NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
|
|
481839 |
1i6y   |
5201 | cing | 4-filtered-FRED | STAR | entry | full | 72 |
data_FRED_restraints_with_modified_coordinates_PDB_code_1i6y
# This FRED archive file contains, for PDB entry <1i6y>:
#
# - 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_1i6y
_Assembly.Sf_category assembly
_Assembly.Entry_ID 1
_Assembly.ID 1
_Assembly.Name 1i6y
_Assembly.Number_of_components 1
_Assembly.Organic_ligands .
_Assembly.Metal_ions .
_Assembly.Paramagnetic .
_Assembly.Thiol_state "all disulfide bound"
_Assembly.Molecular_mass 1337.53
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 $ION_SELECTIVE_LIGAND_A1 A . 1 1
stop_
save_
save_ION_SELECTIVE_LIGAND_A1
_Entity.Sf_category entity
_Entity.Entry_ID 1
_Entity.ID 1
_Entity.Name "ION SELECTIVE LIGAND A1"
_Entity.Type polymer
_Entity.Polymer_type polypeptide(L)
_Entity.Polymer_seq_one_letter_code XCRVVRGDYLDCX
_Entity.Number_of_monomers 13
loop_
_Entity_comp_index.ID
_Entity_comp_index.Comp_ID
_Entity_comp_index.Comp_label
_Entity_comp_index.Entry_ID
_Entity_comp_index.Entity_ID
1 ACE $ACE 1 1
2 CYS . 1 1
3 ARG . 1 1
4 VAL . 1 1
5 VAL . 1 1
6 ARG . 1 1
7 GLY . 1 1
8 ASP . 1 1
9 TYR . 1 1
10 LEU . 1 1
11 ASP . 1 1
12 CYS . 1 1
13 NH2 $NH2 1 1
stop_
loop_
_Entity_poly_seq.Mon_ID
_Entity_poly_seq.Num
_Entity_poly_seq.Comp_index_ID
_Entity_poly_seq.Entry_ID
_Entity_poly_seq.Entity_ID
ACE 1 1 1 1
CYS 2 2 1 1
ARG 3 3 1 1
VAL 4 4 1 1
VAL 5 5 1 1
ARG 6 6 1 1
GLY 7 7 1 1
ASP 8 8 1 1
TYR 9 9 1 1
LEU 10 10 1 1
ASP 11 11 1 1
CYS 12 12 1 1
NH2 13 13 1 1
stop_
save_
save_ACE
_Chem_comp.Sf_category chem_comp
_Chem_comp.Entry_ID 1
_Chem_comp.ID ACE
_Chem_comp.Type non-polymer
save_
save_NH2
_Chem_comp.Sf_category chem_comp
_Chem_comp.Entry_ID 1
_Chem_comp.ID NH2
_Chem_comp.Type non-polymer
save_
save_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
48 1 . . . 1 1
49 1 . . . 1 1
50 1 . . . 1 1
51 1 . . . 1 1
52 1 . . . 1 1
53 1 . . . 1 1
54 1 . . . 1 1
55 1 . . . 1 1
56 1 . . . 1 1
57 1 . . . 1 1
58 1 . . . 1 1
59 1 . . . 1 1
60 1 . . . 1 1
61 1 . . . 1 1
62 1 . . . 1 1
63 1 . . . 1 1
stop_
loop_
_Dist_constraint.Tree_node_member_constraint_ID
_Dist_constraint.Tree_node_member_node_ID
_Dist_constraint.Constraint_tree_node_member_ID
_Dist_constraint.Entity_assembly_ID
_Dist_constraint.Entity_ID
_Dist_constraint.Comp_index_ID
_Dist_constraint.Comp_ID
_Dist_constraint.Atom_ID
_Dist_constraint.Auth_asym_ID
_Dist_constraint.Auth_seq_ID
_Dist_constraint.Auth_comp_ID
_Dist_constraint.Auth_atom_ID
_Dist_constraint.Entry_ID
_Dist_constraint.Distance_constraint_list_ID
1 1 1 1 1 2 CYS H . 3 . HN 1 1
1 1 2 1 1 2 CYS QB . 3 . HB* 1 1
2 1 1 1 1 2 CYS H . 3 . HN 1 1
2 1 2 1 1 3 ARG H . 4 . HN 1 1
3 1 1 1 1 2 CYS H . 3 . HN 1 1
3 1 2 1 1 9 TYR H . 10 . HN 1 1
4 1 1 1 1 2 CYS HA . 3 . HA 1 1
4 1 2 1 1 3 ARG H . 4 . HN 1 1
5 1 1 1 1 2 CYS HA . 3 . HA 1 1
5 1 2 1 1 3 ARG HA . 4 . HA 1 1
6 1 1 1 1 2 CYS HA . 3 . HA 1 1
6 1 2 1 1 3 ARG HG3 . 4 . HG1* 1 1
7 1 1 1 1 2 CYS QB . 3 . HB* 1 1
7 1 2 1 1 3 ARG H . 4 . HN 1 1
8 1 1 1 1 2 CYS QB . 3 . HB* 1 1
8 1 2 1 1 9 TYR QB . 10 . HB* 1 1
9 1 1 1 1 2 CYS QB . 3 . HB* 1 1
9 1 2 1 1 9 TYR QD . 10 . HD** 1 1
10 1 1 1 1 3 ARG H . 4 . HN 1 1
10 1 2 1 1 4 VAL H . 5 . HN 1 1
11 1 1 1 1 3 ARG H . 4 . HN 1 1
11 1 2 1 1 4 VAL QG . 5 . HG** 1 1
12 1 1 1 1 3 ARG HA . 4 . HA 1 1
12 1 2 1 1 3 ARG QG . 4 . HG** 1 1
13 1 1 1 1 3 ARG HA . 4 . HA 1 1
13 1 2 1 1 4 VAL H . 5 . HN 1 1
14 1 1 1 1 3 ARG HA . 4 . HA 1 1
14 1 2 1 1 9 TYR H . 10 . HN 1 1
15 1 1 1 1 3 ARG HA . 4 . HA 1 1
15 1 2 1 1 9 TYR QD . 10 . HD** 1 1
16 1 1 1 1 3 ARG QG . 4 . HG** 1 1
16 1 2 1 1 4 VAL H . 5 . HN 1 1
17 1 1 1 1 3 ARG QG . 4 . HG** 1 1
17 1 2 1 1 5 VAL H . 6 . HN 1 1
18 1 1 1 1 3 ARG QG . 4 . HG** 1 1
18 1 2 1 1 6 ARG H . 7 . HN 1 1
19 1 1 1 1 3 ARG QG . 4 . HG** 1 1
19 1 2 1 1 6 ARG HA . 7 . HA* 1 1
20 1 1 1 1 3 ARG QG . 4 . HG** 1 1
20 1 2 1 1 7 GLY H . 8 . HN 1 1
21 1 1 1 1 3 ARG QG . 4 . HG** 1 1
21 1 2 1 1 8 ASP H . 9 . HN 1 1
22 1 1 1 1 4 VAL H . 5 . HN 1 1
22 1 2 1 1 4 VAL HB . 5 . HB 1 1
23 1 1 1 1 4 VAL H . 5 . HN 1 1
23 1 2 1 1 4 VAL QG . 5 . HG** 1 1
24 1 1 1 1 4 VAL H . 5 . HN 1 1
24 1 2 1 1 5 VAL H . 6 . HN 1 1
25 1 1 1 1 4 VAL H . 5 . HN 1 1
25 1 2 1 1 7 GLY H . 8 . HN 1 1
26 1 1 1 1 4 VAL H . 5 . HN 1 1
26 1 2 1 1 8 ASP H . 9 . HN 1 1
27 1 1 1 1 4 VAL HA . 5 . HA 1 1
27 1 2 1 1 4 VAL QG . 5 . HG** 1 1
28 1 1 1 1 4 VAL HA . 5 . HA 1 1
28 1 2 1 1 5 VAL H . 6 . HN 1 1
29 1 1 1 1 4 VAL HA . 5 . HA 1 1
29 1 2 1 1 6 ARG H . 7 . HN 1 1
30 1 1 1 1 4 VAL HB . 5 . HB 1 1
30 1 2 1 1 5 VAL H . 6 . HN 1 1
31 1 1 1 1 4 VAL QG . 5 . HG** 1 1
31 1 2 1 1 5 VAL H . 6 . HN 1 1
32 1 1 1 1 4 VAL QG . 5 . HG** 1 1
32 1 2 1 1 5 VAL HA . 6 . HA 1 1
33 1 1 1 1 4 VAL QG . 5 . HG** 1 1
33 1 2 1 1 5 VAL QG . 6 . HG* 1 1
34 1 1 1 1 4 VAL QG . 5 . HG** 1 1
34 1 2 1 1 6 ARG H . 7 . HN 1 1
35 1 1 1 1 4 VAL QG . 5 . HG** 1 1
35 1 2 1 1 7 GLY H . 8 . HN 1 1
36 1 1 1 1 4 VAL QG . 5 . HG** 1 1
36 1 2 1 1 8 ASP H . 9 . HN 1 1
37 1 1 1 1 4 VAL QG . 5 . HG** 1 1
37 1 2 1 1 9 TYR H . 10 . HN 1 1
38 1 1 1 1 4 VAL QG . 5 . HG** 1 1
38 1 2 1 1 10 LEU H . 11 . HN 1 1
39 1 1 1 1 4 VAL QG . 5 . HG** 1 1
39 1 2 1 1 10 LEU QB . 11 . HB* 1 1
40 1 1 1 1 4 VAL O . 5 . O 1 1
40 1 2 1 1 7 GLY H . 8 . HN 1 1
41 1 1 1 1 4 VAL O . 5 . O 1 1
41 1 2 1 1 7 GLY N . 8 . N 1 1
42 1 1 1 1 5 VAL H . 6 . HN 1 1
42 1 2 1 1 5 VAL HB . 6 . HB* 1 1
43 1 1 1 1 5 VAL H . 6 . HN 1 1
43 1 2 1 1 6 ARG H . 7 . HN 1 1
44 1 1 1 1 5 VAL HA . 6 . HA 1 1
44 1 2 1 1 6 ARG H . 7 . HN 1 1
45 1 1 1 1 5 VAL HA . 6 . HA 1 1
45 1 2 1 1 7 GLY H . 8 . HN 1 1
46 1 1 1 1 5 VAL HB . 6 . HB* 1 1
46 1 2 1 1 6 ARG H . 7 . HN 1 1
47 1 1 1 1 5 VAL QG . 6 . HG* 1 1
47 1 2 1 1 6 ARG H . 7 . HN 1 1
48 1 1 1 1 6 ARG H . 7 . HN 1 1
48 1 2 1 1 6 ARG HA . 7 . HA* 1 1
49 1 1 1 1 6 ARG H . 7 . HN 1 1
49 1 2 1 1 7 GLY H . 8 . HN 1 1
50 1 1 1 1 6 ARG HA . 7 . HA* 1 1
50 1 2 1 1 7 GLY H . 8 . HN 1 1
51 1 1 1 1 7 GLY H . 8 . HN 1 1
51 1 2 1 1 8 ASP H . 9 . HN 1 1
52 1 1 1 1 8 ASP H . 9 . HN 1 1
52 1 2 1 1 8 ASP QB . 9 . HB* 1 1
53 1 1 1 1 8 ASP H . 9 . HN 1 1
53 1 2 1 1 9 TYR H . 10 . HN 1 1
54 1 1 1 1 8 ASP HA . 9 . HA 1 1
54 1 2 1 1 9 TYR H . 10 . HN 1 1
55 1 1 1 1 8 ASP QB . 9 . HB* 1 1
55 1 2 1 1 9 TYR H . 10 . HN 1 1
56 1 1 1 1 9 TYR H . 10 . HN 1 1
56 1 2 1 1 9 TYR QB . 10 . HB* 1 1
57 1 1 1 1 9 TYR H . 10 . HN 1 1
57 1 2 1 1 9 TYR QD . 10 . HD** 1 1
58 1 1 1 1 9 TYR H . 10 . HN 1 1
58 1 2 1 1 10 LEU H . 11 . HN 1 1
59 1 1 1 1 9 TYR HA . 10 . HA 1 1
59 1 2 1 1 9 TYR QD . 10 . HD** 1 1
60 1 1 1 1 9 TYR HA . 10 . HA 1 1
60 1 2 1 1 10 LEU H . 11 . HN 1 1
61 1 1 1 1 9 TYR QD . 10 . HD** 1 1
61 1 2 1 1 10 LEU H . 11 . HN 1 1
62 1 1 1 1 10 LEU H . 11 . HN 1 1
62 1 2 1 1 10 LEU QB . 11 . HB* 1 1
63 1 1 1 1 11 ASP H . 12 . HN 1 1
63 1 2 1 1 11 ASP QB . 12 . HB* 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 . . . . . 3.3 1.8 4.18 1 1
2 1 . . . . . 5.0 1.8 5.0 1 1
3 1 . . . . . 6.0 3.0 6.0 1 1
4 1 . . . . . 3.3 1.8 3.3 1 1
5 1 . . . . . 5.0 1.8 5.0 1 1
6 1 . . . . . 5.0 1.8 6.53 1 1
7 1 . . . . . 3.3 1.8 4.18 1 1
8 1 . . . . . 6.0 3.0 8.06 1 1
9 1 . . . . . 6.0 3.0 8.81 1 1
10 1 . . . . . 5.0 1.8 5.0 1 1
11 1 . . . . . 6.0 3.0 8.81 1 1
12 1 . . . . . 2.7 1.8 3.96 1 1
13 1 . . . . . 3.3 1.8 3.3 1 1
14 1 . . . . . 6.0 3.0 6.0 1 1
15 1 . . . . . 5.0 1.8 7.81 1 1
16 1 . . . . . 5.0 1.8 7.81 1 1
17 1 . . . . . 6.0 3.0 8.81 1 1
18 1 . . . . . 5.0 1.8 7.81 1 1
19 1 . . . . . 5.0 1.8 8.41 1 1
20 1 . . . . . 5.0 1.8 7.81 1 1
21 1 . . . . . 5.0 1.8 7.81 1 1
22 1 . . . . . 3.3 1.8 3.3 1 1
23 1 . . . . . 3.3 1.8 5.53 1 1
24 1 . . . . . 5.0 1.8 5.0 1 1
25 1 . . . . . 5.0 1.8 5.0 1 1
26 1 . . . . . 6.0 3.0 6.0 1 1
27 1 . . . . . 2.7 1.8 3.96 1 1
28 1 . . . . . 3.3 1.8 3.3 1 1
29 1 . . . . . 6.0 3.0 6.0 1 1
30 1 . . . . . 3.3 1.8 3.3 1 1
31 1 . . . . . 3.3 1.8 6.11 1 1
32 1 . . . . . 6.0 3.0 8.81 1 1
33 1 . . . . . 3.3 1.8 6.94 1 1
34 1 . . . . . 6.0 3.0 8.81 1 1
35 1 . . . . . 6.0 3.0 8.81 1 1
36 1 . . . . . 6.0 3.0 8.81 1 1
37 1 . . . . . 6.0 3.0 8.81 1 1
38 1 . . . . . 5.0 1.8 7.81 1 1
39 1 . . . . . 5.0 1.8 8.41 1 1
40 1 . . . . . 2.3 1.5 2.3 1 1
41 1 . . . . . 3.3 2.4 3.3 1 1
42 1 . . . . . 3.3 1.8 3.92 1 1
43 1 . . . . . 5.0 1.8 5.0 1 1
44 1 . . . . . 3.3 1.8 3.3 1 1
45 1 . . . . . 6.0 3.0 6.0 1 1
46 1 . . . . . 5.0 1.8 5.88 1 1
47 1 . . . . . 6.0 3.0 6.88 1 1
48 1 . . . . . 2.7 1.8 3.22 1 1
49 1 . . . . . 3.3 1.8 3.3 1 1
50 1 . . . . . 5.0 1.8 5.8 1 1
51 1 . . . . . 3.3 1.8 3.3 1 1
52 1 . . . . . 2.7 1.8 3.32 1 1
53 1 . . . . . 5.0 1.8 5.0 1 1
54 1 . . . . . 3.3 1.8 3.3 1 1
55 1 . . . . . 3.3 1.8 4.18 1 1
56 1 . . . . . 3.3 1.8 3.95 1 1
57 1 . . . . . 5.0 1.8 7.81 1 1
58 1 . . . . . 5.0 1.8 5.0 1 1
59 1 . . . . . 3.3 1.8 4.88 1 1
60 1 . . . . . 3.3 1.8 3.3 1 1
61 1 . . . . . 5.0 1.8 7.81 1 1
62 1 . . . . . 3.3 1.8 4.18 1 1
63 1 . . . . . 3.3 1.8 4.18 1 1
stop_
save_
save_CNS/XPLOR_dihedral_3
_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 1 ACE C 1 1 2 CYS N 1 1 2 CYS CA 1 1 2 CYS C -145.0 -55.0 . 2 . C . 3 . N . 3 . CA . 3 . C 1 1
2 . 1 1 2 CYS C 1 1 3 ARG N 1 1 3 ARG CA 1 1 3 ARG C -145.0 -55.0 . 3 . C . 4 . N . 4 . CA . 4 . C 1 1
3 . 1 1 3 ARG C 1 1 4 VAL N 1 1 4 VAL CA 1 1 4 VAL C -165.0 -75.0 . 4 . C . 5 . N . 5 . CA . 5 . C 1 1
4 . 1 1 4 VAL C 1 1 5 VAL N 1 1 5 VAL CA 1 1 5 VAL C -145.0 -55.0 . 5 . C . 6 . N . 6 . CA . 6 . C 1 1
5 . 1 1 6 ARG C 1 1 7 GLY N 1 1 7 GLY CA 1 1 7 GLY C -145.0 -55.0 . 7 . C . 8 . N . 8 . CA . 8 . C 1 1
6 . 1 1 7 GLY C 1 1 8 ASP N 1 1 8 ASP CA 1 1 8 ASP C -145.0 -55.0 . 8 . C . 9 . N . 9 . CA . 9 . C 1 1
7 . 1 1 8 ASP C 1 1 9 TYR N 1 1 9 TYR CA 1 1 9 TYR C -145.0 -55.0 . 9 . C . 10 . N . 10 . CA . 10 . C 1 1
8 . 1 1 9 TYR C 1 1 10 LEU N 1 1 10 LEU CA 1 1 10 LEU C -145.0 -55.0 . 10 . C . 11 . N . 11 . CA . 11 . C 1 1
9 . 1 1 11 ASP N 1 1 11 ASP CA 1 1 11 ASP CB 1 1 11 ASP CG 30.0 89.99999 . 12 . N . 12 . CA . 12 . CB . 12 . CG 1 1
stop_
save_
save_conformer_family_coord_set_1
_Conformer_family_coord_set.Sf_category conformer_family_coord_set
_Conformer_family_coord_set.Entry_ID 1
_Conformer_family_coord_set.ID 1
loop_
_Atom_site.Model_ID
_Atom_site.ID
_Atom_site.Label_entity_assembly_ID
_Atom_site.Label_entity_ID
_Atom_site.Label_comp_index_ID
_Atom_site.Label_comp_ID
_Atom_site.Label_atom_ID
_Atom_site.Type_symbol
_Atom_site.Cartn_x
_Atom_site.Cartn_y
_Atom_site.Cartn_z
_Atom_site.Occupancy
_Atom_site.Uncertainty
_Atom_site.PDBX_label_asym_ID
_Atom_site.PDB_strand_ID
_Atom_site.PDB_ins_code
_Atom_site.PDB_residue_no
_Atom_site.PDB_residue_name
_Atom_site.PDB_atom_name
_Atom_site.Entry_ID
_Atom_site.Conformer_family_coord_set_ID
1 1 1 1 1 ACE C C 4.060 -5.509 -5.423 1.00 . A A . 1 ACE C 1 1
1 2 1 1 1 ACE CH3 C 3.703 -6.923 -4.966 1.00 . A A . 1 ACE CH3 1 1
1 3 1 1 1 ACE H1 H 4.384 -7.629 -5.419 1.00 . A A . 1 ACE H1 1 1
1 4 1 1 1 ACE H2 H 2.692 -7.153 -5.269 1.00 . A A . 1 ACE H2 1 1
1 5 1 1 1 ACE H3 H 3.781 -6.986 -3.891 1.00 . A A . 1 ACE H3 1 1
1 6 1 1 1 ACE O O 5.169 -5.244 -5.846 1.00 . A A . 1 ACE O 1 1
1 7 1 1 2 CYS C C 2.874 -2.205 -4.750 1.00 . A A . 2 CYS C 1 1
1 8 1 1 2 CYS CA C 3.408 -3.207 -5.781 1.00 . A A . 2 CYS CA 1 1
1 9 1 1 2 CYS CB C 2.649 -3.047 -7.102 1.00 . A A . 2 CYS CB 1 1
1 10 1 1 2 CYS H H 2.239 -4.840 -5.003 1.00 . A A . 2 CYS H 1 1
1 11 1 1 2 CYS HA H 4.465 -3.062 -5.940 1.00 . A A . 2 CYS HA 1 1
1 12 1 1 2 CYS HB2 H 1.713 -3.582 -7.044 1.00 . A A . 2 CYS HB2 1 1
1 13 1 1 2 CYS HB3 H 2.449 -1.999 -7.274 1.00 . A A . 2 CYS HB3 1 1
1 14 1 1 2 CYS N N 3.127 -4.603 -5.344 1.00 . A A . 2 CYS N 1 1
1 15 1 1 2 CYS O O 1.758 -2.321 -4.283 1.00 . A A . 2 CYS O 1 1
1 16 1 1 2 CYS SG S 3.636 -3.706 -8.471 1.00 . A A . 2 CYS SG 1 1
1 17 1 1 3 ARG C C 2.486 0.938 -4.244 1.00 . A A . 3 ARG C 1 1
1 18 1 1 3 ARG CA C 3.168 -0.180 -3.446 1.00 . A A . 3 ARG CA 1 1
1 19 1 1 3 ARG CB C 4.426 0.304 -2.709 1.00 . A A . 3 ARG CB 1 1
1 20 1 1 3 ARG CD C 5.125 1.375 -0.552 1.00 . A A . 3 ARG CD 1 1
1 21 1 1 3 ARG CG C 4.037 1.322 -1.630 1.00 . A A . 3 ARG CG 1 1
1 22 1 1 3 ARG CZ C 5.518 -0.010 1.398 1.00 . A A . 3 ARG CZ 1 1
1 23 1 1 3 ARG H H 4.538 -1.119 -4.822 1.00 . A A . 3 ARG H 1 1
1 24 1 1 3 ARG HA H 2.477 -0.614 -2.754 1.00 . A A . 3 ARG HA 1 1
1 25 1 1 3 ARG HB2 H 4.916 -0.539 -2.243 1.00 . A A . 3 ARG HB2 1 1
1 26 1 1 3 ARG HB3 H 5.101 0.768 -3.412 1.00 . A A . 3 ARG HB3 1 1
