NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | subtype | item_count |
|
|
481476 |
1dep   |
cing | 4-filtered-FRED | STAR | entry | full | 59 |
data_FRED_restraints_with_modified_coordinates_PDB_code_1dep
# This FRED archive file contains, for PDB entry <1dep>:
#
# - 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.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_1dep
_Assembly.Sf_category assembly
_Assembly.Entry_ID 1
_Assembly.ID 1
_Assembly.Name 1dep
_Assembly.Number_of_components 1
_Assembly.Organic_ligands .
_Assembly.Metal_ions .
_Assembly.Paramagnetic .
_Assembly.Thiol_state "all free"
_Assembly.Molecular_mass 1888.29
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 $T345_359 A . 1 1
stop_
save_
save_T345_359
_Entity.Sf_category entity
_Entity.Entry_ID 1
_Entity.ID 1
_Entity.Name "T345 359"
_Entity.Type polymer
_Entity.Polymer_type polypeptide(L)
_Entity.Polymer_seq_one_letter_code RSPDFRKAFKRLLCF
_Entity.Number_of_monomers 15
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 ARG . 1 1
2 SER . 1 1
3 PRO . 1 1
4 ASP . 1 1
5 PHE . 1 1
6 ARG . 1 1
7 LYS . 1 1
8 ALA . 1 1
9 PHE . 1 1
10 LYS . 1 1
11 ARG . 1 1
12 LEU . 1 1
13 LEU . 1 1
14 CYS . 1 1
15 PHE . 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
ARG 1 1 1 1
SER 2 2 1 1
PRO 3 3 1 1
ASP 4 4 1 1
PHE 5 5 1 1
ARG 6 6 1 1
LYS 7 7 1 1
ALA 8 8 1 1
PHE 9 9 1 1
LYS 10 10 1 1
ARG 11 11 1 1
LEU 12 12 1 1
LEU 13 13 1 1
CYS 14 14 1 1
PHE 15 15 1 1
stop_
save_
save_CNS/XPLOR_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
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 ARG QB . 1 . HB# 1 1
1 1 2 1 1 3 PRO QD . 3 . HD# 1 1
2 1 1 1 1 1 ARG HB3 . 1 . HB1 1 1
2 1 2 1 1 3 PRO HB3 . 3 . HB1 1 1
3 1 1 1 1 1 ARG QG . 1 . HG# 1 1
3 1 2 1 1 3 PRO HA . 3 . HA 1 1
4 1 1 1 1 2 SER HA . 2 . HA 1 1
4 1 2 1 1 3 PRO QD . 3 . HD# 1 1
5 1 1 1 1 3 PRO HB3 . 3 . HB1 1 1
5 1 2 1 1 4 ASP H . 4 . HN 1 1
6 1 1 1 1 4 ASP HA . 4 . HA 1 1
6 1 2 1 1 7 LYS H . 7 . HN 1 1
7 1 1 1 1 5 PHE H . 5 . HN 1 1
7 1 2 1 1 6 ARG H . 6 . HN 1 1
8 1 1 1 1 5 PHE HA . 5 . HA 1 1
8 1 2 1 1 6 ARG H . 6 . HN 1 1
9 1 1 1 1 5 PHE HA . 5 . HA 1 1
9 1 2 1 1 8 ALA H . 8 . HN 1 1
10 1 1 1 1 5 PHE HA . 5 . HA 1 1
10 1 2 1 1 8 ALA MB . 8 . HB# 1 1
11 1 1 1 1 5 PHE QB . 5 . HB# 1 1
11 1 2 1 1 6 ARG H . 6 . HN 1 1
12 1 1 1 1 5 PHE QD . 5 . HD# 1 1
12 1 1 1 1 9 PHE QD . 9 . HD# 1 1
12 1 2 1 1 8 ALA MB . 8 . HB# 1 1
13 1 1 1 1 6 ARG H . 6 . HN 1 1
13 1 2 1 1 7 LYS H . 7 . HN 1 1
14 1 1 1 1 6 ARG HA . 6 . HA 1 1
14 1 2 1 1 7 LYS H . 7 . HN 1 1
15 1 1 1 1 7 LYS HA . 7 . HA 1 1
15 1 2 1 1 8 ALA H . 8 . HN 1 1
16 1 1 1 1 7 LYS HA . 7 . HA 1 1
16 1 2 1 1 10 LYS H . 10 . HN 1 1
17 1 1 1 1 7 LYS HA . 7 . HA 1 1
17 1 2 1 1 10 LYS HB3 . 10 . HB1 1 1
18 1 1 1 1 8 ALA H . 8 . HN 1 1
18 1 2 1 1 9 PHE H . 9 . HN 1 1
19 1 1 1 1 8 ALA HA . 8 . HA 1 1
19 1 2 1 1 9 PHE H . 9 . HN 1 1
20 1 1 1 1 8 ALA HA . 8 . HA 1 1
20 1 2 1 1 11 ARG H . 11 . HN 1 1
21 1 1 1 1 8 ALA HA . 8 . HA 1 1
21 1 2 1 1 11 ARG HB2 . 11 . HB2 1 1
22 1 1 1 1 8 ALA HA . 8 . HA 1 1
22 1 2 1 1 11 ARG HB3 . 11 . HB1 1 1
23 1 1 1 1 8 ALA HA . 8 . HA 1 1
23 1 2 1 1 12 LEU H . 12 . HN 1 1
24 1 1 1 1 8 ALA MB . 8 . HB# 1 1
24 1 2 1 1 9 PHE H . 9 . HN 1 1
25 1 1 1 1 9 PHE H . 9 . HN 1 1
25 1 2 1 1 10 LYS H . 10 . HN 1 1
