1 1 1
7 772 1 1 5 TRP CD2 C 2.792 1.327 4.141 1.00 . A A . 9 TRP CD2 1 1
7 773 1 1 5 TRP CE2 C 3.347 2.252 5.052 1.00 . A A . 9 TRP CE2 1 1
7 774 1 1 5 TRP CE3 C 1.429 1.387 3.789 1.00 . A A . 9 TRP CE3 1 1
7 775 1 1 5 TRP CG C 3.785 0.495 3.693 1.00 . A A . 9 TRP CG 1 1
7 776 1 1 5 TRP CH2 C 1.174 3.299 5.269 1.00 . A A . 9 TRP CH2 1 1
7 777 1 1 5 TRP CZ2 C 2.525 3.250 5.634 1.00 . A A . 9 TRP CZ2 1 1
7 778 1 1 5 TRP CZ3 C 0.640 2.380 4.355 1.00 . A A . 9 TRP CZ3 1 1
7 779 1 1 5 TRP H H 2.194 1.162 1.510 1.00 . A A . 9 TRP H 1 1
7 780 1 1 5 TRP HA H 4.900 0.258 1.135 1.00 . A A . 9 TRP HA 1 1
7 781 1 1 5 TRP HB2 H 2.595 -1.041 2.709 1.00 . A A . 9 TRP HB2 1 1
7 782 1 1 5 TRP HB3 H 4.244 -1.447 2.915 1.00 . A A . 9 TRP HB3 1 1
7 783 1 1 5 TRP HD1 H 5.933 0.484 4.168 1.00 . A A . 9 TRP HD1 1 1
7 784 1 1 5 TRP HE1 H 5.363 2.462 5.855 1.00 . A A . 9 TRP HE1 1 1
7 785 1 1 5 TRP HE3 H 1.032 0.655 3.094 1.00 . A A . 9 TRP HE3 1 1
7 786 1 1 5 TRP HH2 H 0.531 4.051 5.704 1.00 . A A . 9 TRP HH2 1 1
7 787 1 1 5 TRP HZ2 H 2.930 3.950 6.348 1.00 . A A . 9 TRP HZ2 1 1
7 788 1 1 5 TRP HZ3 H -0.398 2.414 4.066 1.00 . A A . 9 TRP HZ3 1 1
7 789 1 1 5 TRP N N 2.908 0.874 0.836 1.00 . A A . 9 TRP N 1 1
7 790 1 1 5 TRP NE1 N 4.710 2.024 5.194 1.00 . A A . 9 TRP NE1 1 1
7 791 1 1 5 TRP O O 4.981 -2.098 0.124 1.00 . A A . 9 TRP O 1 1
7 792 1 1 6 ASP C C 3.592 -2.530 -2.816 1.00 . A A . 10 ASP C 1 1
7 793 1 1 6 ASP CA C 2.797 -2.853 -1.505 1.00 . A A . 10 ASP CA 1 1
7 794 1 1 6 ASP CB C 1.318 -3.205 -1.851 1.00 . A A . 10 ASP CB 1 1
7 795 1 1 6 ASP CG C 0.353 -3.687 -0.758 1.00 . A A . 10 ASP CG 1 1
7 796 1 1 6 ASP H H 2.041 -1.148 -0.294 1.00 . A A . 10 ASP H 1 1
7 797 1 1 6 ASP HA H 3.281 -3.763 -1.101 1.00 . A A . 10 ASP HA 1 1
7 798 1 1 6 ASP HB2 H 0.846 -2.321 -2.322 1.00 . A A . 10 ASP HB2 1 1
7 799 1 1 6 ASP HB3 H 1.300 -3.981 -2.637 1.00 . A A . 10 ASP HB3 1 1
7 800 1 1 6 ASP N N 2.818 -1.808 -0.440 1.00 . A A . 10 ASP N 1 1
7 801 1 1 6 ASP O O 4.117 -3.431 -3.465 1.00 . A A . 10 ASP O 1 1
7 802 1 1 6 ASP OD1 O -0.788 -3.228 -0.724 1.00 . A A . 10 ASP OD1 1 1
7 803 1 1 7 NH2 HN1 H 4.345 -1.253 -4.088 1.00 . A A . 11 NH2 HN1 1 1
7 804 1 1 7 NH2 HN2 H 3.461 -0.543 -2.642 1.00 . A A . 11 NH2 HN2 1 1
7 805 1 1 7 NH2 N N 3.714 -1.302 -3.286 1.00 . A A . 11 NH2 N 1 1
8 806 1 1 1 AC5 C C -1.088 -4.382 2.245 1.00 . A A . 5 AC5 C 1 1
8 807 1 1 1 AC5 CA C -0.314 -5.269 1.172 1.00 . A A . 5 AC5 CA 1 1
8 808 1 1 1 AC5 CB1 C -1.266 -6.147 0.337 1.00 . A A . 5 AC5 CB1 1 1
8 809 1 1 1 AC5 CB2 C 0.506 -6.383 1.876 1.00 . A A . 5 AC5 CB2 1 1
8 810 1 1 1 AC5 CG1 C -0.542 -7.439 -0.076 1.00 . A A . 5 AC5 CG1 1 1
8 811 1 1 1 AC5 CG2 C 0.558 -7.632 0.973 1.00 . A A . 5 AC5 CG2 1 1
8 812 1 1 1 AC5 HB11 H -1.664 -5.575 -0.519 1.00 . A A . 5 AC5 HB11 1 1
8 813 1 1 1 AC5 HB12 H -2.135 -6.411 0.959 1.00 . A A . 5 AC5 HB12 1 1
8 814 1 1 1 AC5 HB21 H 0.012 -6.675 2.824 1.00 . A A . 5 AC5 HB21 1 1
8 815 1 1 1 AC5 HB22 H 1.518 -6.046 2.176 1.00 . A A . 5 AC5 HB22 1 1
8 816 1 1 1 AC5 HG11 H -1.232 -8.303 -0.128 1.00 . A A . 5 AC5 HG11 1 1
8 817 1 1 1 AC5 HG12 H -0.097 -7.326 -1.084 1.00 . A A . 5 AC5 HG12 1 1
8 818 1 1 1 AC5 HG21 H 1.546 -7.729 0.485 1.00 . A A . 5 AC5 HG21 1 1