1 27 1 1 3 ARG HD2 H 6.072 1.050 -0.959 1.00 . A A . 3 ARG HD2 1 1
1 28 1 1 3 ARG HD3 H 5.209 2.375 -0.152 1.00 . A A . 3 ARG HD3 1 1
1 29 1 1 3 ARG HE H 3.729 0.161 0.552 1.00 . A A . 3 ARG HE 1 1
1 30 1 1 3 ARG HG2 H 3.935 2.296 -2.081 1.00 . A A . 3 ARG HG2 1 1
1 31 1 1 3 ARG HG3 H 3.100 1.032 -1.180 1.00 . A A . 3 ARG HG3 1 1
1 32 1 1 3 ARG HH11 H 6.807 -0.702 0.033 1.00 . A A . 3 ARG HH11 1 1
1 33 1 1 3 ARG HH12 H 7.269 -0.938 1.685 1.00 . A A . 3 ARG HH12 1 1
1 34 1 1 3 ARG HH21 H 4.429 0.574 2.974 1.00 . A A . 3 ARG HH21 1 1
1 35 1 1 3 ARG HH22 H 5.924 -0.218 3.347 1.00 . A A . 3 ARG HH22 1 1
1 36 1 1 3 ARG N N 3.650 -1.207 -4.417 1.00 . A A . 3 ARG N 1 1
1 37 1 1 3 ARG NE N 4.667 0.439 0.514 1.00 . A A . 3 ARG NE 1 1
1 38 1 1 3 ARG NH1 N 6.617 -0.595 1.008 1.00 . A A . 3 ARG NH1 1 1
1 39 1 1 3 ARG NH2 N 5.271 0.127 2.672 1.00 . A A . 3 ARG NH2 1 1
1 40 1 1 3 ARG O O 1.387 0.754 -4.734 1.00 . A A . 3 ARG O 1 1
1 41 1 1 4 VAL C C 3.508 3.834 -6.097 1.00 . A A . 4 VAL C 1 1
1 42 1 1 4 VAL CA C 2.462 3.141 -5.223 1.00 . A A . 4 VAL CA 1 1
1 43 1 1 4 VAL CB C 1.799 4.109 -4.237 1.00 . A A . 4 VAL CB 1 1
1 44 1 1 4 VAL CG1 C 0.276 3.971 -4.347 1.00 . A A . 4 VAL CG1 1 1
1 45 1 1 4 VAL CG2 C 2.219 3.809 -2.790 1.00 . A A . 4 VAL CG2 1 1
1 46 1 1 4 VAL H H 3.991 2.212 -4.040 1.00 . A A . 4 VAL H 1 1
1 47 1 1 4 VAL HA H 1.721 2.692 -5.865 1.00 . A A . 4 VAL HA 1 1
1 48 1 1 4 VAL HB H 2.091 5.112 -4.489 1.00 . A A . 4 VAL HB 1 1
1 49 1 1 4 VAL HG11 H -0.089 3.355 -3.538 1.00 . A A . 4 VAL HG11 1 1
1 50 1 1 4 VAL HG12 H 0.024 3.508 -5.290 1.00 . A A . 4 VAL HG12 1 1
1 51 1 1 4 VAL HG13 H -0.181 4.947 -4.291 1.00 . A A . 4 VAL HG13 1 1
1 52 1 1 4 VAL HG21 H 1.629 4.412 -2.116 1.00 . A A . 4 VAL HG21 1 1
1 53 1 1 4 VAL HG22 H 3.263 4.044 -2.662 1.00 . A A . 4 VAL HG22 1 1
1 54 1 1 4 VAL HG23 H 2.054 2.764 -2.574 1.00 . A A . 4 VAL HG23 1 1
1 55 1 1 4 VAL N N 3.109 2.071 -4.417 1.00 . A A . 4 VAL N 1 1
1 56 1 1 4 VAL O O 4.652 3.462 -6.083 1.00 . A A . 4 VAL O 1 1
1 57 1 1 5 VAL C C 4.771 6.665 -7.296 1.00 . A A . 5 VAL C 1 1
1 58 1 1 5 VAL CA C 4.133 5.399 -7.836 1.00 . A A . 5 VAL CA 1 1
1 59 1 1 5 VAL CB C 3.354 5.717 -9.112 1.00 . A A . 5 VAL CB 1 1
1 60 1 1 5 VAL CG1 C 4.317 6.225 -10.195 1.00 . A A . 5 VAL CG1 1 1
1 61 1 1 5 VAL CG2 C 2.647 4.455 -9.616 1.00 . A A . 5 VAL CG2 1 1
1 62 1 1 5 VAL H H 2.184 5.051 -6.956 1.00 . A A . 5 VAL H 1 1
1 63 1 1 5 VAL HA H 4.899 4.687 -8.060 1.00 . A A . 5 VAL HA 1 1
1 64 1 1 5 VAL HB H 2.622 6.480 -8.896 1.00 . A A . 5 VAL HB 1 1
1 65 1 1 5 VAL HG11 H 5.043 5.458 -10.422 1.00 . A A . 5 VAL HG11 1 1
1 66 1 1 5 VAL HG12 H 4.826 7.109 -9.842 1.00 . A A . 5 VAL HG12 1 1
1 67 1 1 5 VAL HG13 H 3.757 6.464 -11.086 1.00 . A A . 5 VAL HG13 1 1
1 68 1 1 5 VAL HG21 H 1.644 4.706 -9.924 1.00 . A A . 5 VAL HG21 1 1
1 69 1 1 5 VAL HG22 H 2.607 3.723 -8.825 1.00 . A A . 5 VAL HG22 1 1
1 70 1 1 5 VAL HG23 H 3.191 4.048 -10.455 1.00 . A A . 5 VAL HG23 1 1
1 71 1 1 5 VAL N N 3.126 4.786 -6.909 1.00 . A A . 5 VAL N 1 1
1 72 1 1 5 VAL O O 5.705 7.173 -7.880 1.00 . A A . 5 VAL O 1 1
1 73 1 1 6 ARG C C 6.384 8.024 -5.215 1.00 . A A . 6 ARG C 1 1
1 74 1 1 6 ARG CA C 4.993 8.404 -5.682 1.00 . A A . 6 ARG CA 1 1
1 75 1 1 6 ARG CB C 4.117 8.854 -4.517 1.00 . A A . 6 ARG CB 1 1
1 76 1 1 6 ARG CD C 2.782 10.782 -3.619 1.00 . A A . 6 ARG CD 1 1
1 77 1 1 6 ARG CG C 3.859 10.362 -4.627 1.00 . A A . 6 ARG CG 1 1
1 78 1 1 6 ARG CZ C 3.983 12.842 -3.142 1.00 . A A . 6 ARG CZ 1 1
1 79 1 1 6 ARG H H 3.617 6.735 -5.694 1.00 . A A . 6 ARG H 1 1
1 80 1 1 6 ARG HA H 5.029 9.164 -6.450 1.00 . A A . 6 ARG HA 1 1
1 81 1 1 6 ARG HB2 H 3.177 8.316 -4.553 1.00 . A A . 6 ARG HB2 1 1
1 82 1 1 6 ARG HB3 H 4.618 8.638 -3.587 1.00 . A A . 6 ARG HB3 1 1
1 83 1 1 6 ARG HD2 H 1.803 10.486 -3.975 1.00 . A A . 6 ARG HD2 1 1
1 84 1 1 6 ARG HD3 H 2.978 10.343 -2.653 1.00 . A A . 6 ARG HD3 1 1
1 85 1 1 6 ARG HE H 2.098 12.824 -3.767 1.00 . A A . 6 ARG HE 1 1
1 86 1 1 6 ARG HG2 H 4.776 10.898 -4.422 1.00 . A A . 6 ARG HG2 1 1
1 87 1 1 6 ARG HG3 H 3.524 10.595 -5.628 1.00 . A A . 6 ARG HG3 1 1
1 88 1 1 6 ARG HH11 H 3.570 12.667 -1.191 1.00 . A A . 6 ARG HH11 1 1
1 89 1 1 6 ARG HH12 H 5.081 13.421 -1.572 1.00 . A A . 6 ARG HH12 1 1
1 90 1 1 6 ARG HH21 H 4.646 13.155 -5.005 1.00 . A A . 6 ARG HH21 1 1
1 91 1 1 6 ARG HH22 H 5.695 13.697 -3.737 1.00 . A A . 6 ARG HH22 1 1
1 92 1 1 6 ARG N N 4.345 7.164 -6.186 1.00 . A A . 6 ARG N 1 1
1 93 1 1 6 ARG NE N 2.873 12.272 -3.532 1.00 . A A . 6 ARG NE 1 1
1 94 1 1 6 ARG NH1 N 4.229 12.989 -1.870 1.00 . A A . 6 ARG NH1 1 1
1 95 1 1 6 ARG NH2 N 4.840 13.266 -4.030 1.00 . A A . 6 ARG NH2 1 1
1 96 1 1 6 ARG O O 6.654 7.856 -4.044 1.00 . A A . 6 ARG O 1 1
1 97 1 1 7 GLY C C 8.524 6.014 -5.224 1.00 . A A . 7 GLY C 1 1
1 98 1 1 7 GLY CA C 8.636 7.395 -5.859 1.00 . A A . 7 GLY CA 1 1
1 99 1 1 7 GLY H H 6.990 7.942 -7.108 1.00 . A A . 7 GLY H 1 1
1 100 1 1 7 GLY HA2 H 9.226 7.346 -6.765 1.00 . A A . 7 GLY HA2 1 1
1 101 1 1 7 GLY HA3 H 9.089 8.077 -5.158 1.00 . A A . 7 GLY HA3 1 1
1 102 1 1 7 GLY N N 7.262 7.833 -6.172 1.00 . A A . 7 GLY N 1 1
1 103 1 1 7 GLY O O 9.271 5.676 -4.325 1.00 . A A . 7 GLY O 1 1
1 104 1 1 8 ASP C C 6.996 2.734 -5.935 1.00 . A A . 8 ASP C 1 1
1 105 1 1 8 ASP CA C 7.396 3.877 -4.990 1.00 . A A . 8 ASP CA 1 1
1 106 1 1 8 ASP CB C 6.285 4.102 -3.965 1.00 . A A . 8 ASP CB 1 1
1 107 1 1 8 ASP CG C 6.879 4.684 -2.685 1.00 . A A . 8 ASP CG 1 1
1 108 1 1 8 ASP H H 6.927 5.523 -6.355 1.00 . A A . 8 ASP H 1 1
1 109 1 1 8 ASP HA H 8.299 3.618 -4.476 1.00 . A A . 8 ASP HA 1 1
1 110 1 1 8 ASP HB2 H 5.558 4.791 -4.371 1.00 . A A . 8 ASP HB2 1 1
1 111 1 1 8 ASP HB3 H 5.804 3.161 -3.742 1.00 . A A . 8 ASP HB3 1 1
1 112 1 1 8 ASP N N 7.554 5.220 -5.649 1.00 . A A . 8 ASP N 1 1
1 113 1 1 8 ASP O O 6.982 1.586 -5.527 1.00 . A A . 8 ASP O 1 1
1 114 1 1 8 ASP OD1 O 7.648 3.986 -2.045 1.00 . A A . 8 ASP OD1 1 1
1 115 1 1 8 ASP OD2 O 6.555 5.815 -2.365 1.00 . A A . 8 ASP OD2 1 1
1 116 1 1 9 TYR C C 7.348 1.182 -8.704 1.00 . A A . 9 TYR C 1 1
1 117 1 1 9 TYR CA C 6.181 1.881 -8.035 1.00 . A A . 9 TYR CA 1 1
1 118 1 1 9 TYR CB C 5.256 2.490 -9.096 1.00 . A A . 9 TYR CB 1 1
1 119 1 1 9 TYR CD1 C 3.294 1.498 -7.891 1.00 . A A . 9 TYR CD1 1 1
1 120 1 1 9 TYR CD2 C 3.416 1.244 -10.295 1.00 . A A . 9 TYR CD2 1 1
1 121 1 1 9 TYR CE1 C 2.092 0.781 -7.875 1.00 . A A . 9 TYR CE1 1 1
1 122 1 1 9 TYR CE2 C 2.215 0.523 -10.282 1.00 . A A . 9 TYR CE2 1 1
1 123 1 1 9 TYR CG C 3.953 1.730 -9.098 1.00 . A A . 9 TYR CG 1 1
1 124 1 1 9 TYR CZ C 1.551 0.290 -9.072 1.00 . A A . 9 TYR CZ 1 1
1 125 1 1 9 TYR H H 6.593 3.921 -7.465 1.00 . A A . 9 TYR H 1 1
1 126 1 1 9 TYR HA H 5.624 1.164 -7.452 1.00 . A A . 9 TYR HA 1 1
1 127 1 1 9 TYR HB2 H 5.072 3.520 -8.867 1.00 . A A . 9 TYR HB2 1 1
1 128 1 1 9 TYR HB3 H 5.715 2.413 -10.070 1.00 . A A . 9 TYR HB3 1 1
1 129 1 1 9 TYR HD1 H 3.718 1.879 -6.971 1.00 . A A . 9 TYR HD1 1 1
1 130 1 1 9 TYR HD2 H 3.928 1.425 -11.227 1.00 . A A . 9 TYR HD2 1 1
1 131 1 1 9 TYR HE1 H 1.584 0.602 -6.942 1.00 . A A . 9 TYR HE1 1 1
1 132 1 1 9 TYR HE2 H 1.799 0.149 -11.206 1.00 . A A . 9 TYR HE2 1 1
1 133 1 1 9 TYR HH H -0.268 0.041 -9.605 1.00 . A A . 9 TYR HH 1 1
1 134 1 1 9 TYR N N 6.626 3.003 -7.153 1.00 . A A . 9 TYR N 1 1
1 135 1 1 9 TYR O O 8.423 1.722 -8.868 1.00 . A A . 9 TYR O 1 1
1 136 1 1 9 TYR OH O 0.368 -0.425 -9.057 1.00 . A A . 9 TYR OH 1 1
1 137 1 1 10 LEU C C 7.955 -0.850 -11.267 1.00 . A A . 10 LEU C 1 1
1 138 1 1 10 LEU CA C 8.175 -0.843 -9.746 1.00 . A A . 10 LEU CA 1 1
1 139 1 1 10 LEU CB C 8.027 -2.251 -9.153 1.00 . A A . 10 LEU CB 1 1
1 140 1 1 10 LEU CD1 C 9.533 -1.351 -7.334 1.00 . A A . 10 LEU CD1 1 1
1 141 1 1 10 LEU CD2 C 7.108 -1.777 -6.861 1.00 . A A . 10 LEU CD2 1 1
1 142 1 1 10 LEU CG C 8.336 -2.258 -7.645 1.00 . A A . 10 LEU CG 1 1
1 143 1 1 10 LEU H H 6.220 -0.431 -8.917 1.00 . A A . 10 LEU H 1 1
1 144 1 1 10 LEU HA H 9.144 -0.448 -9.516 1.00 . A A . 10 LEU HA 1 1
1 145 1 1 10 LEU HB2 H 7.012 -2.590 -9.305 1.00 . A A . 10 LEU HB2 1 1
1 146 1 1 10 LEU HB3 H 8.704 -2.921 -9.659 1.00 . A A . 10 LEU HB3 1 1
1 147 1 1 10 LEU HD11 H 10.268 -1.445 -8.119 1.00 . A A . 10 LEU HD11 1 1
1 148 1 1 10 LEU HD12 H 9.973 -1.644 -6.392 1.00 . A A . 10 LEU HD12 1 1
1 149 1 1 10 LEU HD13 H 9.201 -0.325 -7.271 1.00 . A A . 10 LEU HD13 1 1
1 150 1 1 10 LEU HD21 H 6.932 -2.441 -6.028 1.00 . A A . 10 LEU HD21 1 1
1 151 1 1 10 LEU HD22 H 6.243 -1.776 -7.508 1.00 . A A . 10 LEU HD22 1 1
1 152 1 1 10 LEU HD23 H 7.283 -0.777 -6.493 1.00 . A A . 10 LEU HD23 1 1
1 153 1 1 10 LEU HG H 8.576 -3.267 -7.342 1.00 . A A . 10 LEU HG 1 1
1 154 1 1 10 LEU N N 7.114 -0.039 -9.082 1.00 . A A . 10 LEU N 1 1
1 155 1 1 10 LEU O O 8.277 0.104 -11.953 1.00 . A A . 10 LEU O 1 1
1 156 1 1 11 ASP C C 5.723 -2.428 -13.542 1.00 . A A . 11 ASP C 1 1
1 157 1 1 11 ASP CA C 7.162 -1.975 -13.268 1.00 . A A . 11 ASP CA 1 1
1 158 1 1 11 ASP CB C 8.159 -3.008 -13.798 1.00 . A A . 11 ASP CB 1 1
1 159 1 1 11 ASP CG C 8.459 -2.710 -15.269 1.00 . A A . 11 ASP CG 1 1
1 160 1 1 11 ASP H H 7.157 -2.661 -11.227 1.00 . A A . 11 ASP H 1 1
1 161 1 1 11 ASP HA H 7.346 -1.016 -13.727 1.00 . A A . 11 ASP HA 1 1
1 162 1 1 11 ASP HB2 H 9.073 -2.955 -13.225 1.00 . A A . 11 ASP HB2 1 1
1 163 1 1 11 ASP HB3 H 7.737 -3.998 -13.714 1.00 . A A . 11 ASP HB3 1 1
1 164 1 1 11 ASP N N 7.407 -1.910 -11.797 1.00 . A A . 11 ASP N 1 1
1 165 1 1 11 ASP O O 5.377 -2.798 -14.649 1.00 . A A . 11 ASP O 1 1
1 166 1 1 11 ASP OD1 O 7.676 -3.124 -16.108 1.00 . A A . 11 ASP OD1 1 1
1 167 1 1 11 ASP OD2 O 9.463 -2.067 -15.529 1.00 . A A . 11 ASP OD2 1 1
1 168 1 1 12 CYS C C 2.570 -1.582 -12.919 1.00 . A A . 12 CYS C 1 1
1 169 1 1 12 CYS CA C 3.464 -2.816 -12.741 1.00 . A A . 12 CYS CA 1 1
1 170 1 1 12 CYS CB C 3.089 -3.588 -11.467 1.00 . A A . 12 CYS CB 1 1
1 171 1 1 12 CYS H H 5.179 -2.089 -11.656 1.00 . A A . 12 CYS H 1 1
1 172 1 1 12 CYS HA H 3.385 -3.462 -13.600 1.00 . A A . 12 CYS HA 1 1
1 173 1 1 12 CYS HB2 H 2.082 -3.968 -11.563 1.00 . A A . 12 CYS HB2 1 1
1 174 1 1 12 CYS HB3 H 3.771 -4.417 -11.338 1.00 . A A . 12 CYS HB3 1 1
1 175 1 1 12 CYS N N 4.880 -2.396 -12.540 1.00 . A A . 12 CYS N 1 1
1 176 1 1 12 CYS O O 1.364 -1.663 -12.798 1.00 . A A . 12 CYS O 1 1
1 177 1 1 12 CYS SG S 3.186 -2.489 -10.022 1.00 . A A . 12 CYS SG 1 1
1 178 1 1 13 NH2 HN1 H 4.093 -0.364 -13.305 1.00 . A A . 13 NH2 HN1 1 1
1 179 1 1 13 NH2 HN2 H 2.560 0.364 -13.328 1.00 . A A . 13 NH2 HN2 1 1
1 180 1 1 13 NH2 N N 3.121 -0.431 -13.208 1.00 . A A . 13 NH2 N 1 1
2 181 1 1 1 ACE C C 4.981 -1.445 -15.376 1.00 . A A . 1 ACE C 1 1
2 182 1 1 1 ACE CH3 C 4.904 -1.380 -16.903 1.00 . A A . 1 ACE CH3 1 1
2 183 1 1 1 ACE H1 H 4.018 -1.895 -17.240 1.00 . A A . 1 ACE H1 1 1
2 184 1 1 1 ACE H2 H 5.778 -1.851 -17.327 1.00 . A A . 1 ACE H2 1 1
2 185 1 1 1 ACE H3 H 4.863 -0.347 -17.216 1.00 . A A . 1 ACE H3 1 1
2 186 1 1 1 ACE O O 5.997 -1.135 -14.785 1.00 . A A . 1 ACE O 1 1
2 187 1 1 2 CYS C C 4.283 -0.591 -12.616 1.00 . A A . 2 CYS C 1 1
2 188 1 1 2 CYS CA C 3.907 -1.941 -13.242 1.00 . A A . 2 CYS CA 1 1
2 189 1 1 2 CYS CB C 4.947 -3.013 -12.900 1.00 . A A . 2 CYS CB 1 1
2 190 1 1 2 CYS H H 3.109 -2.092 -15.241 1.00 . A A . 2 CYS H 1 1
2 191 1 1 2 CYS HA H 2.935 -2.254 -12.895 1.00 . A A . 2 CYS HA 1 1
2 192 1 1 2 CYS HB2 H 5.860 -2.818 -13.443 1.00 . A A . 2 CYS HB2 1 1
2 193 1 1 2 CYS HB3 H 5.149 -2.994 -11.839 1.00 . A A . 2 CYS HB3 1 1
2 194 1 1 2 CYS N N 3.913 -1.849 -14.736 1.00 . A A . 2 CYS N 1 1
2 195 1 1 2 CYS O O 5.428 -0.180 -12.636 1.00 . A A . 2 CYS O 1 1
2 196 1 1 2 CYS SG S 4.307 -4.642 -13.364 1.00 . A A . 2 CYS SG 1 1
2 197 1 1 3 ARG C C 2.626 1.690 -10.276 1.00 . A A . 3 ARG C 1 1
2 198 1 1 3 ARG CA C 3.606 1.423 -11.429 1.00 . A A . 3 ARG CA 1 1
2 199 1 1 3 ARG CB C 3.425 2.453 -12.553 1.00 . A A . 3 ARG CB 1 1
2 200 1 1 3 ARG CD C 1.475 3.622 -13.594 1.00 . A A . 3 ARG CD 1 1
2 201 1 1 3 ARG CG C 2.074 2.255 -13.248 1.00 . A A . 3 ARG CG 1 1
2 202 1 1 3 ARG CZ C -0.023 5.108 -12.405 1.00 . A A . 3 ARG CZ 1 1
2 203 1 1 3 ARG H H 2.408 -0.255 -12.056 1.00 . A A . 3 ARG H 1 1
2 204 1 1 3 ARG HA H 4.622 1.452 -11.068 1.00 . A A . 3 ARG HA 1 1
2 205 1 1 3 ARG HB2 H 3.467 3.447 -12.137 1.00 . A A . 3 ARG HB2 1 1
2 206 1 1 3 ARG HB3 H 4.218 2.334 -13.276 1.00 . A A . 3 ARG HB3 1 1
2 207 1 1 3 ARG HD2 H 2.264 4.331 -13.808 1.00 . A A . 3 ARG HD2 1 1
2 208 1 1 3 ARG HD3 H 0.805 3.538 -14.435 1.00 . A A . 3 ARG HD3 1 1