26 1 1 1 1 9 PHE HA . 9 . HA 1 1
26 1 2 1 1 12 LEU H . 12 . HN 1 1
27 1 1 1 1 9 PHE QB . 9 . HB# 1 1
27 1 2 1 1 10 LYS H . 10 . HN 1 1
28 1 1 1 1 9 PHE QD . 9 . HD# 1 1
28 1 2 1 1 12 LEU QD . 12 . HD# 1 1
29 1 1 1 1 9 PHE QD . 9 . HD# 1 1
29 1 2 1 1 13 LEU QD . 13 . HD# 1 1
30 1 1 1 1 9 PHE QE . 9 . HE# 1 1
30 1 1 1 1 15 PHE QD . 15 . HD# 1 1
30 1 2 1 1 12 LEU QD . 12 . HD# 1 1
31 1 1 1 1 10 LYS H . 10 . HN 1 1
31 1 2 1 1 11 ARG H . 11 . HN 1 1
32 1 1 1 1 10 LYS HA . 10 . HA 1 1
32 1 2 1 1 11 ARG H . 11 . HN 1 1
33 1 1 1 1 10 LYS HA . 10 . HA 1 1
33 1 2 1 1 13 LEU QD . 13 . HD# 1 1
34 1 1 1 1 11 ARG H . 11 . HN 1 1
34 1 2 1 1 12 LEU H . 12 . HN 1 1
35 1 1 1 1 11 ARG HB2 . 11 . HB2 1 1
35 1 2 1 1 12 LEU H . 12 . HN 1 1
36 1 1 1 1 12 LEU H . 12 . HN 1 1
36 1 2 1 1 13 LEU H . 13 . HN 1 1
37 1 1 1 1 12 LEU HA . 12 . HA 1 1
37 1 2 1 1 13 LEU H . 13 . HN 1 1
38 1 1 1 1 12 LEU HA . 12 . HA 1 1
38 1 2 1 1 15 PHE H . 15 . HN 1 1
39 1 1 1 1 12 LEU HA . 12 . HA 1 1
39 1 2 1 1 15 PHE HB3 . 15 . HB1 1 1
40 1 1 1 1 12 LEU QB . 12 . HB# 1 1
40 1 2 1 1 13 LEU H . 13 . HN 1 1
41 1 1 1 1 12 LEU HG . 12 . HG# 1 1
41 1 2 1 1 13 LEU H . 13 . HN 1 1
42 1 1 1 1 13 LEU H . 13 . HN 1 1
42 1 2 1 1 14 CYS H . 14 . HN 1 1
43 1 1 1 1 13 LEU HA . 13 . HA 1 1
43 1 2 1 1 14 CYS H . 14 . HN 1 1
44 1 1 1 1 13 LEU HG . 13 . HG# 1 1
44 1 2 1 1 15 PHE H . 15 . HN 1 1
45 1 1 1 1 14 CYS H . 14 . HN 1 1
45 1 2 1 1 15 PHE H . 15 . HN 1 1
46 1 1 1 1 14 CYS HA . 14 . HA 1 1
46 1 2 1 1 15 PHE H . 15 . HN 1 1
47 1 1 1 1 14 CYS HB3 . 14 . HB1 1 1
47 1 2 1 1 15 PHE H . 15 . 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 . . . . . 5.0 1.8 7.5 1 1
2 1 . . . . . 5.0 1.8 5.5 1 1
3 1 . . . . . 5.0 1.8 6.5 1 1
4 1 . . . . . 2.8 1.8 4.3 1 1
5 1 . . . . . 5.0 1.8 5.5 1 1
6 1 . . . . . 3.8 1.8 4.3 1 1
7 1 . . . . . 3.8 1.8 4.3 1 1
8 1 . . . . . 5.0 1.8 5.5 1 1
9 1 . . . . . 5.0 1.8 5.5 1 1
10 1 . . . . . 3.8 1.8 5.3 1 1
11 1 . . . . . 5.0 1.8 6.5 1 1
12 1 . . . . . 3.8 1.8 6.3 1 1
13 1 . . . . . 3.8 1.8 4.3 1 1
14 1 . . . . . 3.8 1.8 4.3 1 1
15 1 . . . . . 5.0 1.8 5.5 1 1
16 1 . . . . . 5.0 1.8 5.5 1 1
17 1 . . . . . 3.8 1.8 4.3 1 1
18 1 . . . . . 3.8 1.8 4.3 1 1
19 1 . . . . . 5.0 1.8 5.5 1 1
20 1 . . . . . 3.8 1.8 4.3 1 1
21 1 . . . . . 3.8 1.8 4.3 1 1
22 1 . . . . . 3.8 1.8 4.3 1 1
23 1 . . . . . 3.8 1.8 4.3 1 1
24 1 . . . . . 2.8 1.8 4.3 1 1
25 1 . . . . . 3.8 1.8 4.3 1 1
26 1 . . . . . 3.8 1.8 4.3 1 1
27 1 . . . . . 3.8 1.8 5.3 1 1
28 1 . . . . . 3.8 1.8 6.3 1 1
29 1 . . . . . 2.8 1.8 5.3 1 1
30 1 . . . . . 5.0 1.8 7.5 1 1
31 1 . . . . . 3.8 1.8 4.3 1 1
32 1 . . . . . 5.0 1.8 5.5 1 1
33 1 . . . . . 5.0 1.8 6.5 1 1
34 1 . . . . . 3.8 1.8 4.3 1 1
35 1 . . . . . 5.0 1.8 5.5 1 1
36 1 . . . . . 3.8 1.8 4.3 1 1
37 1 . . . . . 5.0 1.8 5.5 1 1
38 1 . . . . . 3.8 1.8 4.3 1 1
39 1 . . . . . 5.0 1.8 5.5 1 1
40 1 . . . . . 5.0 1.8 6.5 1 1
41 1 . . . . . 3.8 1.8 5.3 1 1
42 1 . . . . . 3.8 1.8 4.3 1 1
43 1 . . . . . 3.8 1.8 4.3 1 1
44 1 . . . . . 5.0 1.8 6.5 1 1
45 1 . . . . . 3.8 1.8 4.3 1 1
46 1 . . . . . 3.8 1.8 4.3 1 1
47 1 . . . . . 3.8 1.8 4.3 1 1
stop_
save_
save_CNS/XPLOR_dihedral_4
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID 1
_Torsion_angle_constraint_list.ID 1
_Torsion_angle_constraint_list.Constraint_file_ID .
_Torsion_angle_constraint_list.Block_ID .