8 819 1 1 1 AC5 HG22 H 0.407 -8.558 1.559 1.00 . A A . 5 AC5 HG22 1 1
8 820 1 1 1 AC5 N N 0.626 -4.579 0.214 1.00 . A A . 5 AC5 N 1 1
8 821 1 1 1 AC5 O O -2.224 -4.658 2.645 1.00 . A A . 5 AC5 O 1 1
8 822 1 1 2 HIS C C -1.494 -0.950 3.008 1.00 . A A . 6 HIS C 1 1
8 823 1 1 2 HIS CA C -1.016 -2.307 3.640 1.00 . A A . 6 HIS CA 1 1
8 824 1 1 2 HIS CB C 0.064 -2.060 4.731 1.00 . A A . 6 HIS CB 1 1
8 825 1 1 2 HIS CD2 C 1.381 -4.030 5.795 1.00 . A A . 6 HIS CD2 1 1
8 826 1 1 2 HIS CE1 C 0.052 -4.558 7.325 1.00 . A A . 6 HIS CE1 1 1
8 827 1 1 2 HIS CG C 0.269 -3.182 5.746 1.00 . A A . 6 HIS CG 1 1
8 828 1 1 2 HIS H H 0.417 -3.195 2.164 1.00 . A A . 6 HIS H 1 1
8 829 1 1 2 HIS HA H -1.919 -2.713 4.130 1.00 . A A . 6 HIS HA 1 1
8 830 1 1 2 HIS HB2 H 1.030 -1.795 4.262 1.00 . A A . 6 HIS HB2 1 1
8 831 1 1 2 HIS HB3 H -0.189 -1.158 5.300 1.00 . A A . 6 HIS HB3 1 1
8 832 1 1 2 HIS HD1 H -1.527 -3.097 6.985 1.00 . A A . 6 HIS HD1 1 1
8 833 1 1 2 HIS HD2 H 2.214 -3.963 5.112 1.00 . A A . 6 HIS HD2 1 1
8 834 1 1 2 HIS HE1 H -0.374 -5.083 8.169 1.00 . A A . 6 HIS HE1 1 1
8 835 1 1 2 HIS N N -0.431 -3.323 2.716 1.00 . A A . 6 HIS N 1 1
8 836 1 1 2 HIS ND1 N -0.617 -3.506 6.753 1.00 . A A . 6 HIS ND1 1 1
8 837 1 1 2 HIS NE2 N 1.267 -4.954 6.824 1.00 . A A . 6 HIS NE2 1 1
8 838 1 1 2 HIS O O -1.991 -0.092 3.742 1.00 . A A . 6 HIS O 1 1
8 839 1 1 3 . C C -0.319 0.924 0.125 1.00 . A A . 7 DPN C 1 1
8 840 1 1 3 . CA C -1.542 0.601 1.045 1.00 . A A . 7 DPN CA 1 1
8 841 1 1 3 . CB C -2.894 0.589 0.287 1.00 . A A . 7 DPN CB 1 1
8 842 1 1 3 . CD1 C -3.100 2.402 -1.494 1.00 . A A . 7 DPN CD1 1 1
8 843 1 1 3 . CD2 C -4.040 2.828 0.691 1.00 . A A . 7 DPN CD2 1 1
8 844 1 1 3 . CE1 C -3.499 3.671 -1.912 1.00 . A A . 7 DPN CE1 1 1
8 845 1 1 3 . CE2 C -4.440 4.096 0.270 1.00 . A A . 7 DPN CE2 1 1
8 846 1 1 3 . CG C -3.367 1.973 -0.189 1.00 . A A . 7 DPN CG 1 1
8 847 1 1 3 . CZ C -4.169 4.515 -1.029 1.00 . A A . 7 DPN CZ 1 1
8 848 1 1 3 . H H -1.050 -1.563 1.166 1.00 . A A . 7 DPN H 1 1
8 849 1 1 3 . HA H -1.611 1.383 1.830 1.00 . A A . 7 DPN HA 1 1
8 850 1 1 3 . HB2 H -2.820 -0.112 -0.563 1.00 . A A . 7 DPN HB2 1 1
8 851 1 1 3 . HB3 H -3.682 0.150 0.932 1.00 . A A . 7 DPN HB3 1 1
8 852 1 1 3 . HD1 H -2.575 1.757 -2.186 1.00 . A A . 7 DPN HD1 1 1
8 853 1 1 3 . HD2 H -4.255 2.512 1.702 1.00 . A A . 7 DPN HD2 1 1
8 854 1 1 3 . HE1 H -3.293 3.996 -2.921 1.00 . A A . 7 DPN HE1 1 1
8 855 1 1 3 . HE2 H -4.965 4.750 0.952 1.00 . A A . 7 DPN HE2 1 1
8 856 1 1 3 . HZ H -4.483 5.495 -1.357 1.00 . A A . 7 DPN HZ 1 1
8 857 1 1 3 . N N -1.330 -0.722 1.693 1.00 . A A . 7 DPN N 1 1
8 858 1 1 3 . O O 0.124 0.100 -0.683 1.00 . A A . 7 DPN O 1 1
8 859 1 1 4 ARG C C 2.788 1.608 -0.254 1.00 . A A . 8 ARG C 1 1
8 860 1 1 4 ARG CA C 1.527 2.534 -0.408 1.00 . A A . 8 ARG CA 1 1
8 861 1 1 4 ARG CB C 1.807 4.025 -0.074 1.00 . A A . 8 ARG CB 1 1
8 862 1 1 4 ARG CD C 2.444 5.845 1.688 1.00 . A A . 8 ARG CD 1 1
8 863 1 1 4 ARG CG C 2.249 4.348 1.380 1.00 . A A . 8 ARG CG 1 1
8 864 1 1 4 ARG CZ C 0.520 6.858 2.963 1.00 . A A . 8 ARG CZ 1 1
8 865 1 1 4 ARG H H -0.279 2.768 0.876 1.00 . A A . 8 ARG H 1 1
8 866 1 1 4 ARG HA H 1.309 2.493 -1.485 1.00 . A A . 8 ARG HA 1 1
8 867 1 1 4 ARG HB2 H 2.585 4.395 -0.769 1.00 . A A . 8 ARG HB2 1 1