2 209 1 1 3 ARG HE H 0.782 3.502 -11.557 1.00 . A A . 3 ARG HE 1 1
2 210 1 1 3 ARG HG2 H 2.219 1.685 -14.156 1.00 . A A . 3 ARG HG2 1 1
2 211 1 1 3 ARG HG3 H 1.402 1.725 -12.593 1.00 . A A . 3 ARG HG3 1 1
2 212 1 1 3 ARG HH11 H 1.515 6.366 -12.154 1.00 . A A . 3 ARG HH11 1 1
2 213 1 1 3 ARG HH12 H -0.044 7.107 -12.295 1.00 . A A . 3 ARG HH12 1 1
2 214 1 1 3 ARG HH21 H -1.735 4.102 -12.661 1.00 . A A . 3 ARG HH21 1 1
2 215 1 1 3 ARG HH22 H -1.883 5.825 -12.582 1.00 . A A . 3 ARG HH22 1 1
2 216 1 1 3 ARG N N 3.320 0.099 -12.061 1.00 . A A . 3 ARG N 1 1
2 217 1 1 3 ARG NE N 0.721 4.035 -12.378 1.00 . A A . 3 ARG NE 1 1
2 218 1 1 3 ARG NH1 N 0.525 6.285 -12.274 1.00 . A A . 3 ARG NH1 1 1
2 219 1 1 3 ARG NH2 N -1.314 5.004 -12.562 1.00 . A A . 3 ARG NH2 1 1
2 220 1 1 3 ARG O O 1.423 1.616 -10.443 1.00 . A A . 3 ARG O 1 1
2 221 1 1 4 VAL C C 2.162 3.800 -7.681 1.00 . A A . 4 VAL C 1 1
2 222 1 1 4 VAL CA C 2.217 2.294 -7.957 1.00 . A A . 4 VAL CA 1 1
2 223 1 1 4 VAL CB C 2.779 1.530 -6.743 1.00 . A A . 4 VAL CB 1 1
2 224 1 1 4 VAL CG1 C 2.014 0.218 -6.566 1.00 . A A . 4 VAL CG1 1 1
2 225 1 1 4 VAL CG2 C 4.270 1.228 -6.924 1.00 . A A . 4 VAL CG2 1 1
2 226 1 1 4 VAL H H 4.094 2.079 -8.993 1.00 . A A . 4 VAL H 1 1
2 227 1 1 4 VAL HA H 1.232 1.938 -8.176 1.00 . A A . 4 VAL HA 1 1
2 228 1 1 4 VAL HB H 2.646 2.134 -5.863 1.00 . A A . 4 VAL HB 1 1
2 229 1 1 4 VAL HG11 H 1.075 0.412 -6.070 1.00 . A A . 4 VAL HG11 1 1
2 230 1 1 4 VAL HG12 H 2.602 -0.463 -5.969 1.00 . A A . 4 VAL HG12 1 1
2 231 1 1 4 VAL HG13 H 1.826 -0.222 -7.535 1.00 . A A . 4 VAL HG13 1 1
2 232 1 1 4 VAL HG21 H 4.663 0.797 -6.015 1.00 . A A . 4 VAL HG21 1 1
2 233 1 1 4 VAL HG22 H 4.795 2.143 -7.145 1.00 . A A . 4 VAL HG22 1 1
2 234 1 1 4 VAL HG23 H 4.399 0.532 -7.738 1.00 . A A . 4 VAL HG23 1 1
2 235 1 1 4 VAL N N 3.126 2.011 -9.109 1.00 . A A . 4 VAL N 1 1
2 236 1 1 4 VAL O O 1.386 4.520 -8.283 1.00 . A A . 4 VAL O 1 1
2 237 1 1 5 VAL C C 4.299 6.390 -6.811 1.00 . A A . 5 VAL C 1 1
2 238 1 1 5 VAL CA C 2.949 5.735 -6.463 1.00 . A A . 5 VAL CA 1 1
2 239 1 1 5 VAL CB C 2.636 5.840 -4.962 1.00 . A A . 5 VAL CB 1 1
2 240 1 1 5 VAL CG1 C 1.119 5.890 -4.775 1.00 . A A . 5 VAL CG1 1 1
2 241 1 1 5 VAL CG2 C 3.188 4.641 -4.173 1.00 . A A . 5 VAL CG2 1 1
2 242 1 1 5 VAL H H 3.577 3.696 -6.307 1.00 . A A . 5 VAL H 1 1
2 243 1 1 5 VAL HA H 2.161 6.209 -7.025 1.00 . A A . 5 VAL HA 1 1
2 244 1 1 5 VAL HB H 3.070 6.742 -4.583 1.00 . A A . 5 VAL HB 1 1
2 245 1 1 5 VAL HG11 H 0.888 6.026 -3.729 1.00 . A A . 5 VAL HG11 1 1
2 246 1 1 5 VAL HG12 H 0.683 4.966 -5.124 1.00 . A A . 5 VAL HG12 1 1
2 247 1 1 5 VAL HG13 H 0.714 6.716 -5.344 1.00 . A A . 5 VAL HG13 1 1
2 248 1 1 5 VAL HG21 H 2.432 3.873 -4.104 1.00 . A A . 5 VAL HG21 1 1
2 249 1 1 5 VAL HG22 H 3.463 4.964 -3.178 1.00 . A A . 5 VAL HG22 1 1
2 250 1 1 5 VAL HG23 H 4.053 4.244 -4.669 1.00 . A A . 5 VAL HG23 1 1
2 251 1 1 5 VAL N N 2.968 4.284 -6.777 1.00 . A A . 5 VAL N 1 1
2 252 1 1 5 VAL O O 5.206 5.748 -7.312 1.00 . A A . 5 VAL O 1 1
2 253 1 1 6 ARG C C 6.834 8.048 -5.951 1.00 . A A . 6 ARG C 1 1
2 254 1 1 6 ARG CA C 5.712 8.369 -6.926 1.00 . A A . 6 ARG CA 1 1
2 255 1 1 6 ARG CB C 5.384 9.860 -6.858 1.00 . A A . 6 ARG CB 1 1
2 256 1 1 6 ARG CD C 3.717 11.579 -7.578 1.00 . A A . 6 ARG CD 1 1
2 257 1 1 6 ARG CG C 4.338 10.220 -7.915 1.00 . A A . 6 ARG CG 1 1
2 258 1 1 6 ARG CZ C 1.360 12.114 -7.742 1.00 . A A . 6 ARG CZ 1 1
2 259 1 1 6 ARG H H 3.696 8.176 -6.166 1.00 . A A . 6 ARG H 1 1
2 260 1 1 6 ARG HA H 6.005 8.107 -7.921 1.00 . A A . 6 ARG HA 1 1
2 261 1 1 6 ARG HB2 H 4.998 10.095 -5.877 1.00 . A A . 6 ARG HB2 1 1
2 262 1 1 6 ARG HB3 H 6.283 10.432 -7.035 1.00 . A A . 6 ARG HB3 1 1
2 263 1 1 6 ARG HD2 H 3.554 11.662 -6.511 1.00 . A A . 6 ARG HD2 1 1
2 264 1 1 6 ARG HD3 H 4.352 12.380 -7.925 1.00 . A A . 6 ARG HD3 1 1
2 265 1 1 6 ARG HE H 2.360 11.232 -9.213 1.00 . A A . 6 ARG HE 1 1
2 266 1 1 6 ARG HG2 H 4.812 10.270 -8.885 1.00 . A A . 6 ARG HG2 1 1
2 267 1 1 6 ARG HG3 H 3.566 9.466 -7.929 1.00 . A A . 6 ARG HG3 1 1
2 268 1 1 6 ARG HH11 H 1.722 13.975 -8.389 1.00 . A A . 6 ARG HH11 1 1
2 269 1 1 6 ARG HH12 H 0.293 13.781 -7.427 1.00 . A A . 6 ARG HH12 1 1
2 270 1 1 6 ARG HH21 H 0.745 10.376 -6.963 1.00 . A A . 6 ARG HH21 1 1
2 271 1 1 6 ARG HH22 H -0.259 11.746 -6.622 1.00 . A A . 6 ARG HH22 1 1
2 272 1 1 6 ARG N N 4.437 7.670 -6.561 1.00 . A A . 6 ARG N 1 1
2 273 1 1 6 ARG NE N 2.419 11.602 -8.307 1.00 . A A . 6 ARG NE 1 1
2 274 1 1 6 ARG NH1 N 1.105 13.390 -7.862 1.00 . A A . 6 ARG NH1 1 1
2 275 1 1 6 ARG NH2 N 0.553 11.353 -7.055 1.00 . A A . 6 ARG NH2 1 1
2 276 1 1 6 ARG O O 7.996 8.260 -6.242 1.00 . A A . 6 ARG O 1 1
2 277 1 1 7 GLY C C 8.348 5.950 -4.386 1.00 . A A . 7 GLY C 1 1
2 278 1 1 7 GLY CA C 7.596 7.171 -3.855 1.00 . A A . 7 GLY CA 1 1
2 279 1 1 7 GLY H H 5.580 7.331 -4.605 1.00 . A A . 7 GLY H 1 1
2 280 1 1 7 GLY HA2 H 8.277 8.006 -3.752 1.00 . A A . 7 GLY HA2 1 1
2 281 1 1 7 GLY HA3 H 7.164 6.936 -2.897 1.00 . A A . 7 GLY HA3 1 1
2 282 1 1 7 GLY N N 6.518 7.517 -4.816 1.00 . A A . 7 GLY N 1 1
2 283 1 1 7 GLY O O 9.521 5.763 -4.117 1.00 . A A . 7 GLY O 1 1
2 284 1 1 8 ASP C C 7.565 3.382 -6.903 1.00 . A A . 8 ASP C 1 1
2 285 1 1 8 ASP CA C 8.348 3.911 -5.701 1.00 . A A . 8 ASP CA 1 1
2 286 1 1 8 ASP CB C 8.329 2.901 -4.555 1.00 . A A . 8 ASP CB 1 1
2 287 1 1 8 ASP CG C 9.595 3.067 -3.711 1.00 . A A . 8 ASP CG 1 1
2 288 1 1 8 ASP H H 6.740 5.299 -5.369 1.00 . A A . 8 ASP H 1 1
2 289 1 1 8 ASP HA H 9.367 4.135 -5.978 1.00 . A A . 8 ASP HA 1 1
2 290 1 1 8 ASP HB2 H 7.458 3.075 -3.938 1.00 . A A . 8 ASP HB2 1 1
2 291 1 1 8 ASP HB3 H 8.292 1.901 -4.956 1.00 . A A . 8 ASP HB3 1 1
2 292 1 1 8 ASP N N 7.679 5.119 -5.146 1.00 . A A . 8 ASP N 1 1
2 293 1 1 8 ASP O O 6.757 2.489 -6.761 1.00 . A A . 8 ASP O 1 1
2 294 1 1 8 ASP OD1 O 10.657 2.709 -4.194 1.00 . A A . 8 ASP OD1 1 1
2 295 1 1 8 ASP OD2 O 9.481 3.551 -2.596 1.00 . A A . 8 ASP OD2 1 1
2 296 1 1 9 TYR C C 7.656 2.176 -9.876 1.00 . A A . 9 TYR C 1 1
2 297 1 1 9 TYR CA C 6.999 3.414 -9.257 1.00 . A A . 9 TYR CA 1 1
2 298 1 1 9 TYR CB C 7.014 4.571 -10.256 1.00 . A A . 9 TYR CB 1 1
2 299 1 1 9 TYR CD1 C 4.501 4.651 -10.313 1.00 . A A . 9 TYR CD1 1 1
2 300 1 1 9 TYR CD2 C 5.725 6.692 -9.868 1.00 . A A . 9 TYR CD2 1 1
2 301 1 1 9 TYR CE1 C 3.294 5.346 -10.192 1.00 . A A . 9 TYR CE1 1 1
2 302 1 1 9 TYR CE2 C 4.516 7.389 -9.752 1.00 . A A . 9 TYR CE2 1 1
2 303 1 1 9 TYR CG C 5.716 5.326 -10.150 1.00 . A A . 9 TYR CG 1 1
2 304 1 1 9 TYR CZ C 3.300 6.715 -9.913 1.00 . A A . 9 TYR CZ 1 1
2 305 1 1 9 TYR H H 8.424 4.641 -8.185 1.00 . A A . 9 TYR H 1 1
2 306 1 1 9 TYR HA H 5.977 3.198 -8.967 1.00 . A A . 9 TYR HA 1 1
2 307 1 1 9 TYR HB2 H 7.838 5.232 -10.032 1.00 . A A . 9 TYR HB2 1 1
2 308 1 1 9 TYR HB3 H 7.124 4.182 -11.257 1.00 . A A . 9 TYR HB3 1 1
2 309 1 1 9 TYR HD1 H 4.497 3.594 -10.528 1.00 . A A . 9 TYR HD1 1 1
2 310 1 1 9 TYR HD2 H 6.665 7.208 -9.741 1.00 . A A . 9 TYR HD2 1 1
2 311 1 1 9 TYR HE1 H 2.355 4.825 -10.319 1.00 . A A . 9 TYR HE1 1 1
2 312 1 1 9 TYR HE2 H 4.522 8.446 -9.538 1.00 . A A . 9 TYR HE2 1 1
2 313 1 1 9 TYR HH H 1.496 6.845 -9.301 1.00 . A A . 9 TYR HH 1 1
2 314 1 1 9 TYR N N 7.778 3.911 -8.079 1.00 . A A . 9 TYR N 1 1
2 315 1 1 9 TYR O O 8.224 2.229 -10.951 1.00 . A A . 9 TYR O 1 1
2 316 1 1 9 TYR OH O 2.107 7.399 -9.793 1.00 . A A . 9 TYR OH 1 1
2 317 1 1 10 LEU C C 7.301 -1.430 -9.342 1.00 . A A . 10 LEU C 1 1
2 318 1 1 10 LEU CA C 8.124 -0.208 -9.773 1.00 . A A . 10 LEU CA 1 1
2 319 1 1 10 LEU CB C 9.574 -0.304 -9.282 1.00 . A A . 10 LEU CB 1 1
2 320 1 1 10 LEU CD1 C 9.799 1.449 -7.492 1.00 . A A . 10 LEU CD1 1 1
2 321 1 1 10 LEU CD2 C 8.581 -0.682 -6.971 1.00 . A A . 10 LEU CD2 1 1
2 322 1 1 10 LEU CG C 9.725 -0.052 -7.775 1.00 . A A . 10 LEU CG 1 1
2 323 1 1 10 LEU H H 7.054 1.035 -8.374 1.00 . A A . 10 LEU H 1 1
2 324 1 1 10 LEU HA H 8.134 -0.149 -10.841 1.00 . A A . 10 LEU HA 1 1
2 325 1 1 10 LEU HB2 H 9.949 -1.291 -9.504 1.00 . A A . 10 LEU HB2 1 1
2 326 1 1 10 LEU HB3 H 10.169 0.420 -9.818 1.00 . A A . 10 LEU HB3 1 1
2 327 1 1 10 LEU HD11 H 10.831 1.735 -7.347 1.00 . A A . 10 LEU HD11 1 1
2 328 1 1 10 LEU HD12 H 9.239 1.674 -6.601 1.00 . A A . 10 LEU HD12 1 1
2 329 1 1 10 LEU HD13 H 9.390 1.997 -8.324 1.00 . A A . 10 LEU HD13 1 1
2 330 1 1 10 LEU HD21 H 8.780 -0.568 -5.915 1.00 . A A . 10 LEU HD21 1 1
2 331 1 1 10 LEU HD22 H 8.506 -1.732 -7.210 1.00 . A A . 10 LEU HD22 1 1
2 332 1 1 10 LEU HD23 H 7.652 -0.193 -7.214 1.00 . A A . 10 LEU HD23 1 1
2 333 1 1 10 LEU HG H 10.649 -0.501 -7.470 1.00 . A A . 10 LEU HG 1 1
2 334 1 1 10 LEU N N 7.547 1.052 -9.217 1.00 . A A . 10 LEU N 1 1
2 335 1 1 10 LEU O O 7.742 -2.557 -9.459 1.00 . A A . 10 LEU O 1 1
2 336 1 1 11 ASP C C 4.242 -2.728 -9.482 1.00 . A A . 11 ASP C 1 1
2 337 1 1 11 ASP CA C 5.261 -2.364 -8.398 1.00 . A A . 11 ASP CA 1 1
2 338 1 1 11 ASP CB C 4.547 -1.856 -7.148 1.00 . A A . 11 ASP CB 1 1
2 339 1 1 11 ASP CG C 4.221 -3.032 -6.229 1.00 . A A . 11 ASP CG 1 1
2 340 1 1 11 ASP H H 5.773 -0.303 -8.757 1.00 . A A . 11 ASP H 1 1
2 341 1 1 11 ASP HA H 5.874 -3.219 -8.151 1.00 . A A . 11 ASP HA 1 1
2 342 1 1 11 ASP HB2 H 5.185 -1.157 -6.629 1.00 . A A . 11 ASP HB2 1 1
2 343 1 1 11 ASP HB3 H 3.632 -1.364 -7.436 1.00 . A A . 11 ASP HB3 1 1
2 344 1 1 11 ASP N N 6.111 -1.218 -8.842 1.00 . A A . 11 ASP N 1 1
2 345 1 1 11 ASP O O 3.925 -1.929 -10.338 1.00 . A A . 11 ASP O 1 1
2 346 1 1 11 ASP OD1 O 5.145 -3.714 -5.822 1.00 . A A . 11 ASP OD1 1 1
2 347 1 1 11 ASP OD2 O 3.050 -3.228 -5.945 1.00 . A A . 11 ASP OD2 1 1
2 348 1 1 12 CYS C C 1.310 -4.270 -9.900 1.00 . A A . 12 CYS C 1 1
2 349 1 1 12 CYS CA C 2.728 -4.338 -10.477 1.00 . A A . 12 CYS CA 1 1
2 350 1 1 12 CYS CB C 3.095 -5.778 -10.830 1.00 . A A . 12 CYS CB 1 1
2 351 1 1 12 CYS H H 3.994 -4.557 -8.749 1.00 . A A . 12 CYS H 1 1
2 352 1 1 12 CYS HA H 2.809 -3.711 -11.350 1.00 . A A . 12 CYS HA 1 1
2 353 1 1 12 CYS HB2 H 3.202 -6.354 -9.923 1.00 . A A . 12 CYS HB2 1 1
2 354 1 1 12 CYS HB3 H 2.317 -6.210 -11.442 1.00 . A A . 12 CYS HB3 1 1
2 355 1 1 12 CYS N N 3.727 -3.927 -9.450 1.00 . A A . 12 CYS N 1 1
2 356 1 1 12 CYS O O 0.340 -4.249 -10.631 1.00 . A A . 12 CYS O 1 1
2 357 1 1 12 CYS SG S 4.659 -5.796 -11.743 1.00 . A A . 12 CYS SG 1 1
2 358 1 1 13 NH2 HN1 H 1.929 -4.243 -8.013 1.00 . A A . 13 NH2 HN1 1 1
2 359 1 1 13 NH2 HN2 H 0.246 -4.176 -8.226 1.00 . A A . 13 NH2 HN2 1 1
2 360 1 1 13 NH2 N N 1.149 -4.227 -8.605 1.00 . A A . 13 NH2 N 1 1
3 361 1 1 1 ACE C C 0.874 -5.165 -10.618 1.00 . A A . 1 ACE C 1 1
3 362 1 1 1 ACE CH3 C -0.102 -6.282 -10.244 1.00 . A A . 1 ACE CH3 1 1
3 363 1 1 1 ACE H1 H -0.857 -6.372 -11.010 1.00 . A A . 1 ACE H1 1 1
3 364 1 1 1 ACE H2 H -0.571 -6.048 -9.300 1.00 . A A . 1 ACE H2 1 1
3 365 1 1 1 ACE H3 H 0.436 -7.215 -10.158 1.00 . A A . 1 ACE H3 1 1
3 366 1 1 1 ACE O O 1.762 -4.821 -9.860 1.00 . A A . 1 ACE O 1 1
3 367 1 1 2 CYS C C 1.114 -2.144 -11.722 1.00 . A A . 2 CYS C 1 1
3 368 1 1 2 CYS CA C 1.639 -3.500 -12.205 1.00 . A A . 2 CYS CA 1 1
3 369 1 1 2 CYS CB C 1.654 -3.557 -13.734 1.00 . A A . 2 CYS CB 1 1
3 370 1 1 2 CYS H H -0.001 -4.887 -12.381 1.00 . A A . 2 CYS H 1 1
3 371 1 1 2 CYS HA H 2.632 -3.675 -11.821 1.00 . A A . 2 CYS HA 1 1
3 372 1 1 2 CYS HB2 H 0.662 -3.781 -14.094 1.00 . A A . 2 CYS HB2 1 1
3 373 1 1 2 CYS HB3 H 1.974 -2.603 -14.127 1.00 . A A . 2 CYS HB3 1 1
3 374 1 1 2 CYS N N 0.719 -4.594 -11.783 1.00 . A A . 2 CYS N 1 1
3 375 1 1 2 CYS O O 0.452 -1.428 -12.447 1.00 . A A . 2 CYS O 1 1
3 376 1 1 2 CYS SG S 2.794 -4.849 -14.283 1.00 . A A . 2 CYS SG 1 1
3 377 1 1 3 ARG C C 2.120 0.448 -9.724 1.00 . A A . 3 ARG C 1 1
3 378 1 1 3 ARG CA C 0.929 -0.483 -9.962 1.00 . A A . 3 ARG CA 1 1
3 379 1 1 3 ARG CB C 0.244 -0.827 -8.639 1.00 . A A . 3 ARG CB 1 1
3 380 1 1 3 ARG CD C -2.001 0.094 -9.228 1.00 . A A . 3 ARG CD 1 1
3 381 1 1 3 ARG CG C -1.220 -1.180 -8.899 1.00 . A A . 3 ARG CG 1 1
3 382 1 1 3 ARG CZ C -3.782 1.162 -7.982 1.00 . A A . 3 ARG CZ 1 1
3 383 1 1 3 ARG H H 1.941 -2.385 -9.933 1.00 . A A . 3 ARG H 1 1
3 384 1 1 3 ARG HA H 0.221 -0.029 -10.639 1.00 . A A . 3 ARG HA 1 1
3 385 1 1 3 ARG HB2 H 0.744 -1.672 -8.186 1.00 . A A . 3 ARG HB2 1 1
3 386 1 1 3 ARG HB3 H 0.295 0.021 -7.974 1.00 . A A . 3 ARG HB3 1 1
3 387 1 1 3 ARG HD2 H -1.325 0.878 -9.541 1.00 . A A . 3 ARG HD2 1 1
3 388 1 1 3 ARG HD3 H -2.735 -0.101 -9.993 1.00 . A A . 3 ARG HD3 1 1
3 389 1 1 3 ARG HE H -2.297 0.189 -7.096 1.00 . A A . 3 ARG HE 1 1