loop_
_Torsion_angle_constraint.ID
_Torsion_angle_constraint.Torsion_angle_name
_Torsion_angle_constraint.Entity_assembly_ID_1
_Torsion_angle_constraint.Entity_ID_1
_Torsion_angle_constraint.Comp_index_ID_1
_Torsion_angle_constraint.Comp_ID_1
_Torsion_angle_constraint.Atom_ID_1
_Torsion_angle_constraint.Entity_assembly_ID_2
_Torsion_angle_constraint.Entity_ID_2
_Torsion_angle_constraint.Comp_index_ID_2
_Torsion_angle_constraint.Comp_ID_2
_Torsion_angle_constraint.Atom_ID_2
_Torsion_angle_constraint.Entity_assembly_ID_3
_Torsion_angle_constraint.Entity_ID_3
_Torsion_angle_constraint.Comp_index_ID_3
_Torsion_angle_constraint.Comp_ID_3
_Torsion_angle_constraint.Atom_ID_3
_Torsion_angle_constraint.Entity_assembly_ID_4
_Torsion_angle_constraint.Entity_ID_4
_Torsion_angle_constraint.Comp_index_ID_4
_Torsion_angle_constraint.Comp_ID_4
_Torsion_angle_constraint.Atom_ID_4
_Torsion_angle_constraint.Angle_lower_bound_val
_Torsion_angle_constraint.Angle_upper_bound_val
_Torsion_angle_constraint.Auth_asym_ID_1
_Torsion_angle_constraint.Auth_seq_ID_1
_Torsion_angle_constraint.Auth_comp_ID_1
_Torsion_angle_constraint.Auth_atom_ID_1
_Torsion_angle_constraint.Auth_asym_ID_2
_Torsion_angle_constraint.Auth_seq_ID_2
_Torsion_angle_constraint.Auth_comp_ID_2
_Torsion_angle_constraint.Auth_atom_ID_2
_Torsion_angle_constraint.Auth_asym_ID_3
_Torsion_angle_constraint.Auth_seq_ID_3
_Torsion_angle_constraint.Auth_comp_ID_3
_Torsion_angle_constraint.Auth_atom_ID_3
_Torsion_angle_constraint.Auth_asym_ID_4
_Torsion_angle_constraint.Auth_seq_ID_4
_Torsion_angle_constraint.Auth_comp_ID_4
_Torsion_angle_constraint.Auth_atom_ID_4
_Torsion_angle_constraint.Entry_ID
_Torsion_angle_constraint.Torsion_angle_constraint_list_ID
1 . 1 1 3 PRO C 1 1 4 ASP CA 1 1 4 ASP N 1 1 4 ASP C -69.1 -49.099995 . 3 . C . 4 . CA . 4 . N . 4 . C 1 1
2 . 1 1 4 ASP C 1 1 5 PHE CA 1 1 5 PHE N 1 1 5 PHE C -66.7 -46.7 . 4 . C . 5 . CA . 5 . N . 5 . C 1 1
3 . 1 1 5 PHE C 1 1 6 ARG CA 1 1 6 ARG N 1 1 6 ARG C -69.1 -49.099995 . 5 . C . 6 . CA . 6 . N . 6 . C 1 1
4 . 1 1 6 ARG C 1 1 7 LYS CA 1 1 7 LYS N 1 1 7 LYS C -66.7 -46.7 . 6 . C . 7 . CA . 7 . N . 7 . C 1 1
5 . 1 1 7 LYS C 1 1 8 ALA CA 1 1 8 ALA N 1 1 8 ALA C -67.5 -47.5 . 7 . C . 8 . CA . 8 . N . 8 . C 1 1
6 . 1 1 8 ALA C 1 1 9 PHE CA 1 1 9 PHE N 1 1 9 PHE C -66.7 -46.7 . 8 . C . 9 . CA . 9 . N . 9 . C 1 1
7 . 1 1 9 PHE C 1 1 10 LYS CA 1 1 10 LYS N 1 1 10 LYS C -68.3 -48.3 . 9 . C . 10 . CA . 10 . N . 10 . C 1 1
8 . 1 1 10 LYS C 1 1 11 ARG CA 1 1 11 ARG N 1 1 11 ARG C -67.5 -47.5 . 10 . C . 11 . CA . 11 . N . 11 . C 1 1
9 . 1 1 11 ARG C 1 1 12 LEU CA 1 1 12 LEU N 1 1 12 LEU C -67.5 -47.5 . 11 . C . 12 . CA . 12 . N . 12 . C 1 1
10 . 1 1 12 LEU C 1 1 13 LEU CA 1 1 13 LEU N 1 1 13 LEU C -67.5 -47.5 . 12 . C . 13 . CA . 13 . N . 13 . C 1 1
11 . 1 1 13 LEU C 1 1 14 CYS CA 1 1 14 CYS N 1 1 14 CYS C -68.3 -48.3 . 13 . C . 14 . CA . 14 . N . 14 . C 1 1
12 . 1 1 14 CYS C 1 1 15 PHE CA 1 1 15 PHE N 1 1 15 PHE C -68.3 -48.3 . 14 . C . 15 . CA . 15 . N . 15 . C 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 ARG C C 16.929 -5.883 12.229 1.00 . A A . 1 ARG C 1 1
1 2 1 1 1 ARG CA C 18.147 -5.524 13.067 1.00 . A A . 1 ARG CA 1 1
1 3 1 1 1 ARG CB C 18.479 -4.019 12.908 1.00 . A A . 1 ARG CB 1 1
1 4 1 1 1 ARG CD C 19.650 -3.542 15.279 1.00 . A A . 1 ARG CD 1 1
1 5 1 1 1 ARG CG C 18.600 -3.138 14.202 1.00 . A A . 1 ARG CG 1 1
1 6 1 1 1 ARG CZ C 18.242 -4.879 16.787 1.00 . A A . 1 ARG CZ 1 1
1 7 1 1 1 ARG H1 H 19.505 -6.303 11.723 1.00 . A A . 1 ARG H1 1 1
1 8 1 1 1 ARG H2 H 20.155 -5.963 13.255 1.00 . A A . 1 ARG H2 1 1
1 9 1 1 1 ARG H3 H 19.160 -7.322 13.037 1.00 . A A . 1 ARG H3 1 1