8 868 1 1 4 ARG HB3 H 0.907 4.616 -0.327 1.00 . A A . 8 ARG HB3 1 1
8 869 1 1 4 ARG HD2 H 3.088 5.970 2.582 1.00 . A A . 8 ARG HD2 1 1
8 870 1 1 4 ARG HD3 H 3.036 6.319 0.878 1.00 . A A . 8 ARG HD3 1 1
8 871 1 1 4 ARG HE H 0.604 6.783 0.980 1.00 . A A . 8 ARG HE 1 1
8 872 1 1 4 ARG HG2 H 1.532 3.911 2.100 1.00 . A A . 8 ARG HG2 1 1
8 873 1 1 4 ARG HG3 H 3.206 3.828 1.577 1.00 . A A . 8 ARG HG3 1 1
8 874 1 1 4 ARG HH11 H -1.078 7.715 3.781 1.00 . A A . 8 ARG HH11 1 1
8 875 1 1 4 ARG HH12 H -0.979 7.696 1.964 1.00 . A A . 8 ARG HH12 1 1
8 876 1 1 4 ARG HH21 H 0.470 6.870 4.972 1.00 . A A . 8 ARG HH21 1 1
8 877 1 1 4 ARG HH22 H 1.889 6.076 4.134 1.00 . A A . 8 ARG HH22 1 1
8 878 1 1 4 ARG N N 0.257 2.128 0.286 1.00 . A A . 8 ARG N 1 1
8 879 1 1 4 ARG NE N 1.132 6.541 1.820 1.00 . A A . 8 ARG NE 1 1
8 880 1 1 4 ARG NH1 N -0.625 7.475 2.897 1.00 . A A . 8 ARG NH1 1 1
8 881 1 1 4 ARG NH2 N 1.001 6.581 4.150 1.00 . A A . 8 ARG NH2 1 1
8 882 1 1 4 ARG O O 3.545 1.394 -1.202 1.00 . A A . 8 ARG O 1 1
8 883 1 1 5 TRP C C 3.936 -1.313 0.321 1.00 . A A . 9 TRP C 1 1
8 884 1 1 5 TRP CA C 3.883 -0.071 1.278 1.00 . A A . 9 TRP CA 1 1
8 885 1 1 5 TRP CB C 3.517 -0.549 2.714 1.00 . A A . 9 TRP CB 1 1
8 886 1 1 5 TRP CD1 C 4.679 0.922 4.601 1.00 . A A . 9 TRP CD1 1 1
8 887 1 1 5 TRP CD2 C 2.521 1.274 4.253 1.00 . A A . 9 TRP CD2 1 1
8 888 1 1 5 TRP CE2 C 2.973 2.164 5.249 1.00 . A A . 9 TRP CE2 1 1
8 889 1 1 5 TRP CE3 C 1.203 1.336 3.769 1.00 . A A . 9 TRP CE3 1 1
8 890 1 1 5 TRP CG C 3.573 0.492 3.845 1.00 . A A . 9 TRP CG 1 1
8 891 1 1 5 TRP CH2 C 0.766 3.169 5.303 1.00 . A A . 9 TRP CH2 1 1
8 892 1 1 5 TRP CZ2 C 2.081 3.128 5.786 1.00 . A A . 9 TRP CZ2 1 1
8 893 1 1 5 TRP CZ3 C 0.341 2.288 4.298 1.00 . A A . 9 TRP CZ3 1 1
8 894 1 1 5 TRP H H 2.196 1.307 1.587 1.00 . A A . 9 TRP H 1 1
8 895 1 1 5 TRP HA H 4.898 0.359 1.330 1.00 . A A . 9 TRP HA 1 1
8 896 1 1 5 TRP HB2 H 2.511 -1.011 2.691 1.00 . A A . 9 TRP HB2 1 1
8 897 1 1 5 TRP HB3 H 4.152 -1.386 3.006 1.00 . A A . 9 TRP HB3 1 1
8 898 1 1 5 TRP HD1 H 5.681 0.537 4.471 1.00 . A A . 9 TRP HD1 1 1
8 899 1 1 5 TRP HE1 H 4.928 2.463 6.156 1.00 . A A . 9 TRP HE1 1 1
8 900 1 1 5 TRP HE3 H 0.908 0.666 2.977 1.00 . A A . 9 TRP HE3 1 1
8 901 1 1 5 TRP HH2 H 0.069 3.888 5.706 1.00 . A A . 9 TRP HH2 1 1
8 902 1 1 5 TRP HZ2 H 2.412 3.815 6.552 1.00 . A A . 9 TRP HZ2 1 1
8 903 1 1 5 TRP HZ3 H -0.660 2.321 3.899 1.00 . A A . 9 TRP HZ3 1 1
8 904 1 1 5 TRP N N 2.940 1.032 0.942 1.00 . A A . 9 TRP N 1 1
8 905 1 1 5 TRP NE1 N 4.323 1.960 5.494 1.00 . A A . 9 TRP NE1 1 1
8 906 1 1 5 TRP O O 5.001 -1.917 0.172 1.00 . A A . 9 TRP O 1 1
8 907 1 1 6 ASP C C 3.565 -2.560 -2.649 1.00 . A A . 10 ASP C 1 1
8 908 1 1 6 ASP CA C 2.761 -2.791 -1.324 1.00 . A A . 10 ASP CA 1 1
8 909 1 1 6 ASP CB C 1.273 -3.112 -1.656 1.00 . A A . 10 ASP CB 1 1
8 910 1 1 6 ASP CG C 0.311 -3.501 -0.520 1.00 . A A . 10 ASP CG 1 1
8 911 1 1 6 ASP H H 2.007 -1.075 -0.147 1.00 . A A . 10 ASP H 1 1
8 912 1 1 6 ASP HA H 3.216 -3.694 -0.870 1.00 . A A . 10 ASP HA 1 1
8 913 1 1 6 ASP HB2 H 0.827 -2.242 -2.175 1.00 . A A . 10 ASP HB2 1 1
8 914 1 1 6 ASP HB3 H 1.230 -3.924 -2.406 1.00 . A A . 10 ASP HB3 1 1
8 915 1 1 6 ASP N N 2.810 -1.696 -0.311 1.00 . A A . 10 ASP N 1 1