3 390 1 1 3 ARG HG2 H -1.283 -1.867 -9.732 1.00 . A A . 3 ARG HG2 1 1
3 391 1 1 3 ARG HG3 H -1.642 -1.642 -8.019 1.00 . A A . 3 ARG HG3 1 1
3 392 1 1 3 ARG HH11 H -2.872 2.870 -8.498 1.00 . A A . 3 ARG HH11 1 1
3 393 1 1 3 ARG HH12 H -4.592 2.965 -8.310 1.00 . A A . 3 ARG HH12 1 1
3 394 1 1 3 ARG HH21 H -4.950 -0.381 -7.472 1.00 . A A . 3 ARG HH21 1 1
3 395 1 1 3 ARG HH22 H -5.768 1.124 -7.728 1.00 . A A . 3 ARG HH22 1 1
3 396 1 1 3 ARG N N 1.405 -1.790 -10.499 1.00 . A A . 3 ARG N 1 1
3 397 1 1 3 ARG NE N -2.679 0.466 -7.955 1.00 . A A . 3 ARG NE 1 1
3 398 1 1 3 ARG NH1 N -3.746 2.431 -8.287 1.00 . A A . 3 ARG NH1 1 1
3 399 1 1 3 ARG NH2 N -4.922 0.591 -7.706 1.00 . A A . 3 ARG NH2 1 1
3 400 1 1 3 ARG O O 3.257 0.013 -9.698 1.00 . A A . 3 ARG O 1 1
3 401 1 1 4 VAL C C 2.689 3.662 -8.198 1.00 . A A . 4 VAL C 1 1
3 402 1 1 4 VAL CA C 3.024 2.646 -9.296 1.00 . A A . 4 VAL CA 1 1
3 403 1 1 4 VAL CB C 3.277 3.363 -10.635 1.00 . A A . 4 VAL CB 1 1
3 404 1 1 4 VAL CG1 C 2.444 4.645 -10.725 1.00 . A A . 4 VAL CG1 1 1
3 405 1 1 4 VAL CG2 C 4.760 3.729 -10.735 1.00 . A A . 4 VAL CG2 1 1
3 406 1 1 4 VAL H H 0.962 2.062 -9.561 1.00 . A A . 4 VAL H 1 1
3 407 1 1 4 VAL HA H 3.902 2.083 -9.019 1.00 . A A . 4 VAL HA 1 1
3 408 1 1 4 VAL HB H 3.012 2.708 -11.448 1.00 . A A . 4 VAL HB 1 1
3 409 1 1 4 VAL HG11 H 2.356 4.946 -11.760 1.00 . A A . 4 VAL HG11 1 1
3 410 1 1 4 VAL HG12 H 2.931 5.430 -10.164 1.00 . A A . 4 VAL HG12 1 1
3 411 1 1 4 VAL HG13 H 1.461 4.466 -10.317 1.00 . A A . 4 VAL HG13 1 1
3 412 1 1 4 VAL HG21 H 4.930 4.297 -11.636 1.00 . A A . 4 VAL HG21 1 1
3 413 1 1 4 VAL HG22 H 5.354 2.827 -10.759 1.00 . A A . 4 VAL HG22 1 1
3 414 1 1 4 VAL HG23 H 5.043 4.322 -9.876 1.00 . A A . 4 VAL HG23 1 1
3 415 1 1 4 VAL N N 1.882 1.719 -9.539 1.00 . A A . 4 VAL N 1 1
3 416 1 1 4 VAL O O 1.541 3.959 -7.931 1.00 . A A . 4 VAL O 1 1
3 417 1 1 5 VAL C C 4.552 6.338 -6.777 1.00 . A A . 5 VAL C 1 1
3 418 1 1 5 VAL CA C 3.498 5.255 -6.550 1.00 . A A . 5 VAL CA 1 1
3 419 1 1 5 VAL CB C 3.699 4.589 -5.180 1.00 . A A . 5 VAL CB 1 1
3 420 1 1 5 VAL CG1 C 2.683 5.166 -4.192 1.00 . A A . 5 VAL CG1 1 1
3 421 1 1 5 VAL CG2 C 3.494 3.074 -5.276 1.00 . A A . 5 VAL CG2 1 1
3 422 1 1 5 VAL H H 4.616 3.976 -7.865 1.00 . A A . 5 VAL H 1 1
3 423 1 1 5 VAL HA H 2.505 5.675 -6.622 1.00 . A A . 5 VAL HA 1 1
3 424 1 1 5 VAL HB H 4.698 4.805 -4.829 1.00 . A A . 5 VAL HB 1 1
3 425 1 1 5 VAL HG11 H 3.028 6.126 -3.838 1.00 . A A . 5 VAL HG11 1 1
3 426 1 1 5 VAL HG12 H 2.570 4.492 -3.358 1.00 . A A . 5 VAL HG12 1 1
3 427 1 1 5 VAL HG13 H 1.730 5.288 -4.689 1.00 . A A . 5 VAL HG13 1 1
3 428 1 1 5 VAL HG21 H 2.470 2.866 -5.549 1.00 . A A . 5 VAL HG21 1 1
3 429 1 1 5 VAL HG22 H 3.709 2.621 -4.318 1.00 . A A . 5 VAL HG22 1 1
3 430 1 1 5 VAL HG23 H 4.156 2.663 -6.022 1.00 . A A . 5 VAL HG23 1 1
3 431 1 1 5 VAL N N 3.702 4.217 -7.598 1.00 . A A . 5 VAL N 1 1
3 432 1 1 5 VAL O O 5.631 6.061 -7.272 1.00 . A A . 5 VAL O 1 1
3 433 1 1 6 ARG C C 6.388 8.488 -5.579 1.00 . A A . 6 ARG C 1 1
3 434 1 1 6 ARG CA C 5.307 8.614 -6.647 1.00 . A A . 6 ARG CA 1 1
3 435 1 1 6 ARG CB C 4.568 9.953 -6.546 1.00 . A A . 6 ARG CB 1 1
3 436 1 1 6 ARG CD C 4.192 11.397 -4.551 1.00 . A A . 6 ARG CD 1 1
3 437 1 1 6 ARG CG C 3.864 10.050 -5.194 1.00 . A A . 6 ARG CG 1 1
3 438 1 1 6 ARG CZ C 3.240 13.579 -5.018 1.00 . A A . 6 ARG CZ 1 1
3 439 1 1 6 ARG H H 3.422 7.776 -6.006 1.00 . A A . 6 ARG H 1 1
3 440 1 1 6 ARG HA H 5.731 8.510 -7.625 1.00 . A A . 6 ARG HA 1 1
3 441 1 1 6 ARG HB2 H 5.278 10.766 -6.642 1.00 . A A . 6 ARG HB2 1 1
3 442 1 1 6 ARG HB3 H 3.835 10.026 -7.337 1.00 . A A . 6 ARG HB3 1 1
3 443 1 1 6 ARG HD2 H 3.732 11.469 -3.574 1.00 . A A . 6 ARG HD2 1 1
3 444 1 1 6 ARG HD3 H 5.261 11.528 -4.475 1.00 . A A . 6 ARG HD3 1 1
3 445 1 1 6 ARG HE H 3.528 12.214 -6.432 1.00 . A A . 6 ARG HE 1 1
3 446 1 1 6 ARG HG2 H 2.796 9.962 -5.339 1.00 . A A . 6 ARG HG2 1 1
3 447 1 1 6 ARG HG3 H 4.207 9.252 -4.554 1.00 . A A . 6 ARG HG3 1 1
3 448 1 1 6 ARG HH11 H 5.099 14.315 -4.905 1.00 . A A . 6 ARG HH11 1 1
3 449 1 1 6 ARG HH12 H 3.837 15.388 -4.402 1.00 . A A . 6 ARG HH12 1 1
3 450 1 1 6 ARG HH21 H 1.292 13.117 -5.023 1.00 . A A . 6 ARG HH21 1 1
3 451 1 1 6 ARG HH22 H 1.683 14.711 -4.469 1.00 . A A . 6 ARG HH22 1 1
3 452 1 1 6 ARG N N 4.282 7.558 -6.416 1.00 . A A . 6 ARG N 1 1
3 453 1 1 6 ARG NE N 3.619 12.414 -5.478 1.00 . A A . 6 ARG NE 1 1
3 454 1 1 6 ARG NH1 N 4.128 14.499 -4.754 1.00 . A A . 6 ARG NH1 1 1
3 455 1 1 6 ARG NH2 N 1.973 13.821 -4.821 1.00 . A A . 6 ARG NH2 1 1
3 456 1 1 6 ARG O O 6.400 9.185 -4.586 1.00 . A A . 6 ARG O 1 1
3 457 1 1 7 GLY C C 8.644 5.793 -4.833 1.00 . A A . 7 GLY C 1 1
3 458 1 1 7 GLY CA C 8.380 7.295 -4.821 1.00 . A A . 7 GLY CA 1 1
3 459 1 1 7 GLY H H 7.220 7.008 -6.594 1.00 . A A . 7 GLY H 1 1
3 460 1 1 7 GLY HA2 H 9.270 7.827 -5.126 1.00 . A A . 7 GLY HA2 1 1
3 461 1 1 7 GLY HA3 H 8.085 7.603 -3.830 1.00 . A A . 7 GLY HA3 1 1
3 462 1 1 7 GLY N N 7.283 7.559 -5.788 1.00 . A A . 7 GLY N 1 1
3 463 1 1 7 GLY O O 9.767 5.336 -4.721 1.00 . A A . 7 GLY O 1 1
3 464 1 1 8 ASP C C 7.270 3.100 -6.457 1.00 . A A . 8 ASP C 1 1
3 465 1 1 8 ASP CA C 7.760 3.549 -5.085 1.00 . A A . 8 ASP CA 1 1
3 466 1 1 8 ASP CB C 6.864 2.987 -3.976 1.00 . A A . 8 ASP CB 1 1
3 467 1 1 8 ASP CG C 7.626 2.992 -2.648 1.00 . A A . 8 ASP CG 1 1
3 468 1 1 8 ASP H H 6.717 5.423 -5.142 1.00 . A A . 8 ASP H 1 1
3 469 1 1 8 ASP HA H 8.790 3.258 -4.928 1.00 . A A . 8 ASP HA 1 1
3 470 1 1 8 ASP HB2 H 5.979 3.597 -3.886 1.00 . A A . 8 ASP HB2 1 1
3 471 1 1 8 ASP HB3 H 6.577 1.973 -4.220 1.00 . A A . 8 ASP HB3 1 1
3 472 1 1 8 ASP N N 7.605 5.024 -5.014 1.00 . A A . 8 ASP N 1 1
3 473 1 1 8 ASP O O 6.262 2.434 -6.584 1.00 . A A . 8 ASP O 1 1
3 474 1 1 8 ASP OD1 O 8.297 2.011 -2.369 1.00 . A A . 8 ASP OD1 1 1
3 475 1 1 8 ASP OD2 O 7.526 3.975 -1.935 1.00 . A A . 8 ASP OD2 1 1
3 476 1 1 9 TYR C C 7.859 1.646 -9.136 1.00 . A A . 9 TYR C 1 1
3 477 1 1 9 TYR CA C 7.515 3.109 -8.860 1.00 . A A . 9 TYR CA 1 1
3 478 1 1 9 TYR CB C 8.303 4.017 -9.824 1.00 . A A . 9 TYR CB 1 1
3 479 1 1 9 TYR CD1 C 7.026 6.193 -9.964 1.00 . A A . 9 TYR CD1 1 1
3 480 1 1 9 TYR CD2 C 9.072 6.128 -8.663 1.00 . A A . 9 TYR CD2 1 1
3 481 1 1 9 TYR CE1 C 6.869 7.547 -9.649 1.00 . A A . 9 TYR CE1 1 1
3 482 1 1 9 TYR CE2 C 8.914 7.483 -8.346 1.00 . A A . 9 TYR CE2 1 1
3 483 1 1 9 TYR CG C 8.127 5.481 -9.471 1.00 . A A . 9 TYR CG 1 1
3 484 1 1 9 TYR CZ C 7.813 8.192 -8.839 1.00 . A A . 9 TYR CZ 1 1
3 485 1 1 9 TYR H H 8.764 4.036 -7.377 1.00 . A A . 9 TYR H 1 1
3 486 1 1 9 TYR HA H 6.457 3.285 -8.971 1.00 . A A . 9 TYR HA 1 1
3 487 1 1 9 TYR HB2 H 9.347 3.765 -9.765 1.00 . A A . 9 TYR HB2 1 1
3 488 1 1 9 TYR HB3 H 7.954 3.852 -10.833 1.00 . A A . 9 TYR HB3 1 1
3 489 1 1 9 TYR HD1 H 6.296 5.697 -10.585 1.00 . A A . 9 TYR HD1 1 1
3 490 1 1 9 TYR HD2 H 9.922 5.582 -8.283 1.00 . A A . 9 TYR HD2 1 1
3 491 1 1 9 TYR HE1 H 6.019 8.095 -10.025 1.00 . A A . 9 TYR HE1 1 1
3 492 1 1 9 TYR HE2 H 9.642 7.979 -7.716 1.00 . A A . 9 TYR HE2 1 1
3 493 1 1 9 TYR HH H 8.179 10.039 -9.158 1.00 . A A . 9 TYR HH 1 1
3 494 1 1 9 TYR N N 7.967 3.483 -7.495 1.00 . A A . 9 TYR N 1 1
3 495 1 1 9 TYR O O 8.730 1.344 -9.923 1.00 . A A . 9 TYR O 1 1
3 496 1 1 9 TYR OH O 7.660 9.528 -8.529 1.00 . A A . 9 TYR OH 1 1
3 497 1 1 10 LEU C C 6.383 -1.205 -9.750 1.00 . A A . 10 LEU C 1 1
3 498 1 1 10 LEU CA C 7.416 -0.701 -8.743 1.00 . A A . 10 LEU CA 1 1
3 499 1 1 10 LEU CB C 7.201 -1.373 -7.380 1.00 . A A . 10 LEU CB 1 1
3 500 1 1 10 LEU CD1 C 9.700 -1.503 -7.139 1.00 . A A . 10 LEU CD1 1 1
3 501 1 1 10 LEU CD2 C 8.440 0.356 -6.044 1.00 . A A . 10 LEU CD2 1 1
3 502 1 1 10 LEU CG C 8.393 -1.122 -6.443 1.00 . A A . 10 LEU CG 1 1
3 503 1 1 10 LEU H H 6.450 1.012 -7.890 1.00 . A A . 10 LEU H 1 1
3 504 1 1 10 LEU HA H 8.422 -0.864 -9.095 1.00 . A A . 10 LEU HA 1 1
3 505 1 1 10 LEU HB2 H 6.305 -0.972 -6.927 1.00 . A A . 10 LEU HB2 1 1
3 506 1 1 10 LEU HB3 H 7.078 -2.438 -7.520 1.00 . A A . 10 LEU HB3 1 1
3 507 1 1 10 LEU HD11 H 10.460 -1.698 -6.395 1.00 . A A . 10 LEU HD11 1 1
3 508 1 1 10 LEU HD12 H 10.021 -0.690 -7.774 1.00 . A A . 10 LEU HD12 1 1
3 509 1 1 10 LEU HD13 H 9.546 -2.389 -7.737 1.00 . A A . 10 LEU HD13 1 1
3 510 1 1 10 LEU HD21 H 8.792 0.944 -6.878 1.00 . A A . 10 LEU HD21 1 1
3 511 1 1 10 LEU HD22 H 9.112 0.480 -5.208 1.00 . A A . 10 LEU HD22 1 1
3 512 1 1 10 LEU HD23 H 7.451 0.685 -5.763 1.00 . A A . 10 LEU HD23 1 1
3 513 1 1 10 LEU HG H 8.276 -1.727 -5.556 1.00 . A A . 10 LEU HG 1 1
3 514 1 1 10 LEU N N 7.161 0.741 -8.508 1.00 . A A . 10 LEU N 1 1
3 515 1 1 10 LEU O O 5.848 -2.289 -9.617 1.00 . A A . 10 LEU O 1 1
3 516 1 1 11 ASP C C 5.688 -1.690 -12.821 1.00 . A A . 11 ASP C 1 1
3 517 1 1 11 ASP CA C 5.051 -0.810 -11.748 1.00 . A A . 11 ASP CA 1 1
3 518 1 1 11 ASP CB C 4.549 0.512 -12.342 1.00 . A A . 11 ASP CB 1 1
3 519 1 1 11 ASP CG C 5.716 1.247 -13.009 1.00 . A A . 11 ASP CG 1 1
3 520 1 1 11 ASP H H 6.508 0.472 -10.812 1.00 . A A . 11 ASP H 1 1
3 521 1 1 11 ASP HA H 4.239 -1.326 -11.270 1.00 . A A . 11 ASP HA 1 1
3 522 1 1 11 ASP HB2 H 3.779 0.317 -13.076 1.00 . A A . 11 ASP HB2 1 1
3 523 1 1 11 ASP HB3 H 4.140 1.127 -11.553 1.00 . A A . 11 ASP HB3 1 1
3 524 1 1 11 ASP N N 6.079 -0.407 -10.744 1.00 . A A . 11 ASP N 1 1
3 525 1 1 11 ASP O O 5.702 -1.360 -13.990 1.00 . A A . 11 ASP O 1 1
3 526 1 1 11 ASP OD1 O 6.678 1.534 -12.316 1.00 . A A . 11 ASP OD1 1 1
3 527 1 1 11 ASP OD2 O 5.628 1.506 -14.197 1.00 . A A . 11 ASP OD2 1 1
3 528 1 1 12 CYS C C 7.497 -3.078 -14.549 1.00 . A A . 12 CYS C 1 1
3 529 1 1 12 CYS CA C 6.875 -3.780 -13.337 1.00 . A A . 12 CYS CA 1 1
3 530 1 1 12 CYS CB C 5.768 -4.744 -13.776 1.00 . A A . 12 CYS CB 1 1
3 531 1 1 12 CYS H H 6.174 -3.029 -11.448 1.00 . A A . 12 CYS H 1 1
3 532 1 1 12 CYS HA H 7.638 -4.330 -12.806 1.00 . A A . 12 CYS HA 1 1
3 533 1 1 12 CYS HB2 H 6.195 -5.515 -14.399 1.00 . A A . 12 CYS HB2 1 1
3 534 1 1 12 CYS HB3 H 5.323 -5.198 -12.902 1.00 . A A . 12 CYS HB3 1 1
3 535 1 1 12 CYS N N 6.216 -2.813 -12.404 1.00 . A A . 12 CYS N 1 1
3 536 1 1 12 CYS O O 7.378 -3.544 -15.665 1.00 . A A . 12 CYS O 1 1
3 537 1 1 12 CYS SG S 4.498 -3.859 -14.712 1.00 . A A . 12 CYS SG 1 1
3 538 1 1 13 NH2 HN1 H 8.290 -1.610 -13.474 1.00 . A A . 13 NH2 HN1 1 1
3 539 1 1 13 NH2 HN2 H 8.632 -1.562 -15.135 1.00 . A A . 13 NH2 HN2 1 1
3 540 1 1 13 NH2 N N 8.193 -1.991 -14.372 1.00 . A A . 13 NH2 N 1 1
4 541 1 1 1 ACE C C 2.372 -1.487 -15.143 1.00 . A A . 1 ACE C 1 1
4 542 1 1 1 ACE CH3 C 1.747 -1.850 -16.490 1.00 . A A . 1 ACE CH3 1 1
4 543 1 1 1 ACE H1 H 1.634 -2.923 -16.559 1.00 . A A . 1 ACE H1 1 1
4 544 1 1 1 ACE H2 H 2.386 -1.502 -17.288 1.00 . A A . 1 ACE H2 1 1
4 545 1 1 1 ACE H3 H 0.777 -1.381 -16.575 1.00 . A A . 1 ACE H3 1 1
4 546 1 1 1 ACE O O 2.732 -0.350 -14.906 1.00 . A A . 1 ACE O 1 1
4 547 1 1 2 CYS C C 2.296 -1.029 -12.232 1.00 . A A . 2 CYS C 1 1
4 548 1 1 2 CYS CA C 3.097 -2.136 -12.916 1.00 . A A . 2 CYS CA 1 1
4 549 1 1 2 CYS CB C 4.530 -1.662 -13.202 1.00 . A A . 2 CYS CB 1 1
4 550 1 1 2 CYS H H 2.199 -3.347 -14.461 1.00 . A A . 2 CYS H 1 1
4 551 1 1 2 CYS HA H 3.115 -3.023 -12.304 1.00 . A A . 2 CYS HA 1 1
4 552 1 1 2 CYS HB2 H 4.763 -1.824 -14.245 1.00 . A A . 2 CYS HB2 1 1
4 553 1 1 2 CYS HB3 H 4.612 -0.609 -12.976 1.00 . A A . 2 CYS HB3 1 1
4 554 1 1 2 CYS N N 2.500 -2.437 -14.253 1.00 . A A . 2 CYS N 1 1
4 555 1 1 2 CYS O O 1.309 -0.552 -12.758 1.00 . A A . 2 CYS O 1 1
4 556 1 1 2 CYS SG S 5.696 -2.591 -12.173 1.00 . A A . 2 CYS SG 1 1
4 557 1 1 3 ARG C C 2.670 1.813 -10.640 1.00 . A A . 3 ARG C 1 1
4 558 1 1 3 ARG CA C 1.973 0.485 -10.382 1.00 . A A . 3 ARG CA 1 1
4 559 1 1 3 ARG CB C 2.018 0.129 -8.900 1.00 . A A . 3 ARG CB 1 1
4 560 1 1 3 ARG CD C 0.985 -1.412 -7.245 1.00 . A A . 3 ARG CD 1 1
4 561 1 1 3 ARG CG C 0.746 -0.627 -8.531 1.00 . A A . 3 ARG CG 1 1
4 562 1 1 3 ARG CZ C -1.118 -2.366 -6.548 1.00 . A A . 3 ARG CZ 1 1
4 563 1 1 3 ARG H H 3.522 -0.986 -10.668 1.00 . A A . 3 ARG H 1 1
4 564 1 1 3 ARG HA H 0.950 0.522 -10.724 1.00 . A A . 3 ARG HA 1 1
4 565 1 1 3 ARG HB2 H 2.880 -0.492 -8.701 1.00 . A A . 3 ARG HB2 1 1
4 566 1 1 3 ARG HB3 H 2.079 1.033 -8.311 1.00 . A A . 3 ARG HB3 1 1
4 567 1 1 3 ARG HD2 H 1.981 -1.833 -7.243 1.00 . A A . 3 ARG HD2 1 1
4 568 1 1 3 ARG HD3 H 0.839 -0.778 -6.384 1.00 . A A . 3 ARG HD3 1 1
4 569 1 1 3 ARG HE H 0.106 -3.293 -7.804 1.00 . A A . 3 ARG HE 1 1