1 10 1 1 1 ARG HA H 17.941 -5.737 14.106 1.00 . A A . 1 ARG HA 1 1
1 11 1 1 1 ARG HB2 H 19.423 -3.955 12.390 1.00 . A A . 1 ARG HB2 1 1
1 12 1 1 1 ARG HB3 H 17.702 -3.584 12.299 1.00 . A A . 1 ARG HB3 1 1
1 13 1 1 1 ARG HD2 H 20.624 -3.669 14.830 1.00 . A A . 1 ARG HD2 1 1
1 14 1 1 1 ARG HD3 H 19.706 -2.792 16.053 1.00 . A A . 1 ARG HD3 1 1
1 15 1 1 1 ARG HE H 19.541 -5.648 15.478 1.00 . A A . 1 ARG HE 1 1
1 16 1 1 1 ARG HG2 H 18.841 -2.136 13.883 1.00 . A A . 1 ARG HG2 1 1
1 17 1 1 1 ARG HG3 H 17.634 -3.143 14.682 1.00 . A A . 1 ARG HG3 1 1
1 18 1 1 1 ARG HH11 H 18.038 -2.867 16.993 1.00 . A A . 1 ARG HH11 1 1
1 19 1 1 1 ARG HH12 H 17.012 -3.821 18.012 1.00 . A A . 1 ARG HH12 1 1
1 20 1 1 1 ARG HH21 H 17.592 -6.605 15.964 1.00 . A A . 1 ARG HH21 1 1
1 21 1 1 1 ARG HH22 H 16.702 -6.060 17.346 1.00 . A A . 1 ARG HH22 1 1
1 22 1 1 1 ARG N N 19.328 -6.337 12.747 1.00 . A A . 1 ARG N 1 1
1 23 1 1 1 ARG NE N 19.168 -4.813 15.829 1.00 . A A . 1 ARG NE 1 1
1 24 1 1 1 ARG NH1 N 17.720 -3.761 17.308 1.00 . A A . 1 ARG NH1 1 1
1 25 1 1 1 ARG NH2 N 17.447 -5.934 16.691 1.00 . A A . 1 ARG NH2 1 1
1 26 1 1 1 ARG O O 17.033 -6.751 11.317 1.00 . A A . 1 ARG O 1 1
1 27 1 1 2 SER C C 13.966 -4.159 11.078 1.00 . A A . 2 SER C 1 1
1 28 1 1 2 SER CA C 14.601 -5.412 11.696 1.00 . A A . 2 SER CA 1 1
1 29 1 1 2 SER CB C 13.561 -6.239 12.460 1.00 . A A . 2 SER CB 1 1
1 30 1 1 2 SER H H 15.815 -4.570 13.241 1.00 . A A . 2 SER H 1 1
1 31 1 1 2 SER HA H 14.861 -5.929 10.784 1.00 . A A . 2 SER HA 1 1
1 32 1 1 2 SER HB2 H 12.748 -6.487 11.794 1.00 . A A . 2 SER HB2 1 1
1 33 1 1 2 SER HB3 H 14.024 -7.147 12.816 1.00 . A A . 2 SER HB3 1 1
1 34 1 1 2 SER HG H 12.507 -4.779 13.247 1.00 . A A . 2 SER HG 1 1
1 35 1 1 2 SER N N 15.823 -5.210 12.499 1.00 . A A . 2 SER N 1 1
1 36 1 1 2 SER O O 12.918 -3.661 11.565 1.00 . A A . 2 SER O 1 1
1 37 1 1 2 SER OG O 13.040 -5.502 13.586 1.00 . A A . 2 SER OG 1 1
1 38 1 1 3 PRO C C 12.970 -2.524 8.638 1.00 . A A . 3 PRO C 1 1
1 39 1 1 3 PRO CA C 14.205 -2.321 9.503 1.00 . A A . 3 PRO CA 1 1
1 40 1 1 3 PRO CB C 15.331 -1.815 8.592 1.00 . A A . 3 PRO CB 1 1
1 41 1 1 3 PRO CD C 15.895 -4.057 9.455 1.00 . A A . 3 PRO CD 1 1
1 42 1 1 3 PRO CG C 16.390 -2.922 8.545 1.00 . A A . 3 PRO CG 1 1
1 43 1 1 3 PRO HA H 14.013 -1.601 10.285 1.00 . A A . 3 PRO HA 1 1
1 44 1 1 3 PRO HB2 H 14.949 -1.622 7.600 1.00 . A A . 3 PRO HB2 1 1
1 45 1 1 3 PRO HB3 H 15.757 -0.909 8.996 1.00 . A A . 3 PRO HB3 1 1
1 46 1 1 3 PRO HD2 H 15.706 -4.945 8.870 1.00 . A A . 3 PRO HD2 1 1
1 47 1 1 3 PRO HD3 H 16.635 -4.275 10.210 1.00 . A A . 3 PRO HD3 1 1
1 48 1 1 3 PRO HG2 H 16.506 -3.282 7.533 1.00 . A A . 3 PRO HG2 1 1
1 49 1 1 3 PRO HG3 H 17.336 -2.545 8.903 1.00 . A A . 3 PRO HG3 1 1
1 50 1 1 3 PRO N N 14.643 -3.594 10.092 1.00 . A A . 3 PRO N 1 1
1 51 1 1 3 PRO O O 12.077 -1.631 8.621 1.00 . A A . 3 PRO O 1 1
1 52 1 1 4 ASP C C 10.555 -4.091 7.719 1.00 . A A . 4 ASP C 1 1
1 53 1 1 4 ASP CA C 11.883 -3.997 6.994 1.00 . A A . 4 ASP CA 1 1
1 54 1 1 4 ASP CB C 12.146 -5.328 6.270 1.00 . A A . 4 ASP CB 1 1
1 55 1 1 4 ASP CG C 13.098 -5.073 5.103 1.00 . A A . 4 ASP CG 1 1
1 56 1 1 4 ASP H H 13.734 -4.241 7.983 1.00 . A A . 4 ASP H 1 1
1 57 1 1 4 ASP HA H 11.775 -3.216 6.256 1.00 . A A . 4 ASP HA 1 1
1 58 1 1 4 ASP HB2 H 12.593 -6.033 6.956 1.00 . A A . 4 ASP HB2 1 1
1 59 1 1 4 ASP HB3 H 11.215 -5.729 5.898 1.00 . A A . 4 ASP HB3 1 1
1 60 1 1 4 ASP N N 12.969 -3.634 7.907 1.00 . A A . 4 ASP N 1 1
1 61 1 1 4 ASP O O 9.548 -3.528 7.218 1.00 . A A . 4 ASP O 1 1
1 62 1 1 4 ASP OD1 O 14.209 -4.508 5.296 1.00 . A A . 4 ASP OD1 1 1
1 63 1 1 4 ASP OD2 O 12.746 -5.366 3.922 1.00 . A A . 4 ASP OD2 1 1