8 916 1 1 6 ASP O O 4.071 -3.504 -3.246 1.00 . A A . 10 ASP O 1 1
8 917 1 1 6 ASP OD1 O -0.710 -2.843 -0.334 1.00 . A A . 10 ASP OD1 1 1
8 918 1 1 7 NH2 HN1 H 4.351 -1.365 -3.982 1.00 . A A . 11 NH2 HN1 1 1
8 919 1 1 7 NH2 HN2 H 3.470 -0.566 -2.579 1.00 . A A . 11 NH2 HN2 1 1
8 920 1 1 7 NH2 N N 3.711 -1.361 -3.184 1.00 . A A . 11 NH2 N 1 1
9 921 1 1 1 AC5 C C -1.134 -4.374 2.228 1.00 . A A . 5 AC5 C 1 1
9 922 1 1 1 AC5 CA C -0.370 -5.264 1.147 1.00 . A A . 5 AC5 CA 1 1
9 923 1 1 1 AC5 CB1 C -1.342 -6.112 0.303 1.00 . A A . 5 AC5 CB1 1 1
9 924 1 1 1 AC5 CB2 C 0.417 -6.407 1.841 1.00 . A A . 5 AC5 CB2 1 1
9 925 1 1 1 AC5 CG1 C -1.663 -7.407 1.069 1.00 . A A . 5 AC5 CG1 1 1
9 926 1 1 1 AC5 CG2 C -0.590 -7.523 2.155 1.00 . A A . 5 AC5 CG2 1 1
9 927 1 1 1 AC5 HB11 H -0.876 -6.368 -0.663 1.00 . A A . 5 AC5 HB11 1 1
9 928 1 1 1 AC5 HB12 H -2.241 -5.517 0.058 1.00 . A A . 5 AC5 HB12 1 1
9 929 1 1 1 AC5 HB21 H 0.951 -6.062 2.749 1.00 . A A . 5 AC5 HB21 1 1
9 930 1 1 1 AC5 HB22 H 1.200 -6.831 1.181 1.00 . A A . 5 AC5 HB22 1 1
9 931 1 1 1 AC5 HG11 H -2.672 -7.357 1.524 1.00 . A A . 5 AC5 HG11 1 1
9 932 1 1 1 AC5 HG12 H -1.663 -8.285 0.394 1.00 . A A . 5 AC5 HG12 1 1
9 933 1 1 1 AC5 HG21 H -0.117 -8.523 2.184 1.00 . A A . 5 AC5 HG21 1 1
9 934 1 1 1 AC5 HG22 H -1.043 -7.359 3.154 1.00 . A A . 5 AC5 HG22 1 1
9 935 1 1 1 AC5 N N 0.587 -4.575 0.204 1.00 . A A . 5 AC5 N 1 1
9 936 1 1 1 AC5 O O -2.277 -4.630 2.626 1.00 . A A . 5 AC5 O 1 1
9 937 1 1 2 HIS C C -1.481 -0.943 2.994 1.00 . A A . 6 HIS C 1 1
9 938 1 1 2 HIS CA C -1.018 -2.307 3.625 1.00 . A A . 6 HIS CA 1 1
9 939 1 1 2 HIS CB C 0.071 -2.074 4.713 1.00 . A A . 6 HIS CB 1 1
9 940 1 1 2 HIS CD2 C -0.290 -4.374 5.945 1.00 . A A . 6 HIS CD2 1 1
9 941 1 1 2 HIS CE1 C 1.381 -4.319 7.203 1.00 . A A . 6 HIS CE1 1 1
9 942 1 1 2 HIS CG C 0.415 -3.183 5.710 1.00 . A A . 6 HIS CG 1 1
9 943 1 1 2 HIS H H 0.398 -3.230 2.145 1.00 . A A . 6 HIS H 1 1
9 944 1 1 2 HIS HA H -1.927 -2.695 4.118 1.00 . A A . 6 HIS HA 1 1
9 945 1 1 2 HIS HB2 H 1.008 -1.763 4.227 1.00 . A A . 6 HIS HB2 1 1
9 946 1 1 2 HIS HB3 H -0.226 -1.204 5.312 1.00 . A A . 6 HIS HB3 1 1
9 947 1 1 2 HIS HD1 H 2.229 -2.398 6.634 1.00 . A A . 6 HIS HD1 1 1
9 948 1 1 2 HIS HD2 H -1.184 -4.644 5.407 1.00 . A A . 6 HIS HD2 1 1
9 949 1 1 2 HIS HE1 H 2.100 -4.611 7.958 1.00 . A A . 6 HIS HE1 1 1
9 950 1 1 2 HIS N N -0.454 -3.331 2.698 1.00 . A A . 6 HIS N 1 1
9 951 1 1 2 HIS ND1 N 1.519 -3.130 6.535 1.00 . A A . 6 HIS ND1 1 1
9 952 1 1 2 HIS NE2 N 0.324 -5.146 6.920 1.00 . A A . 6 HIS NE2 1 1
9 953 1 1 2 HIS O O -1.982 -0.086 3.726 1.00 . A A . 6 HIS O 1 1
9 954 1 1 3 . C C -0.297 0.945 0.121 1.00 . A A . 7 DPN C 1 1
9 955 1 1 3 . CA C -1.524 0.609 1.032 1.00 . A A . 7 DPN CA 1 1
9 956 1 1 3 . CB C -2.867 0.570 0.259 1.00 . A A . 7 DPN CB 1 1
9 957 1 1 3 . CD1 C -4.039 2.805 0.595 1.00 . A A . 7 DPN CD1 1 1
9 958 1 1 3 . CD2 C -3.084 2.329 -1.573 1.00 . A A . 7 DPN CD2 1 1
9 959 1 1 3 . CE1 C -4.452 4.055 0.137 1.00 . A A . 7 DPN CE1 1 1
9 960 1 1 3 . CE2 C -3.496 3.580 -2.028 1.00 . A A . 7 DPN CE2 1 1
9 961 1 1 3 . CG C -3.351 1.936 -0.257 1.00 . A A . 7 DPN CG 1 1
9 962 1 1 3 . CZ C -4.179 4.441 -1.173 1.00 . A A . 7 DPN CZ 1 1