4 570 1 1 3 ARG HG2 H -0.062 0.076 -8.383 1.00 . A A . 3 ARG HG2 1 1
4 571 1 1 3 ARG HG3 H 0.488 -1.311 -9.326 1.00 . A A . 3 ARG HG3 1 1
4 572 1 1 3 ARG HH11 H -1.729 -0.712 -7.495 1.00 . A A . 3 ARG HH11 1 1
4 573 1 1 3 ARG HH12 H -2.766 -1.277 -6.228 1.00 . A A . 3 ARG HH12 1 1
4 574 1 1 3 ARG HH21 H -0.749 -3.984 -5.431 1.00 . A A . 3 ARG HH21 1 1
4 575 1 1 3 ARG HH22 H -2.210 -3.132 -5.058 1.00 . A A . 3 ARG HH22 1 1
4 576 1 1 3 ARG N N 2.715 -0.602 -11.075 1.00 . A A . 3 ARG N 1 1
4 577 1 1 3 ARG NE N -0.035 -2.490 -7.260 1.00 . A A . 3 ARG NE 1 1
4 578 1 1 3 ARG NH1 N -1.934 -1.374 -6.774 1.00 . A A . 3 ARG NH1 1 1
4 579 1 1 3 ARG NH2 N -1.379 -3.228 -5.605 1.00 . A A . 3 ARG NH2 1 1
4 580 1 1 3 ARG O O 3.738 1.856 -11.221 1.00 . A A . 3 ARG O 1 1
4 581 1 1 4 VAL C C 2.612 5.129 -9.248 1.00 . A A . 4 VAL C 1 1
4 582 1 1 4 VAL CA C 2.742 4.209 -10.466 1.00 . A A . 4 VAL CA 1 1
4 583 1 1 4 VAL CB C 2.024 4.806 -11.681 1.00 . A A . 4 VAL CB 1 1
4 584 1 1 4 VAL CG1 C 0.549 5.040 -11.350 1.00 . A A . 4 VAL CG1 1 1
4 585 1 1 4 VAL CG2 C 2.683 6.141 -12.050 1.00 . A A . 4 VAL CG2 1 1
4 586 1 1 4 VAL H H 1.223 2.855 -9.758 1.00 . A A . 4 VAL H 1 1
4 587 1 1 4 VAL HA H 3.785 4.057 -10.703 1.00 . A A . 4 VAL HA 1 1
4 588 1 1 4 VAL HB H 2.102 4.123 -12.516 1.00 . A A . 4 VAL HB 1 1
4 589 1 1 4 VAL HG11 H 0.248 4.373 -10.556 1.00 . A A . 4 VAL HG11 1 1
4 590 1 1 4 VAL HG12 H -0.052 4.849 -12.227 1.00 . A A . 4 VAL HG12 1 1
4 591 1 1 4 VAL HG13 H 0.411 6.062 -11.034 1.00 . A A . 4 VAL HG13 1 1
4 592 1 1 4 VAL HG21 H 2.217 6.938 -11.490 1.00 . A A . 4 VAL HG21 1 1
4 593 1 1 4 VAL HG22 H 2.563 6.325 -13.108 1.00 . A A . 4 VAL HG22 1 1
4 594 1 1 4 VAL HG23 H 3.736 6.101 -11.810 1.00 . A A . 4 VAL HG23 1 1
4 595 1 1 4 VAL N N 2.086 2.900 -10.222 1.00 . A A . 4 VAL N 1 1
4 596 1 1 4 VAL O O 2.115 6.234 -9.350 1.00 . A A . 4 VAL O 1 1
4 597 1 1 5 VAL C C 4.322 6.404 -6.892 1.00 . A A . 5 VAL C 1 1
4 598 1 1 5 VAL CA C 3.034 5.578 -6.914 1.00 . A A . 5 VAL CA 1 1
4 599 1 1 5 VAL CB C 2.940 4.653 -5.691 1.00 . A A . 5 VAL CB 1 1
4 600 1 1 5 VAL CG1 C 1.491 4.203 -5.518 1.00 . A A . 5 VAL CG1 1 1
4 601 1 1 5 VAL CG2 C 3.843 3.419 -5.845 1.00 . A A . 5 VAL CG2 1 1
4 602 1 1 5 VAL H H 3.509 3.827 -8.042 1.00 . A A . 5 VAL H 1 1
4 603 1 1 5 VAL HA H 2.169 6.225 -6.963 1.00 . A A . 5 VAL HA 1 1
4 604 1 1 5 VAL HB H 3.241 5.204 -4.821 1.00 . A A . 5 VAL HB 1 1
4 605 1 1 5 VAL HG11 H 1.404 3.605 -4.623 1.00 . A A . 5 VAL HG11 1 1
4 606 1 1 5 VAL HG12 H 1.191 3.618 -6.374 1.00 . A A . 5 VAL HG12 1 1
4 607 1 1 5 VAL HG13 H 0.855 5.071 -5.435 1.00 . A A . 5 VAL HG13 1 1
4 608 1 1 5 VAL HG21 H 3.281 2.614 -6.292 1.00 . A A . 5 VAL HG21 1 1
4 609 1 1 5 VAL HG22 H 4.199 3.111 -4.874 1.00 . A A . 5 VAL HG22 1 1
4 610 1 1 5 VAL HG23 H 4.685 3.663 -6.476 1.00 . A A . 5 VAL HG23 1 1
4 611 1 1 5 VAL N N 3.092 4.703 -8.107 1.00 . A A . 5 VAL N 1 1
4 612 1 1 5 VAL O O 5.406 5.900 -7.146 1.00 . A A . 5 VAL O 1 1
4 613 1 1 6 ARG C C 6.332 8.253 -5.465 1.00 . A A . 6 ARG C 1 1
4 614 1 1 6 ARG CA C 5.432 8.534 -6.662 1.00 . A A . 6 ARG CA 1 1
4 615 1 1 6 ARG CB C 4.915 9.982 -6.633 1.00 . A A . 6 ARG CB 1 1
4 616 1 1 6 ARG CD C 2.544 10.592 -6.106 1.00 . A A . 6 ARG CD 1 1
4 617 1 1 6 ARG CG C 3.889 10.167 -5.506 1.00 . A A . 6 ARG CG 1 1
4 618 1 1 6 ARG CZ C 0.316 10.656 -5.151 1.00 . A A . 6 ARG CZ 1 1
4 619 1 1 6 ARG H H 3.335 8.066 -6.450 1.00 . A A . 6 ARG H 1 1
4 620 1 1 6 ARG HA H 5.973 8.366 -7.582 1.00 . A A . 6 ARG HA 1 1
4 621 1 1 6 ARG HB2 H 5.746 10.654 -6.471 1.00 . A A . 6 ARG HB2 1 1
4 622 1 1 6 ARG HB3 H 4.450 10.213 -7.581 1.00 . A A . 6 ARG HB3 1 1
4 623 1 1 6 ARG HD2 H 2.635 11.560 -6.579 1.00 . A A . 6 ARG HD2 1 1
4 624 1 1 6 ARG HD3 H 2.200 9.856 -6.818 1.00 . A A . 6 ARG HD3 1 1
4 625 1 1 6 ARG HE H 1.958 10.714 -4.037 1.00 . A A . 6 ARG HE 1 1
4 626 1 1 6 ARG HG2 H 3.767 9.235 -4.970 1.00 . A A . 6 ARG HG2 1 1
4 627 1 1 6 ARG HG3 H 4.233 10.932 -4.825 1.00 . A A . 6 ARG HG3 1 1
4 628 1 1 6 ARG HH11 H 0.270 12.512 -5.902 1.00 . A A . 6 ARG HH11 1 1
4 629 1 1 6 ARG HH12 H -1.258 11.703 -5.814 1.00 . A A . 6 ARG HH12 1 1
4 630 1 1 6 ARG HH21 H 0.057 8.804 -4.438 1.00 . A A . 6 ARG HH21 1 1
4 631 1 1 6 ARG HH22 H -1.380 9.603 -4.986 1.00 . A A . 6 ARG HH22 1 1
4 632 1 1 6 ARG N N 4.215 7.674 -6.625 1.00 . A A . 6 ARG N 1 1
4 633 1 1 6 ARG NE N 1.606 10.662 -4.949 1.00 . A A . 6 ARG NE 1 1
4 634 1 1 6 ARG NH1 N -0.270 11.705 -5.663 1.00 . A A . 6 ARG NH1 1 1
4 635 1 1 6 ARG NH2 N -0.391 9.605 -4.834 1.00 . A A . 6 ARG NH2 1 1
4 636 1 1 6 ARG O O 6.005 8.532 -4.330 1.00 . A A . 6 ARG O 1 1
4 637 1 1 7 GLY C C 8.904 5.881 -4.881 1.00 . A A . 7 GLY C 1 1
4 638 1 1 7 GLY CA C 8.450 7.328 -4.682 1.00 . A A . 7 GLY CA 1 1
4 639 1 1 7 GLY H H 7.685 7.463 -6.679 1.00 . A A . 7 GLY H 1 1
4 640 1 1 7 GLY HA2 H 9.305 7.992 -4.745 1.00 . A A . 7 GLY HA2 1 1
4 641 1 1 7 GLY HA3 H 7.983 7.423 -3.712 1.00 . A A . 7 GLY HA3 1 1
4 642 1 1 7 GLY N N 7.474 7.676 -5.747 1.00 . A A . 7 GLY N 1 1
4 643 1 1 7 GLY O O 10.070 5.565 -4.749 1.00 . A A . 7 GLY O 1 1
4 644 1 1 8 ASP C C 7.290 2.868 -6.229 1.00 . A A . 8 ASP C 1 1
4 645 1 1 8 ASP CA C 8.370 3.576 -5.414 1.00 . A A . 8 ASP CA 1 1
4 646 1 1 8 ASP CB C 8.477 2.985 -4.007 1.00 . A A . 8 ASP CB 1 1
4 647 1 1 8 ASP CG C 9.907 3.160 -3.492 1.00 . A A . 8 ASP CG 1 1
4 648 1 1 8 ASP H H 7.056 5.282 -5.327 1.00 . A A . 8 ASP H 1 1
4 649 1 1 8 ASP HA H 9.324 3.513 -5.918 1.00 . A A . 8 ASP HA 1 1
4 650 1 1 8 ASP HB2 H 7.791 3.498 -3.350 1.00 . A A . 8 ASP HB2 1 1
4 651 1 1 8 ASP HB3 H 8.233 1.933 -4.037 1.00 . A A . 8 ASP HB3 1 1
4 652 1 1 8 ASP N N 7.989 5.001 -5.203 1.00 . A A . 8 ASP N 1 1
4 653 1 1 8 ASP O O 6.347 2.332 -5.682 1.00 . A A . 8 ASP O 1 1
4 654 1 1 8 ASP OD1 O 10.804 2.580 -4.083 1.00 . A A . 8 ASP OD1 1 1
4 655 1 1 8 ASP OD2 O 10.083 3.873 -2.518 1.00 . A A . 8 ASP OD2 1 1
4 656 1 1 9 TYR C C 6.997 1.323 -9.455 1.00 . A A . 9 TYR C 1 1
4 657 1 1 9 TYR CA C 6.366 2.213 -8.375 1.00 . A A . 9 TYR CA 1 1
4 658 1 1 9 TYR CB C 5.600 3.374 -9.007 1.00 . A A . 9 TYR CB 1 1
4 659 1 1 9 TYR CD1 C 7.394 5.083 -9.470 1.00 . A A . 9 TYR CD1 1 1
4 660 1 1 9 TYR CD2 C 6.428 3.868 -11.331 1.00 . A A . 9 TYR CD2 1 1
4 661 1 1 9 TYR CE1 C 8.228 5.778 -10.354 1.00 . A A . 9 TYR CE1 1 1
4 662 1 1 9 TYR CE2 C 7.261 4.560 -12.215 1.00 . A A . 9 TYR CE2 1 1
4 663 1 1 9 TYR CG C 6.494 4.128 -9.960 1.00 . A A . 9 TYR CG 1 1
4 664 1 1 9 TYR CZ C 8.161 5.515 -11.726 1.00 . A A . 9 TYR CZ 1 1
4 665 1 1 9 TYR H H 8.167 3.330 -7.944 1.00 . A A . 9 TYR H 1 1
4 666 1 1 9 TYR HA H 5.695 1.627 -7.761 1.00 . A A . 9 TYR HA 1 1
4 667 1 1 9 TYR HB2 H 4.743 2.991 -9.539 1.00 . A A . 9 TYR HB2 1 1
4 668 1 1 9 TYR HB3 H 5.270 4.041 -8.231 1.00 . A A . 9 TYR HB3 1 1
4 669 1 1 9 TYR HD1 H 7.442 5.284 -8.409 1.00 . A A . 9 TYR HD1 1 1
4 670 1 1 9 TYR HD2 H 5.733 3.132 -11.706 1.00 . A A . 9 TYR HD2 1 1
4 671 1 1 9 TYR HE1 H 8.924 6.514 -9.980 1.00 . A A . 9 TYR HE1 1 1
4 672 1 1 9 TYR HE2 H 7.210 4.358 -13.274 1.00 . A A . 9 TYR HE2 1 1
4 673 1 1 9 TYR HH H 8.428 6.700 -13.198 1.00 . A A . 9 TYR HH 1 1
4 674 1 1 9 TYR N N 7.408 2.875 -7.527 1.00 . A A . 9 TYR N 1 1
4 675 1 1 9 TYR O O 6.360 0.979 -10.434 1.00 . A A . 9 TYR O 1 1
4 676 1 1 9 TYR OH O 8.984 6.198 -12.599 1.00 . A A . 9 TYR OH 1 1
4 677 1 1 10 LEU C C 9.251 -1.295 -9.634 1.00 . A A . 10 LEU C 1 1
4 678 1 1 10 LEU CA C 8.878 0.039 -10.286 1.00 . A A . 10 LEU CA 1 1
4 679 1 1 10 LEU CB C 10.129 0.789 -10.754 1.00 . A A . 10 LEU CB 1 1
4 680 1 1 10 LEU CD1 C 11.057 2.293 -12.531 1.00 . A A . 10 LEU CD1 1 1
4 681 1 1 10 LEU CD2 C 9.636 0.340 -13.169 1.00 . A A . 10 LEU CD2 1 1
4 682 1 1 10 LEU CG C 9.860 1.433 -12.118 1.00 . A A . 10 LEU CG 1 1
4 683 1 1 10 LEU H H 8.711 1.204 -8.478 1.00 . A A . 10 LEU H 1 1
4 684 1 1 10 LEU HA H 8.213 -0.125 -11.119 1.00 . A A . 10 LEU HA 1 1
4 685 1 1 10 LEU HB2 H 10.379 1.557 -10.034 1.00 . A A . 10 LEU HB2 1 1
4 686 1 1 10 LEU HB3 H 10.950 0.095 -10.841 1.00 . A A . 10 LEU HB3 1 1
4 687 1 1 10 LEU HD11 H 10.888 2.694 -13.520 1.00 . A A . 10 LEU HD11 1 1
4 688 1 1 10 LEU HD12 H 11.951 1.688 -12.535 1.00 . A A . 10 LEU HD12 1 1
4 689 1 1 10 LEU HD13 H 11.176 3.106 -11.829 1.00 . A A . 10 LEU HD13 1 1
4 690 1 1 10 LEU HD21 H 10.581 0.085 -13.629 1.00 . A A . 10 LEU HD21 1 1
4 691 1 1 10 LEU HD22 H 8.954 0.701 -13.923 1.00 . A A . 10 LEU HD22 1 1
4 692 1 1 10 LEU HD23 H 9.219 -0.538 -12.697 1.00 . A A . 10 LEU HD23 1 1
4 693 1 1 10 LEU HG H 8.979 2.054 -12.052 1.00 . A A . 10 LEU HG 1 1
4 694 1 1 10 LEU N N 8.225 0.929 -9.278 1.00 . A A . 10 LEU N 1 1
4 695 1 1 10 LEU O O 10.410 -1.640 -9.519 1.00 . A A . 10 LEU O 1 1
4 696 1 1 11 ASP C C 7.832 -4.484 -9.296 1.00 . A A . 11 ASP C 1 1
4 697 1 1 11 ASP CA C 8.556 -3.359 -8.551 1.00 . A A . 11 ASP CA 1 1
4 698 1 1 11 ASP CB C 8.012 -3.221 -7.127 1.00 . A A . 11 ASP CB 1 1
4 699 1 1 11 ASP CG C 8.331 -4.490 -6.332 1.00 . A A . 11 ASP CG 1 1
4 700 1 1 11 ASP H H 7.343 -1.741 -9.303 1.00 . A A . 11 ASP H 1 1
4 701 1 1 11 ASP HA H 9.618 -3.545 -8.525 1.00 . A A . 11 ASP HA 1 1
4 702 1 1 11 ASP HB2 H 8.471 -2.370 -6.646 1.00 . A A . 11 ASP HB2 1 1
4 703 1 1 11 ASP HB3 H 6.941 -3.081 -7.161 1.00 . A A . 11 ASP HB3 1 1
4 704 1 1 11 ASP N N 8.269 -2.044 -9.201 1.00 . A A . 11 ASP N 1 1
4 705 1 1 11 ASP O O 8.373 -5.551 -9.506 1.00 . A A . 11 ASP O 1 1
4 706 1 1 11 ASP OD1 O 9.504 -4.770 -6.147 1.00 . A A . 11 ASP OD1 1 1
4 707 1 1 11 ASP OD2 O 7.397 -5.159 -5.920 1.00 . A A . 11 ASP OD2 1 1
4 708 1 1 12 CYS C C 5.846 -6.616 -9.655 1.00 . A A . 12 CYS C 1 1
4 709 1 1 12 CYS CA C 5.837 -5.295 -10.435 1.00 . A A . 12 CYS CA 1 1
4 710 1 1 12 CYS CB C 6.557 -5.462 -11.775 1.00 . A A . 12 CYS CB 1 1
4 711 1 1 12 CYS H H 6.197 -3.377 -9.516 1.00 . A A . 12 CYS H 1 1
4 712 1 1 12 CYS HA H 4.826 -4.963 -10.598 1.00 . A A . 12 CYS HA 1 1
4 713 1 1 12 CYS HB2 H 7.593 -5.170 -11.667 1.00 . A A . 12 CYS HB2 1 1
4 714 1 1 12 CYS HB3 H 6.504 -6.495 -12.083 1.00 . A A . 12 CYS HB3 1 1
4 715 1 1 12 CYS N N 6.609 -4.248 -9.698 1.00 . A A . 12 CYS N 1 1
4 716 1 1 12 CYS O O 6.501 -7.563 -10.041 1.00 . A A . 12 CYS O 1 1
4 717 1 1 12 CYS SG S 5.763 -4.421 -13.025 1.00 . A A . 12 CYS SG 1 1
4 718 1 1 13 NH2 HN1 H 4.600 -5.962 -8.253 1.00 . A A . 13 NH2 HN1 1 1
4 719 1 1 13 NH2 HN2 H 5.123 -7.566 -8.068 1.00 . A A . 13 NH2 HN2 1 1
4 720 1 1 13 NH2 N N 5.131 -6.722 -8.568 1.00 . A A . 13 NH2 N 1 1
5 721 1 1 1 ACE C C 1.959 -4.766 -5.990 1.00 . A A . 1 ACE C 1 1
5 722 1 1 1 ACE CH3 C 3.035 -5.829 -6.210 1.00 . A A . 1 ACE CH3 1 1
5 723 1 1 1 ACE H1 H 3.016 -6.151 -7.241 1.00 . A A . 1 ACE H1 1 1
5 724 1 1 1 ACE H2 H 2.846 -6.674 -5.563 1.00 . A A . 1 ACE H2 1 1
5 725 1 1 1 ACE H3 H 4.005 -5.411 -5.983 1.00 . A A . 1 ACE H3 1 1
5 726 1 1 1 ACE O O 1.164 -4.853 -5.073 1.00 . A A . 1 ACE O 1 1
5 727 1 1 2 CYS C C 0.935 -2.082 -5.273 1.00 . A A . 2 CYS C 1 1
5 728 1 1 2 CYS CA C 0.898 -2.686 -6.683 1.00 . A A . 2 CYS CA 1 1
5 729 1 1 2 CYS CB C -0.444 -3.376 -6.947 1.00 . A A . 2 CYS CB 1 1
5 730 1 1 2 CYS H H 2.576 -3.719 -7.558 1.00 . A A . 2 CYS H 1 1
5 731 1 1 2 CYS HA H 1.062 -1.916 -7.420 1.00 . A A . 2 CYS HA 1 1
5 732 1 1 2 CYS HB2 H -0.422 -4.377 -6.538 1.00 . A A . 2 CYS HB2 1 1
5 733 1 1 2 CYS HB3 H -1.237 -2.815 -6.478 1.00 . A A . 2 CYS HB3 1 1
5 734 1 1 2 CYS N N 1.925 -3.763 -6.827 1.00 . A A . 2 CYS N 1 1
5 735 1 1 2 CYS O O 0.031 -2.271 -4.482 1.00 . A A . 2 CYS O 1 1
5 736 1 1 2 CYS SG S -0.737 -3.461 -8.734 1.00 . A A . 2 CYS SG 1 1
5 737 1 1 3 ARG C C 1.763 0.776 -3.699 1.00 . A A . 3 ARG C 1 1
5 738 1 1 3 ARG CA C 2.059 -0.718 -3.602 1.00 . A A . 3 ARG CA 1 1
5 739 1 1 3 ARG CB C 3.497 -0.963 -3.137 1.00 . A A . 3 ARG CB 1 1
5 740 1 1 3 ARG CD C 4.928 -1.211 -1.106 1.00 . A A . 3 ARG CD 1 1
5 741 1 1 3 ARG CG C 3.642 -0.588 -1.661 1.00 . A A . 3 ARG CG 1 1
5 742 1 1 3 ARG CZ C 6.407 -0.539 0.687 1.00 . A A . 3 ARG CZ 1 1
5 743 1 1 3 ARG H H 2.684 -1.198 -5.611 1.00 . A A . 3 ARG H 1 1
5 744 1 1 3 ARG HA H 1.374 -1.184 -2.932 1.00 . A A . 3 ARG HA 1 1
5 745 1 1 3 ARG HB2 H 3.742 -2.006 -3.267 1.00 . A A . 3 ARG HB2 1 1
5 746 1 1 3 ARG HB3 H 4.171 -0.359 -3.721 1.00 . A A . 3 ARG HB3 1 1
5 747 1 1 3 ARG HD2 H 4.766 -2.253 -0.871 1.00 . A A . 3 ARG HD2 1 1
5 748 1 1 3 ARG HD3 H 5.733 -1.104 -1.818 1.00 . A A . 3 ARG HD3 1 1
5 749 1 1 3 ARG HE H 4.552 0.147 0.522 1.00 . A A . 3 ARG HE 1 1
5 750 1 1 3 ARG HG2 H 3.689 0.488 -1.566 1.00 . A A . 3 ARG HG2 1 1