1 64 1 1 5 PHE C C 8.828 -3.530 10.136 1.00 . A A . 5 PHE C 1 1
1 65 1 1 5 PHE CA C 9.378 -4.870 9.695 1.00 . A A . 5 PHE CA 1 1
1 66 1 1 5 PHE CB C 9.628 -5.748 10.928 1.00 . A A . 5 PHE CB 1 1
1 67 1 1 5 PHE CD1 C 9.158 -7.789 9.513 1.00 . A A . 5 PHE CD1 1 1
1 68 1 1 5 PHE CD2 C 10.930 -7.895 11.105 1.00 . A A . 5 PHE CD2 1 1
1 69 1 1 5 PHE CE1 C 9.429 -9.092 9.122 1.00 . A A . 5 PHE CE1 1 1
1 70 1 1 5 PHE CE2 C 11.209 -9.193 10.717 1.00 . A A . 5 PHE CE2 1 1
1 71 1 1 5 PHE CG C 9.911 -7.192 10.504 1.00 . A A . 5 PHE CG 1 1
1 72 1 1 5 PHE CZ C 10.459 -9.795 9.725 1.00 . A A . 5 PHE CZ 1 1
1 73 1 1 5 PHE H H 11.441 -5.070 9.204 1.00 . A A . 5 PHE H 1 1
1 74 1 1 5 PHE HA H 8.609 -5.328 9.091 1.00 . A A . 5 PHE HA 1 1
1 75 1 1 5 PHE HB2 H 10.478 -5.364 11.473 1.00 . A A . 5 PHE HB2 1 1
1 76 1 1 5 PHE HB3 H 8.755 -5.728 11.563 1.00 . A A . 5 PHE HB3 1 1
1 77 1 1 5 PHE HD1 H 8.356 -7.240 9.041 1.00 . A A . 5 PHE HD1 1 1
1 78 1 1 5 PHE HD2 H 11.516 -7.430 11.884 1.00 . A A . 5 PHE HD2 1 1
1 79 1 1 5 PHE HE1 H 8.837 -9.558 8.348 1.00 . A A . 5 PHE HE1 1 1
1 80 1 1 5 PHE HE2 H 12.014 -9.736 11.190 1.00 . A A . 5 PHE HE2 1 1
1 81 1 1 5 PHE HZ H 10.675 -10.809 9.421 1.00 . A A . 5 PHE HZ 1 1
1 82 1 1 5 PHE N N 10.590 -4.709 8.878 1.00 . A A . 5 PHE N 1 1
1 83 1 1 5 PHE O O 7.598 -3.300 9.977 1.00 . A A . 5 PHE O 1 1
1 84 1 1 6 ARG C C 8.735 -0.563 9.769 1.00 . A A . 6 ARG C 1 1
1 85 1 1 6 ARG CA C 9.327 -1.313 10.937 1.00 . A A . 6 ARG CA 1 1
1 86 1 1 6 ARG CB C 10.478 -0.459 11.451 1.00 . A A . 6 ARG CB 1 1
1 87 1 1 6 ARG CD C 11.957 0.167 13.331 1.00 . A A . 6 ARG CD 1 1
1 88 1 1 6 ARG CG C 10.849 -0.795 12.896 1.00 . A A . 6 ARG CG 1 1
1 89 1 1 6 ARG CZ C 12.096 2.494 14.159 1.00 . A A . 6 ARG CZ 1 1
1 90 1 1 6 ARG H H 10.677 -2.917 10.568 1.00 . A A . 6 ARG H 1 1
1 91 1 1 6 ARG HA H 8.588 -1.397 11.720 1.00 . A A . 6 ARG HA 1 1
1 92 1 1 6 ARG HB2 H 11.341 -0.625 10.823 1.00 . A A . 6 ARG HB2 1 1
1 93 1 1 6 ARG HB3 H 10.190 0.580 11.399 1.00 . A A . 6 ARG HB3 1 1
1 94 1 1 6 ARG HD2 H 12.568 -0.310 14.083 1.00 . A A . 6 ARG HD2 1 1
1 95 1 1 6 ARG HD3 H 12.568 0.417 12.476 1.00 . A A . 6 ARG HD3 1 1
1 96 1 1 6 ARG HE H 10.411 1.424 14.072 1.00 . A A . 6 ARG HE 1 1
1 97 1 1 6 ARG HG2 H 9.986 -0.674 13.534 1.00 . A A . 6 ARG HG2 1 1
1 98 1 1 6 ARG HG3 H 11.202 -1.814 12.957 1.00 . A A . 6 ARG HG3 1 1
1 99 1 1 6 ARG HH11 H 13.917 2.514 13.260 1.00 . A A . 6 ARG HH11 1 1
1 100 1 1 6 ARG HH12 H 13.939 2.221 14.967 1.00 . A A . 6 ARG HH12 1 1
1 101 1 1 6 ARG HH21 H 11.339 2.956 15.971 1.00 . A A . 6 ARG HH21 1 1
1 102 1 1 6 ARG HH22 H 11.339 4.245 14.814 1.00 . A A . 6 ARG HH22 1 1
1 103 1 1 6 ARG N N 9.732 -2.661 10.537 1.00 . A A . 6 ARG N 1 1
1 104 1 1 6 ARG NE N 11.373 1.403 13.890 1.00 . A A . 6 ARG NE 1 1
1 105 1 1 6 ARG NH1 N 13.429 2.402 14.126 1.00 . A A . 6 ARG NH1 1 1
1 106 1 1 6 ARG NH2 N 11.547 3.297 15.054 1.00 . A A . 6 ARG NH2 1 1
1 107 1 1 6 ARG O O 7.690 0.112 9.959 1.00 . A A . 6 ARG O 1 1
1 108 1 1 7 LYS C C 7.515 -0.615 7.051 1.00 . A A . 7 LYS C 1 1
1 109 1 1 7 LYS CA C 8.891 -0.112 7.414 1.00 . A A . 7 LYS CA 1 1
1 110 1 1 7 LYS CB C 9.777 -0.333 6.189 1.00 . A A . 7 LYS CB 1 1
1 111 1 1 7 LYS CD C 11.152 1.823 6.288 1.00 . A A . 7 LYS CD 1 1
1 112 1 1 7 LYS CE C 12.474 1.935 5.502 1.00 . A A . 7 LYS CE 1 1
1 113 1 1 7 LYS CG C 10.089 1.014 5.511 1.00 . A A . 7 LYS CG 1 1
1 114 1 1 7 LYS H H 10.153 -1.336 8.596 1.00 . A A . 7 LYS H 1 1
1 115 1 1 7 LYS HA H 8.831 0.950 7.598 1.00 . A A . 7 LYS HA 1 1
1 116 1 1 7 LYS HB2 H 10.701 -0.801 6.496 1.00 . A A . 7 LYS HB2 1 1
1 117 1 1 7 LYS HB3 H 9.264 -0.975 5.488 1.00 . A A . 7 LYS HB3 1 1