9 963 1 1 3 . H H -1.034 -1.553 1.154 1.00 . A A . 7 DPN H 1 1
9 964 1 1 3 . HA H -1.614 1.392 1.813 1.00 . A A . 7 DPN HA 1 1
9 965 1 1 3 . HB2 H -2.776 -0.151 -0.574 1.00 . A A . 7 DPN HB2 1 1
9 966 1 1 3 . HB3 H -3.658 0.136 0.904 1.00 . A A . 7 DPN HB3 1 1
9 967 1 1 3 . HD1 H -4.254 2.517 1.614 1.00 . A A . 7 DPN HD1 1 1
9 968 1 1 3 . HD2 H -2.548 1.671 -2.243 1.00 . A A . 7 DPN HD2 1 1
9 969 1 1 3 . HE1 H -4.985 4.724 0.797 1.00 . A A . 7 DPN HE1 1 1
9 970 1 1 3 . HE2 H -3.287 3.880 -3.046 1.00 . A A . 7 DPN HE2 1 1
9 971 1 1 3 . HZ H -4.502 5.409 -1.529 1.00 . A A . 7 DPN HZ 1 1
9 972 1 1 3 . N N -1.300 -0.711 1.683 1.00 . A A . 7 DPN N 1 1
9 973 1 1 3 . O O 0.155 0.127 -0.688 1.00 . A A . 7 DPN O 1 1
9 974 1 1 4 ARG C C 2.808 1.601 -0.228 1.00 . A A . 8 ARG C 1 1
9 975 1 1 4 ARG CA C 1.564 2.555 -0.362 1.00 . A A . 8 ARG CA 1 1
9 976 1 1 4 ARG CB C 1.876 4.025 0.050 1.00 . A A . 8 ARG CB 1 1
9 977 1 1 4 ARG CD C 2.546 5.723 1.885 1.00 . A A . 8 ARG CD 1 1
9 978 1 1 4 ARG CG C 2.306 4.249 1.521 1.00 . A A . 8 ARG CG 1 1
9 979 1 1 4 ARG CZ C 3.264 6.900 3.981 1.00 . A A . 8 ARG CZ 1 1
9 980 1 1 4 ARG H H -0.274 2.785 0.877 1.00 . A A . 8 ARG H 1 1
9 981 1 1 4 ARG HA H 1.361 2.567 -1.443 1.00 . A A . 8 ARG HA 1 1
9 982 1 1 4 ARG HB2 H 2.671 4.411 -0.619 1.00 . A A . 8 ARG HB2 1 1
9 983 1 1 4 ARG HB3 H 0.995 4.654 -0.178 1.00 . A A . 8 ARG HB3 1 1
9 984 1 1 4 ARG HD2 H 3.318 6.156 1.215 1.00 . A A . 8 ARG HD2 1 1
9 985 1 1 4 ARG HD3 H 1.614 6.306 1.724 1.00 . A A . 8 ARG HD3 1 1
9 986 1 1 4 ARG HE H 3.095 4.924 3.851 1.00 . A A . 8 ARG HE 1 1
9 987 1 1 4 ARG HG2 H 1.535 3.823 2.189 1.00 . A A . 8 ARG HG2 1 1
9 988 1 1 4 ARG HG3 H 3.228 3.666 1.717 1.00 . A A . 8 ARG HG3 1 1
9 989 1 1 4 ARG HH11 H 3.412 8.905 4.050 1.00 . A A . 8 ARG HH11 1 1
9 990 1 1 4 ARG HH12 H 2.868 8.116 2.491 1.00 . A A . 8 ARG HH12 1 1
9 991 1 1 4 ARG HH21 H 3.731 5.843 5.593 1.00 . A A . 8 ARG HH21 1 1
9 992 1 1 4 ARG HH22 H 3.870 7.653 5.717 1.00 . A A . 8 ARG HH22 1 1
9 993 1 1 4 ARG N N 0.279 2.146 0.300 1.00 . A A . 8 ARG N 1 1
9 994 1 1 4 ARG NE N 2.980 5.786 3.306 1.00 . A A . 8 ARG NE 1 1
9 995 1 1 4 ARG NH1 N 3.176 8.101 3.465 1.00 . A A . 8 ARG NH1 1 1
9 996 1 1 4 ARG NH2 N 3.652 6.789 5.217 1.00 . A A . 8 ARG NH2 1 1
9 997 1 1 4 ARG O O 3.571 1.401 -1.175 1.00 . A A . 8 ARG O 1 1
9 998 1 1 5 TRP C C 3.928 -1.349 0.328 1.00 . A A . 9 TRP C 1 1
9 999 1 1 5 TRP CA C 3.892 -0.104 1.282 1.00 . A A . 9 TRP CA 1 1
9 1000 1 1 5 TRP CB C 3.551 -0.571 2.725 1.00 . A A . 9 TRP CB 1 1
9 1001 1 1 5 TRP CD1 C 4.726 0.920 4.593 1.00 . A A . 9 TRP CD1 1 1
9 1002 1 1 5 TRP CD2 C 2.562 1.253 4.268 1.00 . A A . 9 TRP CD2 1 1
9 1003 1 1 5 TRP CE2 C 3.015 2.148 5.260 1.00 . A A . 9 TRP CE2 1 1
9 1004 1 1 5 TRP CE3 C 1.237 1.301 3.801 1.00 . A A . 9 TRP CE3 1 1
9 1005 1 1 5 TRP CG C 3.615 0.480 3.849 1.00 . A A . 9 TRP CG 1 1
9 1006 1 1 5 TRP CH2 C 0.801 3.133 5.336 1.00 . A A . 9 TRP CH2 1 1
9 1007 1 1 5 TRP CZ2 C 2.120 3.102 5.810 1.00 . A A . 9 TRP CZ2 1 1
9 1008 1 1 5 TRP CZ3 C 0.372 2.244 4.340 1.00 . A A . 9 TRP CZ3 1 1
9 1009 1 1 5 TRP H H 2.187 1.250 1.595 1.00 . A A . 9 TRP H 1 1
9 1010 1 1 5 TRP HA H 4.908 0.328 1.313 1.00 . A A . 9 TRP HA 1 1
9 1011 1 1 5 TRP HB2 H 2.550 -1.041 2.721 1.00 . A A . 9 TRP HB2 1 1