5 751 1 1 3 ARG HG3 H 2.794 -0.964 -1.109 1.00 . A A . 3 ARG HG3 1 1
5 752 1 1 3 ARG HH11 H 6.503 -2.530 0.491 1.00 . A A . 3 ARG HH11 1 1
5 753 1 1 3 ARG HH12 H 7.871 -1.786 1.248 1.00 . A A . 3 ARG HH12 1 1
5 754 1 1 3 ARG HH21 H 6.586 1.426 1.014 1.00 . A A . 3 ARG HH21 1 1
5 755 1 1 3 ARG HH22 H 7.918 0.453 1.544 1.00 . A A . 3 ARG HH22 1 1
5 756 1 1 3 ARG N N 1.971 -1.345 -4.955 1.00 . A A . 3 ARG N 1 1
5 757 1 1 3 ARG NE N 5.232 -0.438 0.129 1.00 . A A . 3 ARG NE 1 1
5 758 1 1 3 ARG NH1 N 6.971 -1.710 0.819 1.00 . A A . 3 ARG NH1 1 1
5 759 1 1 3 ARG NH2 N 7.018 0.530 1.116 1.00 . A A . 3 ARG NH2 1 1
5 760 1 1 3 ARG O O 0.798 1.269 -3.148 1.00 . A A . 3 ARG O 1 1
5 761 1 1 4 VAL C C 2.820 3.434 -5.946 1.00 . A A . 4 VAL C 1 1
5 762 1 1 4 VAL CA C 2.372 2.961 -4.547 1.00 . A A . 4 VAL CA 1 1
5 763 1 1 4 VAL CB C 3.205 3.586 -3.413 1.00 . A A . 4 VAL CB 1 1
5 764 1 1 4 VAL CG1 C 4.666 3.747 -3.838 1.00 . A A . 4 VAL CG1 1 1
5 765 1 1 4 VAL CG2 C 2.623 4.954 -3.036 1.00 . A A . 4 VAL CG2 1 1
5 766 1 1 4 VAL H H 3.349 1.058 -4.827 1.00 . A A . 4 VAL H 1 1
5 767 1 1 4 VAL HA H 1.331 3.191 -4.398 1.00 . A A . 4 VAL HA 1 1
5 768 1 1 4 VAL HB H 3.161 2.936 -2.551 1.00 . A A . 4 VAL HB 1 1
5 769 1 1 4 VAL HG11 H 5.053 2.794 -4.165 1.00 . A A . 4 VAL HG11 1 1
5 770 1 1 4 VAL HG12 H 5.244 4.101 -2.997 1.00 . A A . 4 VAL HG12 1 1
5 771 1 1 4 VAL HG13 H 4.734 4.461 -4.643 1.00 . A A . 4 VAL HG13 1 1
5 772 1 1 4 VAL HG21 H 2.511 5.013 -1.962 1.00 . A A . 4 VAL HG21 1 1
5 773 1 1 4 VAL HG22 H 1.658 5.078 -3.504 1.00 . A A . 4 VAL HG22 1 1
5 774 1 1 4 VAL HG23 H 3.289 5.735 -3.370 1.00 . A A . 4 VAL HG23 1 1
5 775 1 1 4 VAL N N 2.588 1.491 -4.399 1.00 . A A . 4 VAL N 1 1
5 776 1 1 4 VAL O O 2.915 2.649 -6.871 1.00 . A A . 4 VAL O 1 1
5 777 1 1 5 VAL C C 4.671 6.206 -7.302 1.00 . A A . 5 VAL C 1 1
5 778 1 1 5 VAL CA C 3.510 5.218 -7.448 1.00 . A A . 5 VAL CA 1 1
5 779 1 1 5 VAL CB C 2.267 5.917 -8.014 1.00 . A A . 5 VAL CB 1 1
5 780 1 1 5 VAL CG1 C 2.609 6.595 -9.344 1.00 . A A . 5 VAL CG1 1 1
5 781 1 1 5 VAL CG2 C 1.163 4.883 -8.247 1.00 . A A . 5 VAL CG2 1 1
5 782 1 1 5 VAL H H 3.003 5.326 -5.365 1.00 . A A . 5 VAL H 1 1
5 783 1 1 5 VAL HA H 3.790 4.408 -8.082 1.00 . A A . 5 VAL HA 1 1
5 784 1 1 5 VAL HB H 1.921 6.661 -7.311 1.00 . A A . 5 VAL HB 1 1
5 785 1 1 5 VAL HG11 H 3.116 5.891 -9.988 1.00 . A A . 5 VAL HG11 1 1
5 786 1 1 5 VAL HG12 H 3.252 7.443 -9.161 1.00 . A A . 5 VAL HG12 1 1
5 787 1 1 5 VAL HG13 H 1.699 6.929 -9.821 1.00 . A A . 5 VAL HG13 1 1
5 788 1 1 5 VAL HG21 H 0.691 4.643 -7.306 1.00 . A A . 5 VAL HG21 1 1
5 789 1 1 5 VAL HG22 H 1.591 3.989 -8.673 1.00 . A A . 5 VAL HG22 1 1
5 790 1 1 5 VAL HG23 H 0.427 5.288 -8.926 1.00 . A A . 5 VAL HG23 1 1
5 791 1 1 5 VAL N N 3.085 4.707 -6.113 1.00 . A A . 5 VAL N 1 1
5 792 1 1 5 VAL O O 5.805 5.911 -7.628 1.00 . A A . 5 VAL O 1 1
5 793 1 1 6 ARG C C 6.334 8.055 -5.444 1.00 . A A . 6 ARG C 1 1
5 794 1 1 6 ARG CA C 5.469 8.397 -6.652 1.00 . A A . 6 ARG CA 1 1
5 795 1 1 6 ARG CB C 4.747 9.733 -6.456 1.00 . A A . 6 ARG CB 1 1
5 796 1 1 6 ARG CD C 2.516 10.391 -5.543 1.00 . A A . 6 ARG CD 1 1
5 797 1 1 6 ARG CG C 3.825 9.659 -5.236 1.00 . A A . 6 ARG CG 1 1
5 798 1 1 6 ARG CZ C 0.750 10.993 -4.001 1.00 . A A . 6 ARG CZ 1 1
5 799 1 1 6 ARG H H 3.471 7.579 -6.559 1.00 . A A . 6 ARG H 1 1
5 800 1 1 6 ARG HA H 6.077 8.438 -7.538 1.00 . A A . 6 ARG HA 1 1
5 801 1 1 6 ARG HB2 H 5.478 10.513 -6.304 1.00 . A A . 6 ARG HB2 1 1
5 802 1 1 6 ARG HB3 H 4.162 9.955 -7.334 1.00 . A A . 6 ARG HB3 1 1
5 803 1 1 6 ARG HD2 H 2.695 11.454 -5.638 1.00 . A A . 6 ARG HD2 1 1
5 804 1 1 6 ARG HD3 H 2.068 10.002 -6.444 1.00 . A A . 6 ARG HD3 1 1
5 805 1 1 6 ARG HE H 1.728 9.268 -3.885 1.00 . A A . 6 ARG HE 1 1
5 806 1 1 6 ARG HG2 H 3.614 8.626 -5.002 1.00 . A A . 6 ARG HG2 1 1
5 807 1 1 6 ARG HG3 H 4.307 10.128 -4.392 1.00 . A A . 6 ARG HG3 1 1
5 808 1 1 6 ARG HH11 H -0.675 10.296 -5.222 1.00 . A A . 6 ARG HH11 1 1
5 809 1 1 6 ARG HH12 H -1.123 11.654 -4.245 1.00 . A A . 6 ARG HH12 1 1
5 810 1 1 6 ARG HH21 H 1.971 11.898 -2.698 1.00 . A A . 6 ARG HH21 1 1
5 811 1 1 6 ARG HH22 H 0.376 12.561 -2.816 1.00 . A A . 6 ARG HH22 1 1
5 812 1 1 6 ARG N N 4.390 7.375 -6.809 1.00 . A A . 6 ARG N 1 1
5 813 1 1 6 ARG NE N 1.638 10.113 -4.375 1.00 . A A . 6 ARG NE 1 1
5 814 1 1 6 ARG NH1 N -0.442 10.981 -4.530 1.00 . A A . 6 ARG NH1 1 1
5 815 1 1 6 ARG NH2 N 1.056 11.887 -3.102 1.00 . A A . 6 ARG NH2 1 1
5 816 1 1 6 ARG O O 5.866 7.942 -4.328 1.00 . A A . 6 ARG O 1 1
5 817 1 1 7 GLY C C 8.814 5.960 -4.762 1.00 . A A . 7 GLY C 1 1
5 818 1 1 7 GLY CA C 8.531 7.454 -4.606 1.00 . A A . 7 GLY CA 1 1
5 819 1 1 7 GLY H H 7.924 7.913 -6.612 1.00 . A A . 7 GLY H 1 1
5 820 1 1 7 GLY HA2 H 9.452 8.018 -4.695 1.00 . A A . 7 GLY HA2 1 1
5 821 1 1 7 GLY HA3 H 8.077 7.639 -3.645 1.00 . A A . 7 GLY HA3 1 1
5 822 1 1 7 GLY N N 7.595 7.844 -5.692 1.00 . A A . 7 GLY N 1 1
5 823 1 1 7 GLY O O 9.895 5.482 -4.485 1.00 . A A . 7 GLY O 1 1
5 824 1 1 8 ASP C C 7.021 3.317 -6.529 1.00 . A A . 8 ASP C 1 1
5 825 1 1 8 ASP CA C 8.009 3.768 -5.452 1.00 . A A . 8 ASP CA 1 1
5 826 1 1 8 ASP CB C 7.714 3.109 -4.103 1.00 . A A . 8 ASP CB 1 1
5 827 1 1 8 ASP CG C 9.013 2.980 -3.303 1.00 . A A . 8 ASP CG 1 1
5 828 1 1 8 ASP H H 6.983 5.648 -5.478 1.00 . A A . 8 ASP H 1 1
5 829 1 1 8 ASP HA H 9.021 3.551 -5.757 1.00 . A A . 8 ASP HA 1 1
5 830 1 1 8 ASP HB2 H 7.017 3.720 -3.552 1.00 . A A . 8 ASP HB2 1 1
5 831 1 1 8 ASP HB3 H 7.292 2.128 -4.261 1.00 . A A . 8 ASP HB3 1 1
5 832 1 1 8 ASP N N 7.837 5.226 -5.235 1.00 . A A . 8 ASP N 1 1
5 833 1 1 8 ASP O O 5.901 2.945 -6.243 1.00 . A A . 8 ASP O 1 1
5 834 1 1 8 ASP OD1 O 9.833 2.158 -3.673 1.00 . A A . 8 ASP OD1 1 1
5 835 1 1 8 ASP OD2 O 9.164 3.708 -2.336 1.00 . A A . 8 ASP OD2 1 1
5 836 1 1 9 TYR C C 6.529 1.472 -9.109 1.00 . A A . 9 TYR C 1 1
5 837 1 1 9 TYR CA C 6.503 2.989 -8.880 1.00 . A A . 9 TYR CA 1 1
5 838 1 1 9 TYR CB C 7.066 3.692 -10.120 1.00 . A A . 9 TYR CB 1 1
5 839 1 1 9 TYR CD1 C 5.609 5.713 -10.498 1.00 . A A . 9 TYR CD1 1 1
5 840 1 1 9 TYR CD2 C 7.798 6.024 -9.503 1.00 . A A . 9 TYR CD2 1 1
5 841 1 1 9 TYR CE1 C 5.379 7.093 -10.423 1.00 . A A . 9 TYR CE1 1 1
5 842 1 1 9 TYR CE2 C 7.567 7.403 -9.428 1.00 . A A . 9 TYR CE2 1 1
5 843 1 1 9 TYR CG C 6.819 5.179 -10.038 1.00 . A A . 9 TYR CG 1 1
5 844 1 1 9 TYR CZ C 6.359 7.937 -9.887 1.00 . A A . 9 TYR CZ 1 1
5 845 1 1 9 TYR H H 8.315 3.710 -7.962 1.00 . A A . 9 TYR H 1 1
5 846 1 1 9 TYR HA H 5.496 3.335 -8.687 1.00 . A A . 9 TYR HA 1 1
5 847 1 1 9 TYR HB2 H 8.129 3.509 -10.181 1.00 . A A . 9 TYR HB2 1 1
5 848 1 1 9 TYR HB3 H 6.585 3.297 -11.002 1.00 . A A . 9 TYR HB3 1 1
5 849 1 1 9 TYR HD1 H 4.853 5.062 -10.912 1.00 . A A . 9 TYR HD1 1 1
5 850 1 1 9 TYR HD2 H 8.730 5.613 -9.148 1.00 . A A . 9 TYR HD2 1 1
5 851 1 1 9 TYR HE1 H 4.446 7.506 -10.778 1.00 . A A . 9 TYR HE1 1 1
5 852 1 1 9 TYR HE2 H 8.323 8.055 -9.015 1.00 . A A . 9 TYR HE2 1 1
5 853 1 1 9 TYR HH H 5.834 9.599 -10.671 1.00 . A A . 9 TYR HH 1 1
5 854 1 1 9 TYR N N 7.422 3.378 -7.765 1.00 . A A . 9 TYR N 1 1
5 855 1 1 9 TYR O O 7.284 0.970 -9.918 1.00 . A A . 9 TYR O 1 1
5 856 1 1 9 TYR OH O 6.133 9.297 -9.810 1.00 . A A . 9 TYR OH 1 1
5 857 1 1 10 LEU C C 4.223 -1.116 -9.085 1.00 . A A . 10 LEU C 1 1
5 858 1 1 10 LEU CA C 5.631 -0.734 -8.613 1.00 . A A . 10 LEU CA 1 1
5 859 1 1 10 LEU CB C 5.895 -1.339 -7.228 1.00 . A A . 10 LEU CB 1 1
5 860 1 1 10 LEU CD1 C 8.320 -1.450 -7.891 1.00 . A A . 10 LEU CD1 1 1
5 861 1 1 10 LEU CD2 C 7.515 0.381 -6.390 1.00 . A A . 10 LEU CD2 1 1
5 862 1 1 10 LEU CG C 7.341 -1.090 -6.772 1.00 . A A . 10 LEU CG 1 1
5 863 1 1 10 LEU H H 5.074 1.180 -7.791 1.00 . A A . 10 LEU H 1 1
5 864 1 1 10 LEU HA H 6.378 -1.063 -9.319 1.00 . A A . 10 LEU HA 1 1
5 865 1 1 10 LEU HB2 H 5.223 -0.887 -6.522 1.00 . A A . 10 LEU HB2 1 1
5 866 1 1 10 LEU HB3 H 5.712 -2.404 -7.263 1.00 . A A . 10 LEU HB3 1 1
5 867 1 1 10 LEU HD11 H 8.360 -0.644 -8.607 1.00 . A A . 10 LEU HD11 1 1
5 868 1 1 10 LEU HD12 H 7.987 -2.354 -8.381 1.00 . A A . 10 LEU HD12 1 1
5 869 1 1 10 LEU HD13 H 9.302 -1.608 -7.471 1.00 . A A . 10 LEU HD13 1 1
5 870 1 1 10 LEU HD21 H 8.002 0.908 -7.196 1.00 . A A . 10 LEU HD21 1 1
5 871 1 1 10 LEU HD22 H 8.118 0.451 -5.498 1.00 . A A . 10 LEU HD22 1 1
5 872 1 1 10 LEU HD23 H 6.546 0.821 -6.205 1.00 . A A . 10 LEU HD23 1 1
5 873 1 1 10 LEU HG H 7.548 -1.709 -5.910 1.00 . A A . 10 LEU HG 1 1
5 874 1 1 10 LEU N N 5.687 0.747 -8.423 1.00 . A A . 10 LEU N 1 1
5 875 1 1 10 LEU O O 3.418 -1.606 -8.319 1.00 . A A . 10 LEU O 1 1
5 876 1 1 11 ASP C C 2.489 -2.638 -11.368 1.00 . A A . 11 ASP C 1 1
5 877 1 1 11 ASP CA C 2.541 -1.207 -10.833 1.00 . A A . 11 ASP CA 1 1
5 878 1 1 11 ASP CB C 2.280 -0.206 -11.960 1.00 . A A . 11 ASP CB 1 1
5 879 1 1 11 ASP CG C 0.772 -0.067 -12.176 1.00 . A A . 11 ASP CG 1 1
5 880 1 1 11 ASP H H 4.568 -0.469 -10.931 1.00 . A A . 11 ASP H 1 1
5 881 1 1 11 ASP HA H 1.811 -1.071 -10.048 1.00 . A A . 11 ASP HA 1 1
5 882 1 1 11 ASP HB2 H 2.697 0.754 -11.691 1.00 . A A . 11 ASP HB2 1 1
5 883 1 1 11 ASP HB3 H 2.741 -0.559 -12.869 1.00 . A A . 11 ASP HB3 1 1
5 884 1 1 11 ASP N N 3.911 -0.879 -10.332 1.00 . A A . 11 ASP N 1 1
5 885 1 1 11 ASP O O 3.480 -3.187 -11.807 1.00 . A A . 11 ASP O 1 1
5 886 1 1 11 ASP OD1 O 0.220 -0.877 -12.902 1.00 . A A . 11 ASP OD1 1 1
5 887 1 1 11 ASP OD2 O 0.194 0.844 -11.606 1.00 . A A . 11 ASP OD2 1 1
5 888 1 1 12 CYS C C 1.014 -4.641 -13.340 1.00 . A A . 12 CYS C 1 1
5 889 1 1 12 CYS CA C 1.206 -4.640 -11.820 1.00 . A A . 12 CYS CA 1 1
5 890 1 1 12 CYS CB C -0.032 -5.206 -11.115 1.00 . A A . 12 CYS CB 1 1
5 891 1 1 12 CYS H H 0.552 -2.781 -10.958 1.00 . A A . 12 CYS H 1 1
5 892 1 1 12 CYS HA H 2.078 -5.213 -11.553 1.00 . A A . 12 CYS HA 1 1
5 893 1 1 12 CYS HB2 H -0.897 -4.618 -11.382 1.00 . A A . 12 CYS HB2 1 1
5 894 1 1 12 CYS HB3 H -0.185 -6.229 -11.427 1.00 . A A . 12 CYS HB3 1 1
5 895 1 1 12 CYS N N 1.335 -3.245 -11.322 1.00 . A A . 12 CYS N 1 1
5 896 1 1 12 CYS O O 1.116 -5.668 -13.981 1.00 . A A . 12 CYS O 1 1
5 897 1 1 12 CYS SG S 0.208 -5.150 -9.318 1.00 . A A . 12 CYS SG 1 1
5 898 1 1 13 NH2 HN1 H 0.660 -2.687 -13.437 1.00 . A A . 13 NH2 HN1 1 1
5 899 1 1 13 NH2 HN2 H 0.624 -3.507 -14.924 1.00 . A A . 13 NH2 HN2 1 1
5 900 1 1 13 NH2 N N 0.744 -3.518 -13.952 1.00 . A A . 13 NH2 N 1 1
6 901 1 1 1 ACE C C -3.314 -3.472 -12.503 1.00 . A A . 1 ACE C 1 1
6 902 1 1 1 ACE CH3 C -4.521 -3.910 -13.334 1.00 . A A . 1 ACE CH3 1 1
6 903 1 1 1 ACE H1 H -5.384 -4.006 -12.692 1.00 . A A . 1 ACE H1 1 1
6 904 1 1 1 ACE H2 H -4.310 -4.860 -13.801 1.00 . A A . 1 ACE H2 1 1
6 905 1 1 1 ACE H3 H -4.719 -3.170 -14.096 1.00 . A A . 1 ACE H3 1 1
6 906 1 1 1 ACE O O -3.307 -3.589 -11.292 1.00 . A A . 1 ACE O 1 1
6 907 1 1 2 CYS C C -1.274 -1.079 -11.889 1.00 . A A . 2 CYS C 1 1
6 908 1 1 2 CYS CA C -1.083 -2.519 -12.387 1.00 . A A . 2 CYS CA 1 1
6 909 1 1 2 CYS CB C 0.070 -2.601 -13.395 1.00 . A A . 2 CYS CB 1 1
6 910 1 1 2 CYS H H -2.319 -2.880 -14.118 1.00 . A A . 2 CYS H 1 1
6 911 1 1 2 CYS HA H -0.895 -3.180 -11.556 1.00 . A A . 2 CYS HA 1 1
6 912 1 1 2 CYS HB2 H -0.306 -2.949 -14.346 1.00 . A A . 2 CYS HB2 1 1
6 913 1 1 2 CYS HB3 H 0.509 -1.621 -13.521 1.00 . A A . 2 CYS HB3 1 1
6 914 1 1 2 CYS N N -2.292 -2.966 -13.142 1.00 . A A . 2 CYS N 1 1
6 915 1 1 2 CYS O O -2.028 -0.313 -12.456 1.00 . A A . 2 CYS O 1 1
6 916 1 1 2 CYS SG S 1.329 -3.753 -12.786 1.00 . A A . 2 CYS SG 1 1
6 917 1 1 3 ARG C C 0.656 1.228 -9.955 1.00 . A A . 3 ARG C 1 1
6 918 1 1 3 ARG CA C -0.729 0.678 -10.301 1.00 . A A . 3 ARG CA 1 1
6 919 1 1 3 ARG CB C -1.595 0.539 -9.047 1.00 . A A . 3 ARG CB 1 1
6 920 1 1 3 ARG CD C -3.949 0.561 -8.189 1.00 . A A . 3 ARG CD 1 1
6 921 1 1 3 ARG CG C -3.061 0.780 -9.418 1.00 . A A . 3 ARG CG 1 1
6 922 1 1 3 ARG CZ C -5.548 -1.227 -8.560 1.00 . A A . 3 ARG CZ 1 1
6 923 1 1 3 ARG H H 0.018 -1.341 -10.398 1.00 . A A . 3 ARG H 1 1
6 924 1 1 3 ARG HA H -1.218 1.315 -11.022 1.00 . A A . 3 ARG HA 1 1
6 925 1 1 3 ARG HB2 H -1.483 -0.456 -8.639 1.00 . A A . 3 ARG HB2 1 1
6 926 1 1 3 ARG HB3 H -1.287 1.267 -8.311 1.00 . A A . 3 ARG HB3 1 1
6 927 1 1 3 ARG HD2 H -3.398 0.777 -7.285 1.00 . A A . 3 ARG HD2 1 1
6 928 1 1 3 ARG HD3 H -4.832 1.178 -8.248 1.00 . A A . 3 ARG HD3 1 1
6 929 1 1 3 ARG HE H -3.666 -1.568 -8.023 1.00 . A A . 3 ARG HE 1 1
6 930 1 1 3 ARG HG2 H -3.180 1.795 -9.771 1.00 . A A . 3 ARG HG2 1 1