1 118 1 1 7 LYS HD2 H 10.770 2.816 6.472 1.00 . A A . 7 LYS HD2 1 1
1 119 1 1 7 LYS HD3 H 11.346 1.332 7.230 1.00 . A A . 7 LYS HD3 1 1
1 120 1 1 7 LYS HE2 H 12.295 1.659 4.473 1.00 . A A . 7 LYS HE2 1 1
1 121 1 1 7 LYS HE3 H 12.822 2.956 5.545 1.00 . A A . 7 LYS HE3 1 1
1 122 1 1 7 LYS HG2 H 10.456 0.825 4.513 1.00 . A A . 7 LYS HG2 1 1
1 123 1 1 7 LYS HG3 H 9.180 1.595 5.456 1.00 . A A . 7 LYS HG3 1 1
1 124 1 1 7 LYS HZ1 H 13.097 0.121 6.252 1.00 . A A . 7 LYS HZ1 1 1
1 125 1 1 7 LYS HZ2 H 14.283 0.960 5.373 1.00 . A A . 7 LYS HZ2 1 1
1 126 1 1 7 LYS HZ3 H 13.871 1.466 6.941 1.00 . A A . 7 LYS HZ3 1 1
1 127 1 1 7 LYS N N 9.364 -0.756 8.627 1.00 . A A . 7 LYS N 1 1
1 128 1 1 7 LYS NZ N 13.506 1.057 6.057 1.00 . A A . 7 LYS NZ 1 1
1 129 1 1 7 LYS O O 6.701 0.210 6.599 1.00 . A A . 7 LYS O 1 1
1 130 1 1 8 ALA C C 5.031 -1.986 7.881 1.00 . A A . 8 ALA C 1 1
1 131 1 1 8 ALA CA C 6.039 -2.491 6.873 1.00 . A A . 8 ALA CA 1 1
1 132 1 1 8 ALA CB C 5.989 -4.025 6.903 1.00 . A A . 8 ALA CB 1 1
1 133 1 1 8 ALA H H 8.077 -2.482 7.463 1.00 . A A . 8 ALA H 1 1
1 134 1 1 8 ALA HA H 5.747 -2.167 5.886 1.00 . A A . 8 ALA HA 1 1
1 135 1 1 8 ALA HB1 H 6.325 -4.377 7.867 1.00 . A A . 8 ALA HB1 1 1
1 136 1 1 8 ALA HB2 H 4.975 -4.356 6.733 1.00 . A A . 8 ALA HB2 1 1
1 137 1 1 8 ALA HB3 H 6.631 -4.422 6.131 1.00 . A A . 8 ALA HB3 1 1
1 138 1 1 8 ALA N N 7.337 -1.909 7.172 1.00 . A A . 8 ALA N 1 1
1 139 1 1 8 ALA O O 3.996 -1.497 7.425 1.00 . A A . 8 ALA O 1 1
1 140 1 1 9 PHE C C 4.149 0.224 9.667 1.00 . A A . 9 PHE C 1 1
1 141 1 1 9 PHE CA C 4.475 -1.214 10.057 1.00 . A A . 9 PHE CA 1 1
1 142 1 1 9 PHE CB C 4.969 -1.262 11.509 1.00 . A A . 9 PHE CB 1 1
1 143 1 1 9 PHE CD1 C 2.583 -1.134 12.368 1.00 . A A . 9 PHE CD1 1 1
1 144 1 1 9 PHE CD2 C 4.231 0.274 13.370 1.00 . A A . 9 PHE CD2 1 1
1 145 1 1 9 PHE CE1 C 1.621 -0.618 13.220 1.00 . A A . 9 PHE CE1 1 1
1 146 1 1 9 PHE CE2 C 3.276 0.788 14.226 1.00 . A A . 9 PHE CE2 1 1
1 147 1 1 9 PHE CG C 3.891 -0.689 12.444 1.00 . A A . 9 PHE CG 1 1
1 148 1 1 9 PHE CZ C 1.971 0.342 14.152 1.00 . A A . 9 PHE CZ 1 1
1 149 1 1 9 PHE H H 6.288 -2.157 9.416 1.00 . A A . 9 PHE H 1 1
1 150 1 1 9 PHE HA H 3.526 -1.725 9.998 1.00 . A A . 9 PHE HA 1 1
1 151 1 1 9 PHE HB2 H 5.175 -2.286 11.784 1.00 . A A . 9 PHE HB2 1 1
1 152 1 1 9 PHE HB3 H 5.872 -0.676 11.601 1.00 . A A . 9 PHE HB3 1 1
1 153 1 1 9 PHE HD1 H 2.312 -1.886 11.642 1.00 . A A . 9 PHE HD1 1 1
1 154 1 1 9 PHE HD2 H 5.250 0.629 13.427 1.00 . A A . 9 PHE HD2 1 1
1 155 1 1 9 PHE HE1 H 0.600 -0.964 13.157 1.00 . A A . 9 PHE HE1 1 1
1 156 1 1 9 PHE HE2 H 3.550 1.538 14.953 1.00 . A A . 9 PHE HE2 1 1
1 157 1 1 9 PHE HZ H 1.224 0.743 14.822 1.00 . A A . 9 PHE HZ 1 1
1 158 1 1 9 PHE N N 5.407 -1.847 9.119 1.00 . A A . 9 PHE N 1 1
1 159 1 1 9 PHE O O 2.954 0.543 9.451 1.00 . A A . 9 PHE O 1 1
1 160 1 1 10 LYS C C 4.077 2.252 7.403 1.00 . A A . 10 LYS C 1 1
1 161 1 1 10 LYS CA C 4.995 2.246 8.622 1.00 . A A . 10 LYS CA 1 1
1 162 1 1 10 LYS CB C 6.366 2.838 8.268 1.00 . A A . 10 LYS CB 1 1
1 163 1 1 10 LYS CD C 5.896 5.309 8.829 1.00 . A A . 10 LYS CD 1 1
1 164 1 1 10 LYS CE C 5.835 6.734 8.254 1.00 . A A . 10 LYS CE 1 1
1 165 1 1 10 LYS CG C 6.236 4.280 7.730 1.00 . A A . 10 LYS CG 1 1
1 166 1 1 10 LYS H H 6.061 0.521 9.254 1.00 . A A . 10 LYS H 1 1
1 167 1 1 10 LYS HA H 4.500 2.889 9.335 1.00 . A A . 10 LYS HA 1 1
1 168 1 1 10 LYS HB2 H 6.984 2.848 9.154 1.00 . A A . 10 LYS HB2 1 1
1 169 1 1 10 LYS HB3 H 6.830 2.222 7.513 1.00 . A A . 10 LYS HB3 1 1
1 170 1 1 10 LYS HD2 H 4.937 5.061 9.260 1.00 . A A . 10 LYS HD2 1 1
1 171 1 1 10 LYS HD3 H 6.656 5.270 9.596 1.00 . A A . 10 LYS HD3 1 1