9 1012 1 1 5 TRP HB3 H 4.196 -1.401 3.013 1.00 . A A . 9 TRP HB3 1 1
9 1013 1 1 5 TRP HD1 H 5.728 0.534 4.456 1.00 . A A . 9 TRP HD1 1 1
9 1014 1 1 5 TRP HE1 H 4.972 2.423 6.180 1.00 . A A . 9 TRP HE1 1 1
9 1015 1 1 5 TRP HE3 H 0.937 0.626 3.013 1.00 . A A . 9 TRP HE3 1 1
9 1016 1 1 5 TRP HH2 H 0.101 3.849 5.742 1.00 . A A . 9 TRP HH2 1 1
9 1017 1 1 5 TRP HZ2 H 2.446 3.785 6.580 1.00 . A A . 9 TRP HZ2 1 1
9 1018 1 1 5 TRP HZ3 H -0.634 2.267 3.952 1.00 . A A . 9 TRP HZ3 1 1
9 1019 1 1 5 TRP N N 2.939 0.992 0.953 1.00 . A A . 9 TRP N 1 1
9 1020 1 1 5 TRP NE1 N 4.372 1.958 5.487 1.00 . A A . 9 TRP NE1 1 1
9 1021 1 1 5 TRP O O 4.981 -1.973 0.186 1.00 . A A . 9 TRP O 1 1
9 1022 1 1 6 ASP C C 3.546 -2.574 -2.649 1.00 . A A . 10 ASP C 1 1
9 1023 1 1 6 ASP CA C 2.737 -2.803 -1.326 1.00 . A A . 10 ASP CA 1 1
9 1024 1 1 6 ASP CB C 1.246 -3.107 -1.662 1.00 . A A . 10 ASP CB 1 1
9 1025 1 1 6 ASP CG C 0.273 -3.501 -0.538 1.00 . A A . 10 ASP CG 1 1
9 1026 1 1 6 ASP H H 2.013 -1.063 -0.160 1.00 . A A . 10 ASP H 1 1
9 1027 1 1 6 ASP HA H 3.180 -3.712 -0.877 1.00 . A A . 10 ASP HA 1 1
9 1028 1 1 6 ASP HB2 H 0.810 -2.226 -2.174 1.00 . A A . 10 ASP HB2 1 1
9 1029 1 1 6 ASP HB3 H 1.196 -3.908 -2.423 1.00 . A A . 10 ASP HB3 1 1
9 1030 1 1 6 ASP N N 2.797 -1.714 -0.310 1.00 . A A . 10 ASP N 1 1
9 1031 1 1 6 ASP O O 4.053 -3.519 -3.245 1.00 . A A . 10 ASP O 1 1
9 1032 1 1 6 ASP OD1 O -0.758 -2.853 -0.370 1.00 . A A . 10 ASP OD1 1 1
9 1033 1 1 7 NH2 HN1 H 4.333 -1.380 -3.982 1.00 . A A . 11 NH2 HN1 1 1
9 1034 1 1 7 NH2 HN2 H 3.447 -0.579 -2.584 1.00 . A A . 11 NH2 HN2 1 1
9 1035 1 1 7 NH2 N N 3.694 -1.374 -3.185 1.00 . A A . 11 NH2 N 1 1
10 1036 1 1 1 AC5 C C -0.926 -4.461 2.410 1.00 . A A . 5 AC5 C 1 1
10 1037 1 1 1 AC5 CA C -0.260 -5.328 1.251 1.00 . A A . 5 AC5 CA 1 1
10 1038 1 1 1 AC5 CB1 C -1.324 -6.123 0.440 1.00 . A A . 5 AC5 CB1 1 1
10 1039 1 1 1 AC5 CB2 C 0.577 -6.467 1.908 1.00 . A A . 5 AC5 CB2 1 1
10 1040 1 1 1 AC5 CG1 C -1.228 -7.599 0.840 1.00 . A A . 5 AC5 CG1 1 1
10 1041 1 1 1 AC5 CG2 C 0.251 -7.772 1.171 1.00 . A A . 5 AC5 CG2 1 1
10 1042 1 1 1 AC5 HB11 H -1.152 -6.026 -0.647 1.00 . A A . 5 AC5 HB11 1 1
10 1043 1 1 1 AC5 HB12 H -2.337 -5.712 0.598 1.00 . A A . 5 AC5 HB12 1 1
10 1044 1 1 1 AC5 HB21 H 0.299 -6.603 2.972 1.00 . A A . 5 AC5 HB21 1 1
10 1045 1 1 1 AC5 HB22 H 1.666 -6.257 1.941 1.00 . A A . 5 AC5 HB22 1 1
10 1046 1 1 1 AC5 HG11 H -1.855 -7.801 1.733 1.00 . A A . 5 AC5 HG11 1 1
10 1047 1 1 1 AC5 HG12 H -1.572 -8.284 0.042 1.00 . A A . 5 AC5 HG12 1 1
10 1048 1 1 1 AC5 HG21 H 0.853 -7.866 0.245 1.00 . A A . 5 AC5 HG21 1 1
10 1049 1 1 1 AC5 HG22 H 0.450 -8.672 1.784 1.00 . A A . 5 AC5 HG22 1 1
10 1050 1 1 1 AC5 N N 0.659 -4.655 0.259 1.00 . A A . 5 AC5 N 1 1
10 1051 1 1 1 AC5 O O -1.932 -4.844 3.015 1.00 . A A . 5 AC5 O 1 1
10 1052 1 1 2 HIS C C -1.336 -0.944 3.118 1.00 . A A . 6 HIS C 1 1
10 1053 1 1 2 HIS CA C -0.844 -2.321 3.705 1.00 . A A . 6 HIS CA 1 1
10 1054 1 1 2 HIS CB C 0.290 -2.169 4.764 1.00 . A A . 6 HIS CB 1 1
10 1055 1 1 2 HIS CD2 C -0.522 -2.584 7.179 1.00 . A A . 6 HIS CD2 1 1
10 1056 1 1 2 HIS CE1 C -0.624 -0.609 7.871 1.00 . A A . 6 HIS CE1 1 1
10 1057 1 1 2 HIS CG C -0.155 -1.716 6.146 1.00 . A A . 6 HIS CG 1 1