6 931 1 1 3 ARG HG3 H -3.353 0.092 -10.198 1.00 . A A . 3 ARG HG3 1 1
6 932 1 1 3 ARG HH11 H -5.189 -1.236 -10.529 1.00 . A A . 3 ARG HH11 1 1
6 933 1 1 3 ARG HH12 H -6.804 -1.647 -10.060 1.00 . A A . 3 ARG HH12 1 1
6 934 1 1 3 ARG HH21 H -6.193 -1.308 -6.666 1.00 . A A . 3 ARG HH21 1 1
6 935 1 1 3 ARG HH22 H -7.373 -1.688 -7.876 1.00 . A A . 3 ARG HH22 1 1
6 936 1 1 3 ARG N N -0.592 -0.708 -10.837 1.00 . A A . 3 ARG N 1 1
6 937 1 1 3 ARG NE N -4.330 -0.880 -8.236 1.00 . A A . 3 ARG NE 1 1
6 938 1 1 3 ARG NH1 N -5.872 -1.382 -9.815 1.00 . A A . 3 ARG NH1 1 1
6 939 1 1 3 ARG NH2 N -6.440 -1.423 -7.628 1.00 . A A . 3 ARG NH2 1 1
6 940 1 1 3 ARG O O 1.621 0.490 -9.900 1.00 . A A . 3 ARG O 1 1
6 941 1 1 4 VAL C C 2.061 4.154 -8.342 1.00 . A A . 4 VAL C 1 1
6 942 1 1 4 VAL CA C 2.123 3.072 -9.427 1.00 . A A . 4 VAL CA 1 1
6 943 1 1 4 VAL CB C 2.617 3.661 -10.752 1.00 . A A . 4 VAL CB 1 1
6 944 1 1 4 VAL CG1 C 1.921 4.999 -11.028 1.00 . A A . 4 VAL CG1 1 1
6 945 1 1 4 VAL CG2 C 4.128 3.876 -10.668 1.00 . A A . 4 VAL CG2 1 1
6 946 1 1 4 VAL H H -0.005 3.103 -9.803 1.00 . A A . 4 VAL H 1 1
6 947 1 1 4 VAL HA H 2.782 2.282 -9.119 1.00 . A A . 4 VAL HA 1 1
6 948 1 1 4 VAL HB H 2.395 2.975 -11.553 1.00 . A A . 4 VAL HB 1 1
6 949 1 1 4 VAL HG11 H 2.255 5.733 -10.311 1.00 . A A . 4 VAL HG11 1 1
6 950 1 1 4 VAL HG12 H 0.852 4.872 -10.942 1.00 . A A . 4 VAL HG12 1 1
6 951 1 1 4 VAL HG13 H 2.165 5.331 -12.027 1.00 . A A . 4 VAL HG13 1 1
6 952 1 1 4 VAL HG21 H 4.336 4.722 -10.029 1.00 . A A . 4 VAL HG21 1 1
6 953 1 1 4 VAL HG22 H 4.519 4.066 -11.656 1.00 . A A . 4 VAL HG22 1 1
6 954 1 1 4 VAL HG23 H 4.593 2.992 -10.257 1.00 . A A . 4 VAL HG23 1 1
6 955 1 1 4 VAL N N 0.776 2.513 -9.742 1.00 . A A . 4 VAL N 1 1
6 956 1 1 4 VAL O O 1.066 4.829 -8.168 1.00 . A A . 4 VAL O 1 1
6 957 1 1 5 VAL C C 4.402 6.296 -6.832 1.00 . A A . 5 VAL C 1 1
6 958 1 1 5 VAL CA C 3.203 5.377 -6.568 1.00 . A A . 5 VAL CA 1 1
6 959 1 1 5 VAL CB C 3.392 4.641 -5.225 1.00 . A A . 5 VAL CB 1 1
6 960 1 1 5 VAL CG1 C 2.251 5.010 -4.279 1.00 . A A . 5 VAL CG1 1 1
6 961 1 1 5 VAL CG2 C 3.403 3.116 -5.419 1.00 . A A . 5 VAL CG2 1 1
6 962 1 1 5 VAL H H 3.938 3.782 -7.814 1.00 . A A . 5 VAL H 1 1
6 963 1 1 5 VAL HA H 2.286 5.947 -6.556 1.00 . A A . 5 VAL HA 1 1
6 964 1 1 5 VAL HB H 4.329 4.953 -4.781 1.00 . A A . 5 VAL HB 1 1
6 965 1 1 5 VAL HG11 H 2.188 6.086 -4.193 1.00 . A A . 5 VAL HG11 1 1
6 966 1 1 5 VAL HG12 H 2.439 4.582 -3.306 1.00 . A A . 5 VAL HG12 1 1
6 967 1 1 5 VAL HG13 H 1.320 4.625 -4.668 1.00 . A A . 5 VAL HG13 1 1
6 968 1 1 5 VAL HG21 H 3.691 2.639 -4.493 1.00 . A A . 5 VAL HG21 1 1
6 969 1 1 5 VAL HG22 H 4.110 2.853 -6.188 1.00 . A A . 5 VAL HG22 1 1
6 970 1 1 5 VAL HG23 H 2.419 2.780 -5.704 1.00 . A A . 5 VAL HG23 1 1
6 971 1 1 5 VAL N N 3.147 4.330 -7.632 1.00 . A A . 5 VAL N 1 1
6 972 1 1 5 VAL O O 5.435 5.854 -7.305 1.00 . A A . 5 VAL O 1 1
6 973 1 1 6 ARG C C 6.435 8.357 -5.589 1.00 . A A . 6 ARG C 1 1
6 974 1 1 6 ARG CA C 5.459 8.469 -6.758 1.00 . A A . 6 ARG CA 1 1
6 975 1 1 6 ARG CB C 4.895 9.892 -6.898 1.00 . A A . 6 ARG CB 1 1
6 976 1 1 6 ARG CD C 3.964 11.759 -5.536 1.00 . A A . 6 ARG CD 1 1
6 977 1 1 6 ARG CG C 3.971 10.240 -5.728 1.00 . A A . 6 ARG CG 1 1
6 978 1 1 6 ARG CZ C 1.984 12.659 -4.475 1.00 . A A . 6 ARG CZ 1 1
6 979 1 1 6 ARG H H 3.469 7.903 -6.118 1.00 . A A . 6 ARG H 1 1
6 980 1 1 6 ARG HA H 5.954 8.186 -7.675 1.00 . A A . 6 ARG HA 1 1
6 981 1 1 6 ARG HB2 H 5.714 10.595 -6.922 1.00 . A A . 6 ARG HB2 1 1
6 982 1 1 6 ARG HB3 H 4.339 9.963 -7.822 1.00 . A A . 6 ARG HB3 1 1
6 983 1 1 6 ARG HD2 H 4.968 12.119 -5.354 1.00 . A A . 6 ARG HD2 1 1
6 984 1 1 6 ARG HD3 H 3.541 12.246 -6.403 1.00 . A A . 6 ARG HD3 1 1
6 985 1 1 6 ARG HE H 3.371 11.655 -3.470 1.00 . A A . 6 ARG HE 1 1
6 986 1 1 6 ARG HG2 H 2.968 9.900 -5.946 1.00 . A A . 6 ARG HG2 1 1
6 987 1 1 6 ARG HG3 H 4.326 9.766 -4.827 1.00 . A A . 6 ARG HG3 1 1
6 988 1 1 6 ARG HH11 H 2.879 14.448 -4.542 1.00 . A A . 6 ARG HH11 1 1
6 989 1 1 6 ARG HH12 H 1.152 14.470 -4.665 1.00 . A A . 6 ARG HH12 1 1
6 990 1 1 6 ARG HH21 H 0.830 11.023 -4.442 1.00 . A A . 6 ARG HH21 1 1
6 991 1 1 6 ARG HH22 H -0.009 12.529 -4.608 1.00 . A A . 6 ARG HH22 1 1
6 992 1 1 6 ARG N N 4.296 7.561 -6.515 1.00 . A A . 6 ARG N 1 1
6 993 1 1 6 ARG NE N 3.101 11.996 -4.347 1.00 . A A . 6 ARG NE 1 1
6 994 1 1 6 ARG NH1 N 2.007 13.960 -4.568 1.00 . A A . 6 ARG NH1 1 1
6 995 1 1 6 ARG NH2 N 0.847 12.021 -4.512 1.00 . A A . 6 ARG NH2 1 1
6 996 1 1 6 ARG O O 6.236 8.900 -4.520 1.00 . A A . 6 ARG O 1 1
6 997 1 1 7 GLY C C 8.795 5.862 -4.713 1.00 . A A . 7 GLY C 1 1
6 998 1 1 7 GLY CA C 8.484 7.365 -4.729 1.00 . A A . 7 GLY CA 1 1
6 999 1 1 7 GLY H H 7.580 7.159 -6.664 1.00 . A A . 7 GLY H 1 1
6 1000 1 1 7 GLY HA2 H 9.383 7.929 -4.945 1.00 . A A . 7 GLY HA2 1 1
6 1001 1 1 7 GLY HA3 H 8.083 7.663 -3.772 1.00 . A A . 7 GLY HA3 1 1
6 1002 1 1 7 GLY N N 7.475 7.603 -5.796 1.00 . A A . 7 GLY N 1 1
6 1003 1 1 7 GLY O O 9.850 5.434 -4.292 1.00 . A A . 7 GLY O 1 1
6 1004 1 1 8 ASP C C 7.357 3.076 -6.525 1.00 . A A . 8 ASP C 1 1
6 1005 1 1 8 ASP CA C 8.071 3.589 -5.274 1.00 . A A . 8 ASP CA 1 1
6 1006 1 1 8 ASP CB C 7.420 3.015 -4.013 1.00 . A A . 8 ASP CB 1 1
6 1007 1 1 8 ASP CG C 8.289 3.335 -2.797 1.00 . A A . 8 ASP CG 1 1
6 1008 1 1 8 ASP H H 7.044 5.448 -5.565 1.00 . A A . 8 ASP H 1 1
6 1009 1 1 8 ASP HA H 9.122 3.342 -5.304 1.00 . A A . 8 ASP HA 1 1
6 1010 1 1 8 ASP HB2 H 6.440 3.451 -3.883 1.00 . A A . 8 ASP HB2 1 1
6 1011 1 1 8 ASP HB3 H 7.326 1.944 -4.114 1.00 . A A . 8 ASP HB3 1 1
6 1012 1 1 8 ASP N N 7.872 5.065 -5.206 1.00 . A A . 8 ASP N 1 1
6 1013 1 1 8 ASP O O 6.217 2.666 -6.473 1.00 . A A . 8 ASP O 1 1
6 1014 1 1 8 ASP OD1 O 9.478 3.063 -2.854 1.00 . A A . 8 ASP OD1 1 1
6 1015 1 1 8 ASP OD2 O 7.752 3.844 -1.828 1.00 . A A . 8 ASP OD2 1 1
6 1016 1 1 9 TYR C C 7.401 1.170 -9.095 1.00 . A A . 9 TYR C 1 1
6 1017 1 1 9 TYR CA C 7.341 2.690 -8.918 1.00 . A A . 9 TYR CA 1 1
6 1018 1 1 9 TYR CB C 8.132 3.374 -10.031 1.00 . A A . 9 TYR CB 1 1
6 1019 1 1 9 TYR CD1 C 8.221 5.749 -9.199 1.00 . A A . 9 TYR CD1 1 1
6 1020 1 1 9 TYR CD2 C 6.808 5.231 -11.100 1.00 . A A . 9 TYR CD2 1 1
6 1021 1 1 9 TYR CE1 C 7.825 7.092 -9.271 1.00 . A A . 9 TYR CE1 1 1
6 1022 1 1 9 TYR CE2 C 6.411 6.571 -11.170 1.00 . A A . 9 TYR CE2 1 1
6 1023 1 1 9 TYR CG C 7.713 4.821 -10.115 1.00 . A A . 9 TYR CG 1 1
6 1024 1 1 9 TYR CZ C 6.920 7.502 -10.257 1.00 . A A . 9 TYR CZ 1 1
6 1025 1 1 9 TYR H H 8.914 3.491 -7.672 1.00 . A A . 9 TYR H 1 1
6 1026 1 1 9 TYR HA H 6.314 3.035 -8.941 1.00 . A A . 9 TYR HA 1 1
6 1027 1 1 9 TYR HB2 H 9.187 3.315 -9.813 1.00 . A A . 9 TYR HB2 1 1
6 1028 1 1 9 TYR HB3 H 7.926 2.886 -10.970 1.00 . A A . 9 TYR HB3 1 1
6 1029 1 1 9 TYR HD1 H 8.918 5.431 -8.438 1.00 . A A . 9 TYR HD1 1 1
6 1030 1 1 9 TYR HD2 H 6.417 4.513 -11.805 1.00 . A A . 9 TYR HD2 1 1
6 1031 1 1 9 TYR HE1 H 8.218 7.809 -8.565 1.00 . A A . 9 TYR HE1 1 1
6 1032 1 1 9 TYR HE2 H 5.711 6.888 -11.930 1.00 . A A . 9 TYR HE2 1 1
6 1033 1 1 9 TYR HH H 6.870 9.192 -11.147 1.00 . A A . 9 TYR HH 1 1
6 1034 1 1 9 TYR N N 8.006 3.128 -7.652 1.00 . A A . 9 TYR N 1 1
6 1035 1 1 9 TYR O O 8.455 0.581 -9.233 1.00 . A A . 9 TYR O 1 1
6 1036 1 1 9 TYR OH O 6.528 8.824 -10.329 1.00 . A A . 9 TYR OH 1 1
6 1037 1 1 10 LEU C C 4.956 -1.249 -10.153 1.00 . A A . 10 LEU C 1 1
6 1038 1 1 10 LEU CA C 6.184 -0.929 -9.291 1.00 . A A . 10 LEU CA 1 1
6 1039 1 1 10 LEU CB C 6.036 -1.494 -7.873 1.00 . A A . 10 LEU CB 1 1
6 1040 1 1 10 LEU CD1 C 3.775 -1.946 -6.894 1.00 . A A . 10 LEU CD1 1 1
6 1041 1 1 10 LEU CD2 C 5.255 -0.221 -5.856 1.00 . A A . 10 LEU CD2 1 1
6 1042 1 1 10 LEU CG C 4.820 -0.866 -7.179 1.00 . A A . 10 LEU CG 1 1
6 1043 1 1 10 LEU H H 5.427 1.053 -9.005 1.00 . A A . 10 LEU H 1 1
6 1044 1 1 10 LEU HA H 7.085 -1.302 -9.754 1.00 . A A . 10 LEU HA 1 1
6 1045 1 1 10 LEU HB2 H 5.910 -2.565 -7.923 1.00 . A A . 10 LEU HB2 1 1
6 1046 1 1 10 LEU HB3 H 6.926 -1.266 -7.307 1.00 . A A . 10 LEU HB3 1 1
6 1047 1 1 10 LEU HD11 H 3.997 -2.424 -5.951 1.00 . A A . 10 LEU HD11 1 1
6 1048 1 1 10 LEU HD12 H 3.796 -2.683 -7.684 1.00 . A A . 10 LEU HD12 1 1
6 1049 1 1 10 LEU HD13 H 2.795 -1.495 -6.847 1.00 . A A . 10 LEU HD13 1 1
6 1050 1 1 10 LEU HD21 H 5.054 -0.900 -5.039 1.00 . A A . 10 LEU HD21 1 1
6 1051 1 1 10 LEU HD22 H 4.704 0.696 -5.705 1.00 . A A . 10 LEU HD22 1 1
6 1052 1 1 10 LEU HD23 H 6.311 -0.004 -5.890 1.00 . A A . 10 LEU HD23 1 1
6 1053 1 1 10 LEU HG H 4.389 -0.113 -7.821 1.00 . A A . 10 LEU HG 1 1
6 1054 1 1 10 LEU N N 6.257 0.544 -9.107 1.00 . A A . 10 LEU N 1 1
6 1055 1 1 10 LEU O O 4.183 -2.136 -9.850 1.00 . A A . 10 LEU O 1 1
6 1056 1 1 11 ASP C C 3.945 -1.560 -13.337 1.00 . A A . 11 ASP C 1 1
6 1057 1 1 11 ASP CA C 3.577 -0.730 -12.104 1.00 . A A . 11 ASP CA 1 1
6 1058 1 1 11 ASP CB C 3.129 0.671 -12.528 1.00 . A A . 11 ASP CB 1 1
6 1059 1 1 11 ASP CG C 4.270 1.387 -13.259 1.00 . A A . 11 ASP CG 1 1
6 1060 1 1 11 ASP H H 5.397 0.213 -11.427 1.00 . A A . 11 ASP H 1 1
6 1061 1 1 11 ASP HA H 2.784 -1.211 -11.555 1.00 . A A . 11 ASP HA 1 1
6 1062 1 1 11 ASP HB2 H 2.276 0.588 -13.188 1.00 . A A . 11 ASP HB2 1 1
6 1063 1 1 11 ASP HB3 H 2.852 1.237 -11.653 1.00 . A A . 11 ASP HB3 1 1
6 1064 1 1 11 ASP N N 4.766 -0.507 -11.218 1.00 . A A . 11 ASP N 1 1
6 1065 1 1 11 ASP O O 4.045 -1.049 -14.435 1.00 . A A . 11 ASP O 1 1
6 1066 1 1 11 ASP OD1 O 5.354 1.455 -12.704 1.00 . A A . 11 ASP OD1 1 1
6 1067 1 1 11 ASP OD2 O 4.040 1.853 -14.364 1.00 . A A . 11 ASP OD2 1 1
6 1068 1 1 12 CYS C C 5.628 -3.144 -15.130 1.00 . A A . 12 CYS C 1 1
6 1069 1 1 12 CYS CA C 4.449 -3.716 -14.333 1.00 . A A . 12 CYS CA 1 1
6 1070 1 1 12 CYS CB C 3.182 -3.721 -15.191 1.00 . A A . 12 CYS CB 1 1
6 1071 1 1 12 CYS H H 4.010 -3.235 -12.278 1.00 . A A . 12 CYS H 1 1
6 1072 1 1 12 CYS HA H 4.667 -4.715 -13.998 1.00 . A A . 12 CYS HA 1 1
6 1073 1 1 12 CYS HB2 H 2.801 -2.714 -15.273 1.00 . A A . 12 CYS HB2 1 1
6 1074 1 1 12 CYS HB3 H 3.417 -4.098 -16.174 1.00 . A A . 12 CYS HB3 1 1
6 1075 1 1 12 CYS N N 4.118 -2.841 -13.168 1.00 . A A . 12 CYS N 1 1
6 1076 1 1 12 CYS O O 5.626 -3.166 -16.345 1.00 . A A . 12 CYS O 1 1
6 1077 1 1 12 CYS SG S 1.924 -4.776 -14.424 1.00 . A A . 12 CYS SG 1 1
6 1078 1 1 13 NH2 HN1 H 6.649 -2.607 -13.515 1.00 . A A . 13 NH2 HN1 1 1
6 1079 1 1 13 NH2 HN2 H 7.399 -2.258 -14.997 1.00 . A A . 13 NH2 HN2 1 1
6 1080 1 1 13 NH2 N N 6.642 -2.628 -14.493 1.00 . A A . 13 NH2 N 1 1
7 1081 1 1 1 ACE C C 1.342 -4.770 -12.116 1.00 . A A . 1 ACE C 1 1
7 1082 1 1 1 ACE CH3 C 0.480 -5.910 -11.577 1.00 . A A . 1 ACE CH3 1 1
7 1083 1 1 1 ACE H1 H 1.068 -6.518 -10.904 1.00 . A A . 1 ACE H1 1 1
7 1084 1 1 1 ACE H2 H 0.132 -6.518 -12.398 1.00 . A A . 1 ACE H2 1 1
7 1085 1 1 1 ACE H3 H -0.367 -5.503 -11.045 1.00 . A A . 1 ACE H3 1 1
7 1086 1 1 1 ACE O O 2.554 -4.856 -12.144 1.00 . A A . 1 ACE O 1 1
7 1087 1 1 2 CYS C C 0.938 -1.231 -12.554 1.00 . A A . 2 CYS C 1 1
7 1088 1 1 2 CYS CA C 1.514 -2.550 -13.077 1.00 . A A . 2 CYS CA 1 1
7 1089 1 1 2 CYS CB C 1.373 -2.633 -14.598 1.00 . A A . 2 CYS CB 1 1
7 1090 1 1 2 CYS H H -0.252 -3.653 -12.510 1.00 . A A . 2 CYS H 1 1
7 1091 1 1 2 CYS HA H 2.552 -2.642 -12.798 1.00 . A A . 2 CYS HA 1 1
7 1092 1 1 2 CYS HB2 H 0.400 -3.028 -14.850 1.00 . A A . 2 CYS HB2 1 1
7 1093 1 1 2 CYS HB3 H 1.481 -1.645 -15.023 1.00 . A A . 2 CYS HB3 1 1
7 1094 1 1 2 CYS N N 0.726 -3.701 -12.543 1.00 . A A . 2 CYS N 1 1
7 1095 1 1 2 CYS O O -0.054 -0.734 -13.051 1.00 . A A . 2 CYS O 1 1
7 1096 1 1 2 CYS SG S 2.657 -3.723 -15.268 1.00 . A A . 2 CYS SG 1 1
7 1097 1 1 3 ARG C C 2.242 1.583 -10.781 1.00 . A A . 3 ARG C 1 1
7 1098 1 1 3 ARG CA C 1.066 0.639 -11.010 1.00 . A A . 3 ARG CA 1 1
7 1099 1 1 3 ARG CB C 0.400 0.278 -9.684 1.00 . A A . 3 ARG CB 1 1
7 1100 1 1 3 ARG CD C -1.722 -0.617 -8.721 1.00 . A A . 3 ARG CD 1 1
7 1101 1 1 3 ARG CG C -1.110 0.155 -9.890 1.00 . A A . 3 ARG CG 1 1
7 1102 1 1 3 ARG CZ C -3.823 -0.248 -7.580 1.00 . A A . 3 ARG CZ 1 1
7 1103 1 1 3 ARG H H 2.366 -1.071 -11.185 1.00 . A A . 3 ARG H 1 1
7 1104 1 1 3 ARG HA H 0.344 1.083 -11.678 1.00 . A A . 3 ARG HA 1 1
7 1105 1 1 3 ARG HB2 H 0.793 -0.665 -9.327 1.00 . A A . 3 ARG HB2 1 1
7 1106 1 1 3 ARG HB3 H 0.601 1.050 -8.957 1.00 . A A . 3 ARG HB3 1 1
7 1107 1 1 3 ARG HD2 H -1.635 -1.682 -8.888 1.00 . A A . 3 ARG HD2 1 1
7 1108 1 1 3 ARG HD3 H -1.245 -0.340 -7.795 1.00 . A A . 3 ARG HD3 1 1
7 1109 1 1 3 ARG HE H -3.592 0.091 -9.523 1.00 . A A . 3 ARG HE 1 1