1 172 1 1 10 LYS HE2 H 6.498 6.807 7.405 1.00 . A A . 10 LYS HE2 1 1
1 173 1 1 10 LYS HE3 H 4.825 6.951 7.941 1.00 . A A . 10 LYS HE3 1 1
1 174 1 1 10 LYS HG2 H 7.173 4.562 7.273 1.00 . A A . 10 LYS HG2 1 1
1 175 1 1 10 LYS HG3 H 5.453 4.300 6.987 1.00 . A A . 10 LYS HG3 1 1
1 176 1 1 10 LYS HZ1 H 5.621 7.615 10.102 1.00 . A A . 10 LYS HZ1 1 1
1 177 1 1 10 LYS HZ2 H 7.227 7.507 9.559 1.00 . A A . 10 LYS HZ2 1 1
1 178 1 1 10 LYS HZ3 H 6.178 8.662 8.887 1.00 . A A . 10 LYS HZ3 1 1
1 179 1 1 10 LYS N N 5.163 0.910 9.207 1.00 . A A . 10 LYS N 1 1
1 180 1 1 10 LYS NZ N 6.245 7.699 9.274 1.00 . A A . 10 LYS NZ 1 1
1 181 1 1 10 LYS O O 3.088 3.033 7.365 1.00 . A A . 10 LYS O 1 1
1 182 1 1 11 ARG C C 2.109 0.672 5.617 1.00 . A A . 11 ARG C 1 1
1 183 1 1 11 ARG CA C 3.563 1.001 5.334 1.00 . A A . 11 ARG CA 1 1
1 184 1 1 11 ARG CB C 4.264 -0.132 4.551 1.00 . A A . 11 ARG CB 1 1
1 185 1 1 11 ARG CD C 4.282 -1.323 2.236 1.00 . A A . 11 ARG CD 1 1
1 186 1 1 11 ARG CG C 3.474 -0.546 3.289 1.00 . A A . 11 ARG CG 1 1
1 187 1 1 11 ARG CZ C 3.516 -0.660 -0.015 1.00 . A A . 11 ARG CZ 1 1
1 188 1 1 11 ARG H H 5.017 0.660 6.796 1.00 . A A . 11 ARG H 1 1
1 189 1 1 11 ARG HA H 3.538 1.894 4.727 1.00 . A A . 11 ARG HA 1 1
1 190 1 1 11 ARG HB2 H 5.245 0.207 4.252 1.00 . A A . 11 ARG HB2 1 1
1 191 1 1 11 ARG HB3 H 4.363 -0.992 5.197 1.00 . A A . 11 ARG HB3 1 1
1 192 1 1 11 ARG HD2 H 5.306 -1.462 2.546 1.00 . A A . 11 ARG HD2 1 1
1 193 1 1 11 ARG HD3 H 3.836 -2.282 2.023 1.00 . A A . 11 ARG HD3 1 1
1 194 1 1 11 ARG HE H 4.663 0.429 1.154 1.00 . A A . 11 ARG HE 1 1
1 195 1 1 11 ARG HG2 H 2.648 -1.167 3.601 1.00 . A A . 11 ARG HG2 1 1
1 196 1 1 11 ARG HG3 H 3.095 0.351 2.823 1.00 . A A . 11 ARG HG3 1 1
1 197 1 1 11 ARG HH11 H 2.748 -2.404 0.664 1.00 . A A . 11 ARG HH11 1 1
1 198 1 1 11 ARG HH12 H 2.255 -1.948 -0.933 1.00 . A A . 11 ARG HH12 1 1
1 199 1 1 11 ARG HH21 H 3.404 1.328 -0.349 1.00 . A A . 11 ARG HH21 1 1
1 200 1 1 11 ARG HH22 H 2.575 0.333 -1.500 1.00 . A A . 11 ARG HH22 1 1
1 201 1 1 11 ARG N N 4.291 1.276 6.570 1.00 . A A . 11 ARG N 1 1
1 202 1 1 11 ARG NE N 4.187 -0.424 1.093 1.00 . A A . 11 ARG NE 1 1
1 203 1 1 11 ARG NH1 N 2.779 -1.761 -0.102 1.00 . A A . 11 ARG NH1 1 1
1 204 1 1 11 ARG NH2 N 3.134 0.422 -0.675 1.00 . A A . 11 ARG NH2 1 1
1 205 1 1 11 ARG O O 1.205 1.341 5.061 1.00 . A A . 11 ARG O 1 1
1 206 1 1 12 LEU C C -0.158 0.470 7.652 1.00 . A A . 12 LEU C 1 1
1 207 1 1 12 LEU CA C 0.665 -0.667 7.079 1.00 . A A . 12 LEU CA 1 1
1 208 1 1 12 LEU CB C 0.894 -1.763 8.136 1.00 . A A . 12 LEU CB 1 1
1 209 1 1 12 LEU CD1 C -0.470 -3.458 6.837 1.00 . A A . 12 LEU CD1 1 1
1 210 1 1 12 LEU CD2 C 2.052 -3.565 6.620 1.00 . A A . 12 LEU CD2 1 1
1 211 1 1 12 LEU CG C 0.867 -3.189 7.536 1.00 . A A . 12 LEU CG 1 1
1 212 1 1 12 LEU H H 2.747 -0.440 7.083 1.00 . A A . 12 LEU H 1 1
1 213 1 1 12 LEU HA H 0.120 -1.084 6.245 1.00 . A A . 12 LEU HA 1 1
1 214 1 1 12 LEU HB2 H 1.856 -1.601 8.598 1.00 . A A . 12 LEU HB2 1 1
1 215 1 1 12 LEU HB3 H 0.119 -1.689 8.884 1.00 . A A . 12 LEU HB3 1 1
1 216 1 1 12 LEU HD11 H -1.215 -2.770 7.208 1.00 . A A . 12 LEU HD11 1 1
1 217 1 1 12 LEU HD12 H -0.354 -3.322 5.772 1.00 . A A . 12 LEU HD12 1 1
1 218 1 1 12 LEU HD13 H -0.784 -4.471 7.039 1.00 . A A . 12 LEU HD13 1 1
1 219 1 1 12 LEU HD21 H 2.329 -2.711 6.020 1.00 . A A . 12 LEU HD21 1 1
1 220 1 1 12 LEU HD22 H 2.894 -3.867 7.226 1.00 . A A . 12 LEU HD22 1 1
1 221 1 1 12 LEU HD23 H 1.763 -4.381 5.974 1.00 . A A . 12 LEU HD23 1 1
1 222 1 1 12 LEU HG H 1.004 -3.910 8.329 1.00 . A A . 12 LEU HG 1 1
1 223 1 1 12 LEU N N 1.943 -0.146 6.608 1.00 . A A . 12 LEU N 1 1