10 1058 1 1 2 HIS H H 0.365 -3.138 1.977 1.00 . A A . 6 HIS H 1 1
10 1059 1 1 2 HIS HA H -1.737 -2.736 4.206 1.00 . A A . 6 HIS HA 1 1
10 1060 1 1 2 HIS HB2 H 0.829 -3.127 4.907 1.00 . A A . 6 HIS HB2 1 1
10 1061 1 1 2 HIS HB3 H 1.070 -1.486 4.399 1.00 . A A . 6 HIS HB3 1 1
10 1062 1 1 2 HIS HD1 H -0.081 0.455 6.049 1.00 . A A . 6 HIS HD1 1 1
10 1063 1 1 2 HIS HD2 H -0.530 -3.658 7.069 1.00 . A A . 6 HIS HD2 1 1
10 1064 1 1 2 HIS HE1 H -0.811 0.235 8.522 1.00 . A A . 6 HIS HE1 1 1
10 1065 1 1 2 HIS N N -0.316 -3.318 2.721 1.00 . A A . 6 HIS N 1 1
10 1066 1 1 2 HIS ND1 N -0.194 -0.411 6.587 1.00 . A A . 6 HIS ND1 1 1
10 1067 1 1 2 HIS NE2 N -0.844 -1.883 8.335 1.00 . A A . 6 HIS NE2 1 1
10 1068 1 1 2 HIS O O -1.784 -0.082 3.879 1.00 . A A . 6 HIS O 1 1
10 1069 1 1 3 . C C -0.329 0.940 0.181 1.00 . A A . 7 DPN C 1 1
10 1070 1 1 3 . CA C -1.505 0.609 1.157 1.00 . A A . 7 DPN CA 1 1
10 1071 1 1 3 . CB C -2.891 0.575 0.464 1.00 . A A . 7 DPN CB 1 1
10 1072 1 1 3 . CD1 C -3.212 2.349 -1.337 1.00 . A A . 7 DPN CD1 1 1
10 1073 1 1 3 . CD2 C -4.036 2.811 0.887 1.00 . A A . 7 DPN CD2 1 1
10 1074 1 1 3 . CE1 C -3.647 3.605 -1.757 1.00 . A A . 7 DPN CE1 1 1
10 1075 1 1 3 . CE2 C -4.471 4.064 0.465 1.00 . A A . 7 DPN CE2 1 1
10 1076 1 1 3 . CG C -3.402 1.944 -0.011 1.00 . A A . 7 DPN CG 1 1
10 1077 1 1 3 . CZ C -4.276 4.461 -0.856 1.00 . A A . 7 DPN CZ 1 1
10 1078 1 1 3 . H H -0.987 -1.548 1.255 1.00 . A A . 7 DPN H 1 1
10 1079 1 1 3 . HA H -1.548 1.392 1.943 1.00 . A A . 7 DPN HA 1 1
10 1080 1 1 3 . HB2 H -2.852 -0.139 -0.377 1.00 . A A . 7 DPN HB2 1 1
10 1081 1 1 3 . HB3 H -3.643 0.138 1.151 1.00 . A A . 7 DPN HB3 1 1
10 1082 1 1 3 . HD1 H -2.718 1.697 -2.043 1.00 . A A . 7 DPN HD1 1 1
10 1083 1 1 3 . HD2 H -4.191 2.513 1.916 1.00 . A A . 7 DPN HD2 1 1
10 1084 1 1 3 . HE1 H -3.498 3.914 -2.782 1.00 . A A . 7 DPN HE1 1 1
10 1085 1 1 3 . HE2 H -4.962 4.730 1.162 1.00 . A A . 7 DPN HE2 1 1
10 1086 1 1 3 . HZ H -4.616 5.433 -1.183 1.00 . A A . 7 DPN HZ 1 1
10 1087 1 1 3 . N N -1.248 -0.711 1.796 1.00 . A A . 7 DPN N 1 1
10 1088 1 1 3 . O O 0.093 0.112 -0.635 1.00 . A A . 7 DPN O 1 1
10 1089 1 1 4 ARG C C 2.761 1.603 -0.259 1.00 . A A . 8 ARG C 1 1
10 1090 1 1 4 ARG CA C 1.510 2.547 -0.395 1.00 . A A . 8 ARG CA 1 1
10 1091 1 1 4 ARG CB C 1.823 4.030 -0.031 1.00 . A A . 8 ARG CB 1 1
10 1092 1 1 4 ARG CD C 2.524 5.776 1.750 1.00 . A A . 8 ARG CD 1 1
10 1093 1 1 4 ARG CG C 2.286 4.294 1.424 1.00 . A A . 8 ARG CG 1 1
10 1094 1 1 4 ARG CZ C 3.278 7.000 3.806 1.00 . A A . 8 ARG CZ 1 1
10 1095 1 1 4 ARG H H -0.291 2.799 0.895 1.00 . A A . 8 ARG H 1 1
10 1096 1 1 4 ARG HA H 1.283 2.524 -1.470 1.00 . A A . 8 ARG HA 1 1
10 1097 1 1 4 ARG HB2 H 2.599 4.402 -0.727 1.00 . A A . 8 ARG HB2 1 1
10 1098 1 1 4 ARG HB3 H 0.932 4.647 -0.254 1.00 . A A . 8 ARG HB3 1 1
10 1099 1 1 4 ARG HD2 H 3.278 6.197 1.054 1.00 . A A . 8 ARG HD2 1 1
10 1100 1 1 4 ARG HD3 H 1.585 6.350 1.596 1.00 . A A . 8 ARG HD3 1 1
10 1101 1 1 4 ARG HE H 3.121 5.022 3.721 1.00 . A A . 8 ARG HE 1 1
10 1102 1 1 4 ARG HG2 H 1.533 3.878 2.120 1.00 . A A . 8 ARG HG2 1 1
10 1103 1 1 4 ARG HG3 H 3.216 3.721 1.612 1.00 . A A . 8 ARG HG3 1 1
10 1104 1 1 4 ARG HH11 H 3.917 7.792 5.514 1.00 . A A . 8 ARG HH11 1 1