1 224 1 1 12 LEU O O -1.357 0.607 7.290 1.00 . A A . 12 LEU O 1 1
1 225 1 1 13 LEU C C -0.606 3.448 7.861 1.00 . A A . 13 LEU C 1 1
1 226 1 1 13 LEU CA C -0.046 2.544 8.938 1.00 . A A . 13 LEU CA 1 1
1 227 1 1 13 LEU CB C 0.965 3.342 9.769 1.00 . A A . 13 LEU CB 1 1
1 228 1 1 13 LEU CD1 C 2.657 3.187 11.652 1.00 . A A . 13 LEU CD1 1 1
1 229 1 1 13 LEU CD2 C 0.219 2.362 11.992 1.00 . A A . 13 LEU CD2 1 1
1 230 1 1 13 LEU CG C 1.394 2.576 11.021 1.00 . A A . 13 LEU CG 1 1
1 231 1 1 13 LEU H H 1.503 1.176 8.482 1.00 . A A . 13 LEU H 1 1
1 232 1 1 13 LEU HA H -0.867 2.252 9.576 1.00 . A A . 13 LEU HA 1 1
1 233 1 1 13 LEU HB2 H 1.837 3.541 9.164 1.00 . A A . 13 LEU HB2 1 1
1 234 1 1 13 LEU HB3 H 0.514 4.277 10.067 1.00 . A A . 13 LEU HB3 1 1
1 235 1 1 13 LEU HD11 H 3.326 3.517 10.871 1.00 . A A . 13 LEU HD11 1 1
1 236 1 1 13 LEU HD12 H 2.380 4.030 12.268 1.00 . A A . 13 LEU HD12 1 1
1 237 1 1 13 LEU HD13 H 3.152 2.444 12.260 1.00 . A A . 13 LEU HD13 1 1
1 238 1 1 13 LEU HD21 H -0.479 3.181 11.899 1.00 . A A . 13 LEU HD21 1 1
1 239 1 1 13 LEU HD22 H -0.281 1.435 11.753 1.00 . A A . 13 LEU HD22 1 1
1 240 1 1 13 LEU HD23 H 0.591 2.320 13.005 1.00 . A A . 13 LEU HD23 1 1
1 241 1 1 13 LEU HG H 1.597 1.550 10.752 1.00 . A A . 13 LEU HG 1 1
1 242 1 1 13 LEU N N 0.546 1.341 8.351 1.00 . A A . 13 LEU N 1 1
1 243 1 1 13 LEU O O -1.771 3.905 8.005 1.00 . A A . 13 LEU O 1 1
1 244 1 1 14 CYS C C -1.570 3.881 4.972 1.00 . A A . 14 CYS C 1 1
1 245 1 1 14 CYS CA C -0.315 4.400 5.650 1.00 . A A . 14 CYS CA 1 1
1 246 1 1 14 CYS CB C 0.792 4.613 4.611 1.00 . A A . 14 CYS CB 1 1
1 247 1 1 14 CYS H H 0.966 3.056 6.699 1.00 . A A . 14 CYS H 1 1
1 248 1 1 14 CYS HA H -0.614 5.361 6.041 1.00 . A A . 14 CYS HA 1 1
1 249 1 1 14 CYS HB2 H 1.733 4.339 5.065 1.00 . A A . 14 CYS HB2 1 1
1 250 1 1 14 CYS HB3 H 0.593 3.962 3.773 1.00 . A A . 14 CYS HB3 1 1
1 251 1 1 14 CYS HG H 0.060 6.648 3.855 1.00 . A A . 14 CYS HG 1 1
1 252 1 1 14 CYS N N 0.123 3.551 6.768 1.00 . A A . 14 CYS N 1 1
1 253 1 1 14 CYS O O -2.523 4.673 4.737 1.00 . A A . 14 CYS O 1 1
1 254 1 1 14 CYS SG S 0.945 6.298 3.985 1.00 . A A . 14 CYS SG 1 1
1 255 1 1 15 PHE C C -4.034 2.015 5.158 1.00 . A A . 15 PHE C 1 1
1 256 1 1 15 PHE CA C -2.802 1.876 4.276 1.00 . A A . 15 PHE CA 1 1
1 257 1 1 15 PHE CB C -2.535 0.373 4.046 1.00 . A A . 15 PHE CB 1 1
1 258 1 1 15 PHE CD1 C -2.321 -0.030 1.559 1.00 . A A . 15 PHE CD1 1 1
1 259 1 1 15 PHE CD2 C -0.334 0.084 2.862 1.00 . A A . 15 PHE CD2 1 1
1 260 1 1 15 PHE CE1 C -1.556 -0.221 0.416 1.00 . A A . 15 PHE CE1 1 1
1 261 1 1 15 PHE CE2 C 0.429 -0.100 1.726 1.00 . A A . 15 PHE CE2 1 1
1 262 1 1 15 PHE CG C -1.702 0.126 2.779 1.00 . A A . 15 PHE CG 1 1
1 263 1 1 15 PHE CZ C -0.181 -0.251 0.502 1.00 . A A . 15 PHE CZ 1 1
1 264 1 1 15 PHE H H -0.841 2.036 5.094 1.00 . A A . 15 PHE H 1 1
1 265 1 1 15 PHE HA H -3.066 2.332 3.333 1.00 . A A . 15 PHE HA 1 1
1 266 1 1 15 PHE HB2 H -2.000 -0.021 4.898 1.00 . A A . 15 PHE HB2 1 1
1 267 1 1 15 PHE HB3 H -3.481 -0.138 3.947 1.00 . A A . 15 PHE HB3 1 1
1 268 1 1 15 PHE HD1 H -3.399 -0.004 1.491 1.00 . A A . 15 PHE HD1 1 1
1 269 1 1 15 PHE HD2 H 0.149 0.195 3.821 1.00 . A A . 15 PHE HD2 1 1
1 270 1 1 15 PHE HE1 H -2.039 -0.346 -0.542 1.00 . A A . 15 PHE HE1 1 1
1 271 1 1 15 PHE HE2 H 1.506 -0.125 1.798 1.00 . A A . 15 PHE HE2 1 1
1 272 1 1 15 PHE HZ H 0.415 -0.392 -0.387 1.00 . A A . 15 PHE HZ 1 1
1 273 1 1 15 PHE N N -1.618 2.569 4.827 1.00 . A A . 15 PHE N 1 1
1 274 1 1 15 PHE O O -5.111 2.428 4.651 1.00 . A A . 15 PHE O 1 1
1 275 1 1 15 PHE OXT O -3.939 1.928 6.409 1.00 . A A . 15 PHE OXT 1 1
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