10 1105 1 1 4 ARG HH12 H 3.786 5.979 5.429 1.00 . A A . 8 ARG HH12 1 1
10 1106 1 1 4 ARG HH21 H 2.841 8.184 2.301 1.00 . A A . 8 ARG HH21 1 1
10 1107 1 1 4 ARG HH22 H 3.414 9.007 3.831 1.00 . A A . 8 ARG HH22 1 1
10 1108 1 1 4 ARG N N 0.243 2.149 0.310 1.00 . A A . 8 ARG N 1 1
10 1109 1 1 4 ARG NE N 2.987 5.871 3.161 1.00 . A A . 8 ARG NE 1 1
10 1110 1 1 4 ARG NH1 N 3.694 6.917 5.035 1.00 . A A . 8 ARG NH1 1 1
10 1111 1 1 4 ARG NH2 N 3.169 8.191 3.268 1.00 . A A . 8 ARG NH2 1 1
10 1112 1 1 4 ARG O O 3.508 1.382 -1.212 1.00 . A A . 8 ARG O 1 1
10 1113 1 1 5 TRP C C 3.937 -1.315 0.355 1.00 . A A . 9 TRP C 1 1
10 1114 1 1 5 TRP CA C 3.886 -0.050 1.283 1.00 . A A . 9 TRP CA 1 1
10 1115 1 1 5 TRP CB C 3.550 -0.484 2.738 1.00 . A A . 9 TRP CB 1 1
10 1116 1 1 5 TRP CD1 C 4.757 1.019 4.573 1.00 . A A . 9 TRP CD1 1 1
10 1117 1 1 5 TRP CD2 C 2.597 1.381 4.258 1.00 . A A . 9 TRP CD2 1 1
10 1118 1 1 5 TRP CE2 C 3.070 2.275 5.243 1.00 . A A . 9 TRP CE2 1 1
10 1119 1 1 5 TRP CE3 C 1.268 1.437 3.811 1.00 . A A . 9 TRP CE3 1 1
10 1120 1 1 5 TRP CG C 3.636 0.589 3.839 1.00 . A A . 9 TRP CG 1 1
10 1121 1 1 5 TRP CH2 C 0.863 3.273 5.349 1.00 . A A . 9 TRP CH2 1 1
10 1122 1 1 5 TRP CZ2 C 2.187 3.234 5.804 1.00 . A A . 9 TRP CZ2 1 1
10 1123 1 1 5 TRP CZ3 C 0.415 2.387 4.359 1.00 . A A . 9 TRP CZ3 1 1
10 1124 1 1 5 TRP H H 2.172 1.297 1.582 1.00 . A A . 9 TRP H 1 1
10 1125 1 1 5 TRP HA H 4.895 0.395 1.302 1.00 . A A . 9 TRP HA 1 1
10 1126 1 1 5 TRP HB2 H 2.544 -0.947 2.751 1.00 . A A . 9 TRP HB2 1 1
10 1127 1 1 5 TRP HB3 H 4.189 -1.315 3.038 1.00 . A A . 9 TRP HB3 1 1
10 1128 1 1 5 TRP HD1 H 5.750 0.613 4.440 1.00 . A A . 9 TRP HD1 1 1
10 1129 1 1 5 TRP HE1 H 5.033 2.524 6.155 1.00 . A A . 9 TRP HE1 1 1
10 1130 1 1 5 TRP HE3 H 0.951 0.756 3.035 1.00 . A A . 9 TRP HE3 1 1
10 1131 1 1 5 TRP HH2 H 0.173 3.995 5.762 1.00 . A A . 9 TRP HH2 1 1
10 1132 1 1 5 TRP HZ2 H 2.528 3.915 6.571 1.00 . A A . 9 TRP HZ2 1 1
10 1133 1 1 5 TRP HZ3 H -0.596 2.412 3.988 1.00 . A A . 9 TRP HZ3 1 1
10 1134 1 1 5 TRP N N 2.917 1.027 0.937 1.00 . A A . 9 TRP N 1 1
10 1135 1 1 5 TRP NE1 N 4.425 2.069 5.462 1.00 . A A . 9 TRP NE1 1 1
10 1136 1 1 5 TRP O O 5.003 -1.920 0.221 1.00 . A A . 9 TRP O 1 1
10 1137 1 1 6 ASP C C 3.571 -2.590 -2.603 1.00 . A A . 10 ASP C 1 1
10 1138 1 1 6 ASP CA C 2.774 -2.819 -1.273 1.00 . A A . 10 ASP CA 1 1
10 1139 1 1 6 ASP CB C 1.289 -3.166 -1.598 1.00 . A A . 10 ASP CB 1 1
10 1140 1 1 6 ASP CG C 0.341 -3.562 -0.454 1.00 . A A . 10 ASP CG 1 1
10 1141 1 1 6 ASP H H 2.010 -1.087 -0.124 1.00 . A A . 10 ASP H 1 1
10 1142 1 1 6 ASP HA H 3.241 -3.711 -0.812 1.00 . A A . 10 ASP HA 1 1
10 1143 1 1 6 ASP HB2 H 0.827 -2.302 -2.117 1.00 . A A . 10 ASP HB2 1 1
10 1144 1 1 6 ASP HB3 H 1.253 -3.979 -2.345 1.00 . A A . 10 ASP HB3 1 1
10 1145 1 1 6 ASP N N 2.812 -1.713 -0.272 1.00 . A A . 10 ASP N 1 1
10 1146 1 1 6 ASP O O 4.090 -3.534 -3.189 1.00 . A A . 10 ASP O 1 1
10 1147 1 1 6 ASP OD1 O -0.664 -2.891 -0.233 1.00 . A A . 10 ASP OD1 1 1
10 1148 1 1 7 NH2 HN1 H 4.331 -1.401 -3.953 1.00 . A A . 11 NH2 HN1 1 1
10 1149 1 1 7 NH2 HN2 H 3.441 -0.598 -2.559 1.00 . A A . 11 NH2 HN2 1 1
10 1150 1 1 7 NH2 N N 3.696 -1.397 -3.153 1.00 . A A . 11 NH2 N 1 1
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