7 1110 1 1 3 ARG HG2 H -1.548 1.141 -9.941 1.00 . A A . 3 ARG HG2 1 1
7 1111 1 1 3 ARG HG3 H -1.306 -0.374 -10.811 1.00 . A A . 3 ARG HG3 1 1
7 1112 1 1 3 ARG HH11 H -3.180 -2.077 -7.086 1.00 . A A . 3 ARG HH11 1 1
7 1113 1 1 3 ARG HH12 H -4.262 -1.333 -5.958 1.00 . A A . 3 ARG HH12 1 1
7 1114 1 1 3 ARG HH21 H -4.619 1.575 -7.815 1.00 . A A . 3 ARG HH21 1 1
7 1115 1 1 3 ARG HH22 H -5.077 0.736 -6.370 1.00 . A A . 3 ARG HH22 1 1
7 1116 1 1 3 ARG N N 1.562 -0.655 -11.562 1.00 . A A . 3 ARG N 1 1
7 1117 1 1 3 ARG NE N -3.154 -0.208 -8.700 1.00 . A A . 3 ARG NE 1 1
7 1118 1 1 3 ARG NH1 N -3.749 -1.301 -6.815 1.00 . A A . 3 ARG NH1 1 1
7 1119 1 1 3 ARG NH2 N -4.563 0.767 -7.228 1.00 . A A . 3 ARG NH2 1 1
7 1120 1 1 3 ARG O O 3.387 1.189 -10.888 1.00 . A A . 3 ARG O 1 1
7 1121 1 1 4 VAL C C 2.801 4.753 -9.120 1.00 . A A . 4 VAL C 1 1
7 1122 1 1 4 VAL CA C 3.111 3.767 -10.250 1.00 . A A . 4 VAL CA 1 1
7 1123 1 1 4 VAL CB C 3.316 4.489 -11.590 1.00 . A A . 4 VAL CB 1 1
7 1124 1 1 4 VAL CG1 C 3.754 5.940 -11.357 1.00 . A A . 4 VAL CG1 1 1
7 1125 1 1 4 VAL CG2 C 4.411 3.768 -12.381 1.00 . A A . 4 VAL CG2 1 1
7 1126 1 1 4 VAL H H 1.054 3.130 -10.392 1.00 . A A . 4 VAL H 1 1
7 1127 1 1 4 VAL HA H 4.005 3.211 -10.009 1.00 . A A . 4 VAL HA 1 1
7 1128 1 1 4 VAL HB H 2.394 4.475 -12.154 1.00 . A A . 4 VAL HB 1 1
7 1129 1 1 4 VAL HG11 H 2.881 6.566 -11.249 1.00 . A A . 4 VAL HG11 1 1
7 1130 1 1 4 VAL HG12 H 4.341 6.278 -12.197 1.00 . A A . 4 VAL HG12 1 1
7 1131 1 1 4 VAL HG13 H 4.351 5.994 -10.461 1.00 . A A . 4 VAL HG13 1 1
7 1132 1 1 4 VAL HG21 H 4.747 2.905 -11.828 1.00 . A A . 4 VAL HG21 1 1
7 1133 1 1 4 VAL HG22 H 5.243 4.439 -12.539 1.00 . A A . 4 VAL HG22 1 1
7 1134 1 1 4 VAL HG23 H 4.019 3.451 -13.338 1.00 . A A . 4 VAL HG23 1 1
7 1135 1 1 4 VAL N N 1.981 2.824 -10.472 1.00 . A A . 4 VAL N 1 1
7 1136 1 1 4 VAL O O 2.126 5.748 -9.294 1.00 . A A . 4 VAL O 1 1
7 1137 1 1 5 VAL C C 4.399 6.343 -6.816 1.00 . A A . 5 VAL C 1 1
7 1138 1 1 5 VAL CA C 3.180 5.399 -6.823 1.00 . A A . 5 VAL CA 1 1
7 1139 1 1 5 VAL CB C 3.107 4.474 -5.588 1.00 . A A . 5 VAL CB 1 1
7 1140 1 1 5 VAL CG1 C 1.704 3.866 -5.492 1.00 . A A . 5 VAL CG1 1 1
7 1141 1 1 5 VAL CG2 C 4.116 3.318 -5.687 1.00 . A A . 5 VAL CG2 1 1
7 1142 1 1 5 VAL H H 3.919 3.706 -7.898 1.00 . A A . 5 VAL H 1 1
7 1143 1 1 5 VAL HA H 2.268 5.966 -6.930 1.00 . A A . 5 VAL HA 1 1
7 1144 1 1 5 VAL HB H 3.307 5.050 -4.705 1.00 . A A . 5 VAL HB 1 1
7 1145 1 1 5 VAL HG11 H 1.491 3.319 -6.399 1.00 . A A . 5 VAL HG11 1 1
7 1146 1 1 5 VAL HG12 H 0.973 4.649 -5.360 1.00 . A A . 5 VAL HG12 1 1
7 1147 1 1 5 VAL HG13 H 1.666 3.190 -4.651 1.00 . A A . 5 VAL HG13 1 1
7 1148 1 1 5 VAL HG21 H 3.583 2.390 -5.835 1.00 . A A . 5 VAL HG21 1 1
7 1149 1 1 5 VAL HG22 H 4.686 3.256 -4.775 1.00 . A A . 5 VAL HG22 1 1
7 1150 1 1 5 VAL HG23 H 4.782 3.481 -6.514 1.00 . A A . 5 VAL HG23 1 1
7 1151 1 1 5 VAL N N 3.354 4.490 -7.980 1.00 . A A . 5 VAL N 1 1
7 1152 1 1 5 VAL O O 5.502 5.934 -7.144 1.00 . A A . 5 VAL O 1 1
7 1153 1 1 6 ARG C C 6.390 8.358 -5.487 1.00 . A A . 6 ARG C 1 1
7 1154 1 1 6 ARG CA C 5.384 8.551 -6.620 1.00 . A A . 6 ARG CA 1 1
7 1155 1 1 6 ARG CB C 4.776 9.959 -6.573 1.00 . A A . 6 ARG CB 1 1
7 1156 1 1 6 ARG CD C 3.283 11.583 -7.780 1.00 . A A . 6 ARG CD 1 1
7 1157 1 1 6 ARG CG C 3.767 10.127 -7.716 1.00 . A A . 6 ARG CG 1 1
7 1158 1 1 6 ARG CZ C 4.606 12.834 -9.387 1.00 . A A . 6 ARG CZ 1 1
7 1159 1 1 6 ARG H H 3.325 7.946 -6.303 1.00 . A A . 6 ARG H 1 1
7 1160 1 1 6 ARG HA H 5.876 8.413 -7.572 1.00 . A A . 6 ARG HA 1 1
7 1161 1 1 6 ARG HB2 H 4.278 10.110 -5.624 1.00 . A A . 6 ARG HB2 1 1
7 1162 1 1 6 ARG HB3 H 5.562 10.692 -6.684 1.00 . A A . 6 ARG HB3 1 1
7 1163 1 1 6 ARG HD2 H 2.507 11.684 -8.528 1.00 . A A . 6 ARG HD2 1 1
7 1164 1 1 6 ARG HD3 H 2.919 11.902 -6.816 1.00 . A A . 6 ARG HD3 1 1
7 1165 1 1 6 ARG HE H 5.171 12.584 -7.499 1.00 . A A . 6 ARG HE 1 1
7 1166 1 1 6 ARG HG2 H 4.235 9.862 -8.652 1.00 . A A . 6 ARG HG2 1 1
7 1167 1 1 6 ARG HG3 H 2.919 9.478 -7.542 1.00 . A A . 6 ARG HG3 1 1
7 1168 1 1 6 ARG HH11 H 3.064 14.107 -9.252 1.00 . A A . 6 ARG HH11 1 1
7 1169 1 1 6 ARG HH12 H 3.887 14.087 -10.775 1.00 . A A . 6 ARG HH12 1 1
7 1170 1 1 6 ARG HH21 H 6.182 11.675 -9.811 1.00 . A A . 6 ARG HH21 1 1
7 1171 1 1 6 ARG HH22 H 5.649 12.715 -11.090 1.00 . A A . 6 ARG HH22 1 1
7 1172 1 1 6 ARG N N 4.221 7.608 -6.516 1.00 . A A . 6 ARG N 1 1
7 1173 1 1 6 ARG NE N 4.480 12.385 -8.164 1.00 . A A . 6 ARG NE 1 1
7 1174 1 1 6 ARG NH1 N 3.788 13.747 -9.839 1.00 . A A . 6 ARG NH1 1 1
7 1175 1 1 6 ARG NH2 N 5.552 12.372 -10.157 1.00 . A A . 6 ARG NH2 1 1
7 1176 1 1 6 ARG O O 6.222 8.818 -4.375 1.00 . A A . 6 ARG O 1 1
7 1177 1 1 7 GLY C C 8.825 5.884 -4.868 1.00 . A A . 7 GLY C 1 1
7 1178 1 1 7 GLY CA C 8.527 7.382 -4.814 1.00 . A A . 7 GLY CA 1 1
7 1179 1 1 7 GLY H H 7.542 7.307 -6.715 1.00 . A A . 7 GLY H 1 1
7 1180 1 1 7 GLY HA2 H 9.415 7.947 -5.072 1.00 . A A . 7 GLY HA2 1 1
7 1181 1 1 7 GLY HA3 H 8.197 7.648 -3.822 1.00 . A A . 7 GLY HA3 1 1
7 1182 1 1 7 GLY N N 7.451 7.660 -5.804 1.00 . A A . 7 GLY N 1 1
7 1183 1 1 7 GLY O O 9.955 5.448 -4.779 1.00 . A A . 7 GLY O 1 1
7 1184 1 1 8 ASP C C 7.161 3.076 -6.326 1.00 . A A . 8 ASP C 1 1
7 1185 1 1 8 ASP CA C 7.963 3.613 -5.139 1.00 . A A . 8 ASP CA 1 1
7 1186 1 1 8 ASP CB C 7.378 3.052 -3.836 1.00 . A A . 8 ASP CB 1 1
7 1187 1 1 8 ASP CG C 8.448 3.004 -2.747 1.00 . A A . 8 ASP CG 1 1
7 1188 1 1 8 ASP H H 6.909 5.503 -5.140 1.00 . A A . 8 ASP H 1 1
7 1189 1 1 8 ASP HA H 9.002 3.347 -5.227 1.00 . A A . 8 ASP HA 1 1
7 1190 1 1 8 ASP HB2 H 6.562 3.681 -3.512 1.00 . A A . 8 ASP HB2 1 1
7 1191 1 1 8 ASP HB3 H 7.006 2.051 -4.014 1.00 . A A . 8 ASP HB3 1 1
7 1192 1 1 8 ASP N N 7.796 5.103 -5.047 1.00 . A A . 8 ASP N 1 1
7 1193 1 1 8 ASP O O 6.402 2.139 -6.190 1.00 . A A . 8 ASP O 1 1
7 1194 1 1 8 ASP OD1 O 9.068 4.027 -2.503 1.00 . A A . 8 ASP OD1 1 1
7 1195 1 1 8 ASP OD2 O 8.626 1.946 -2.166 1.00 . A A . 8 ASP OD2 1 1
7 1196 1 1 9 TYR C C 7.217 2.076 -9.442 1.00 . A A . 9 TYR C 1 1
7 1197 1 1 9 TYR CA C 6.502 3.172 -8.654 1.00 . A A . 9 TYR CA 1 1
7 1198 1 1 9 TYR CB C 6.230 4.374 -9.584 1.00 . A A . 9 TYR CB 1 1
7 1199 1 1 9 TYR CD1 C 8.636 5.159 -9.384 1.00 . A A . 9 TYR CD1 1 1
7 1200 1 1 9 TYR CD2 C 6.852 6.800 -9.344 1.00 . A A . 9 TYR CD2 1 1
7 1201 1 1 9 TYR CE1 C 9.579 6.181 -9.232 1.00 . A A . 9 TYR CE1 1 1
7 1202 1 1 9 TYR CE2 C 7.795 7.824 -9.194 1.00 . A A . 9 TYR CE2 1 1
7 1203 1 1 9 TYR CG C 7.270 5.470 -9.439 1.00 . A A . 9 TYR CG 1 1
7 1204 1 1 9 TYR CZ C 9.159 7.514 -9.137 1.00 . A A . 9 TYR CZ 1 1
7 1205 1 1 9 TYR H H 7.922 4.415 -7.573 1.00 . A A . 9 TYR H 1 1
7 1206 1 1 9 TYR HA H 5.550 2.793 -8.290 1.00 . A A . 9 TYR HA 1 1
7 1207 1 1 9 TYR HB2 H 6.225 4.033 -10.605 1.00 . A A . 9 TYR HB2 1 1
7 1208 1 1 9 TYR HB3 H 5.259 4.778 -9.346 1.00 . A A . 9 TYR HB3 1 1
7 1209 1 1 9 TYR HD1 H 8.959 4.131 -9.455 1.00 . A A . 9 TYR HD1 1 1
7 1210 1 1 9 TYR HD2 H 5.797 7.040 -9.387 1.00 . A A . 9 TYR HD2 1 1
7 1211 1 1 9 TYR HE1 H 10.630 5.944 -9.188 1.00 . A A . 9 TYR HE1 1 1
7 1212 1 1 9 TYR HE2 H 7.468 8.851 -9.122 1.00 . A A . 9 TYR HE2 1 1
7 1213 1 1 9 TYR HH H 10.438 8.733 -9.859 1.00 . A A . 9 TYR HH 1 1
7 1214 1 1 9 TYR N N 7.307 3.661 -7.483 1.00 . A A . 9 TYR N 1 1
7 1215 1 1 9 TYR O O 8.029 2.337 -10.304 1.00 . A A . 9 TYR O 1 1
7 1216 1 1 9 TYR OH O 10.091 8.524 -8.988 1.00 . A A . 9 TYR OH 1 1
7 1217 1 1 10 LEU C C 6.371 -0.811 -10.905 1.00 . A A . 10 LEU C 1 1
7 1218 1 1 10 LEU CA C 7.442 -0.287 -9.949 1.00 . A A . 10 LEU CA 1 1
7 1219 1 1 10 LEU CB C 7.794 -1.337 -8.893 1.00 . A A . 10 LEU CB 1 1
7 1220 1 1 10 LEU CD1 C 8.777 0.134 -7.123 1.00 . A A . 10 LEU CD1 1 1
7 1221 1 1 10 LEU CD2 C 9.688 -2.164 -7.491 1.00 . A A . 10 LEU CD2 1 1
7 1222 1 1 10 LEU CG C 9.085 -0.934 -8.175 1.00 . A A . 10 LEU CG 1 1
7 1223 1 1 10 LEU H H 6.160 0.674 -8.520 1.00 . A A . 10 LEU H 1 1
7 1224 1 1 10 LEU HA H 8.325 0.022 -10.488 1.00 . A A . 10 LEU HA 1 1
7 1225 1 1 10 LEU HB2 H 6.989 -1.408 -8.177 1.00 . A A . 10 LEU HB2 1 1
7 1226 1 1 10 LEU HB3 H 7.935 -2.295 -9.372 1.00 . A A . 10 LEU HB3 1 1
7 1227 1 1 10 LEU HD11 H 7.900 -0.153 -6.563 1.00 . A A . 10 LEU HD11 1 1
7 1228 1 1 10 LEU HD12 H 8.599 1.080 -7.611 1.00 . A A . 10 LEU HD12 1 1
7 1229 1 1 10 LEU HD13 H 9.617 0.230 -6.449 1.00 . A A . 10 LEU HD13 1 1
7 1230 1 1 10 LEU HD21 H 10.640 -1.901 -7.047 1.00 . A A . 10 LEU HD21 1 1
7 1231 1 1 10 LEU HD22 H 9.837 -2.945 -8.221 1.00 . A A . 10 LEU HD22 1 1
7 1232 1 1 10 LEU HD23 H 9.018 -2.514 -6.720 1.00 . A A . 10 LEU HD23 1 1
7 1233 1 1 10 LEU HG H 9.788 -0.538 -8.893 1.00 . A A . 10 LEU HG 1 1
7 1234 1 1 10 LEU N N 6.856 0.848 -9.189 1.00 . A A . 10 LEU N 1 1
7 1235 1 1 10 LEU O O 5.736 -1.817 -10.650 1.00 . A A . 10 LEU O 1 1
7 1236 1 1 11 ASP C C 5.674 -1.497 -13.987 1.00 . A A . 11 ASP C 1 1
7 1237 1 1 11 ASP CA C 5.082 -0.555 -12.944 1.00 . A A . 11 ASP CA 1 1
7 1238 1 1 11 ASP CB C 4.587 0.736 -13.603 1.00 . A A . 11 ASP CB 1 1
7 1239 1 1 11 ASP CG C 3.506 0.411 -14.636 1.00 . A A . 11 ASP CG 1 1
7 1240 1 1 11 ASP H H 6.650 0.700 -12.163 1.00 . A A . 11 ASP H 1 1
7 1241 1 1 11 ASP HA H 4.269 -1.032 -12.418 1.00 . A A . 11 ASP HA 1 1
7 1242 1 1 11 ASP HB2 H 4.176 1.385 -12.850 1.00 . A A . 11 ASP HB2 1 1
7 1243 1 1 11 ASP HB3 H 5.412 1.232 -14.093 1.00 . A A . 11 ASP HB3 1 1
7 1244 1 1 11 ASP N N 6.142 -0.117 -11.990 1.00 . A A . 11 ASP N 1 1
7 1245 1 1 11 ASP O O 6.564 -1.139 -14.735 1.00 . A A . 11 ASP O 1 1
7 1246 1 1 11 ASP OD1 O 2.350 0.344 -14.252 1.00 . A A . 11 ASP OD1 1 1
7 1247 1 1 11 ASP OD2 O 3.851 0.243 -15.794 1.00 . A A . 11 ASP OD2 1 1
7 1248 1 1 12 CYS C C 7.218 -3.871 -14.804 1.00 . A A . 12 CYS C 1 1
7 1249 1 1 12 CYS CA C 5.712 -3.691 -15.020 1.00 . A A . 12 CYS CA 1 1
7 1250 1 1 12 CYS CB C 5.428 -3.103 -16.409 1.00 . A A . 12 CYS CB 1 1
7 1251 1 1 12 CYS H H 4.472 -2.968 -13.418 1.00 . A A . 12 CYS H 1 1
7 1252 1 1 12 CYS HA H 5.204 -4.636 -14.906 1.00 . A A . 12 CYS HA 1 1
7 1253 1 1 12 CYS HB2 H 6.086 -2.265 -16.584 1.00 . A A . 12 CYS HB2 1 1
7 1254 1 1 12 CYS HB3 H 5.611 -3.859 -17.160 1.00 . A A . 12 CYS HB3 1 1
7 1255 1 1 12 CYS N N 5.185 -2.706 -14.036 1.00 . A A . 12 CYS N 1 1
7 1256 1 1 12 CYS O O 7.955 -4.134 -15.733 1.00 . A A . 12 CYS O 1 1
7 1257 1 1 12 CYS SG S 3.704 -2.540 -16.533 1.00 . A A . 12 CYS SG 1 1
7 1258 1 1 13 NH2 HN1 H 7.109 -3.525 -12.852 1.00 . A A . 13 NH2 HN1 1 1
7 1259 1 1 13 NH2 HN2 H 8.667 -3.846 -13.445 1.00 . A A . 13 NH2 HN2 1 1
7 1260 1 1 13 NH2 N N 7.705 -3.736 -13.601 1.00 . A A . 13 NH2 N 1 1
8 1261 1 1 1 ACE C C 2.238 -4.573 -7.101 1.00 . A A . 1 ACE C 1 1
8 1262 1 1 1 ACE CH3 C 3.261 -5.354 -6.275 1.00 . A A . 1 ACE CH3 1 1
8 1263 1 1 1 ACE H1 H 3.679 -4.710 -5.516 1.00 . A A . 1 ACE H1 1 1
8 1264 1 1 1 ACE H2 H 4.052 -5.708 -6.921 1.00 . A A . 1 ACE H2 1 1
8 1265 1 1 1 ACE H3 H 2.777 -6.197 -5.804 1.00 . A A . 1 ACE H3 1 1
8 1266 1 1 1 ACE O O 1.046 -4.678 -6.894 1.00 . A A . 1 ACE O 1 1
8 1267 1 1 2 CYS C C 0.759 -2.223 -8.034 1.00 . A A . 2 CYS C 1 1
8 1268 1 1 2 CYS CA C 1.771 -2.990 -8.897 1.00 . A A . 2 CYS CA 1 1
8 1269 1 1 2 CYS CB C 1.055 -4.021 -9.779 1.00 . A A . 2 CYS CB 1 1
8 1270 1 1 2 CYS H H 3.668 -3.727 -8.188 1.00 . A A . 2 CYS H 1 1
8 1271 1 1 2 CYS HA H 2.328 -2.307 -9.516 1.00 . A A . 2 CYS HA 1 1
8 1272 1 1 2 CYS HB2 H 0.531 -4.727 -9.152 1.00 . A A . 2 CYS HB2 1 1
8 1273 1 1 2 CYS HB3 H 0.347 -3.516 -10.420 1.00 . A A . 2 CYS HB3 1 1
8 1274 1 1 2 CYS N N 2.702 -3.790 -8.042 1.00 . A A . 2 CYS N 1 1
8 1275 1 1 2 CYS O O -0.412 -2.156 -8.353 1.00 . A A . 2 CYS O 1 1
8 1276 1 1 2 CYS SG S 2.268 -4.904 -10.798 1.00 . A A . 2 CYS SG 1 1
8 1277 1 1 3 ARG C C 0.953 0.316 -5.430 1.00 . A A . 3 ARG C 1 1
8 1278 1 1 3 ARG CA C 0.256 -0.894 -6.066 1.00 . A A . 3 ARG CA 1 1
8 1279 1 1 3 ARG CB C -0.161 -1.900 -4.991 1.00 . A A . 3 ARG CB 1 1
8 1280 1 1 3 ARG CD C -2.575 -1.742 -4.361 1.00 . A A . 3 ARG CD 1 1
8 1281 1 1 3 ARG CG C -1.568 -2.419 -5.294 1.00 . A A . 3 ARG CG 1 1
8 1282 1 1 3 ARG CZ C -4.401 -0.306 -5.047 1.00 . A A . 3 ARG CZ 1 1
8 1283 1 1 3 ARG H H 2.145 -1.714 -6.702 1.00 . A A . 3 ARG H 1 1
8 1284 1 1 3 ARG HA H -0.609 -0.578 -6.627 1.00 . A A . 3 ARG HA 1 1
8 1285 1 1 3 ARG HB2 H 0.536 -2.726 -4.985 1.00 . A A . 3 ARG HB2 1 1
8 1286 1 1 3 ARG HB3 H -0.156 -1.418 -4.024 1.00 . A A . 3 ARG HB3 1 1
8 1287 1 1 3 ARG HD2 H -2.864 -2.418 -3.568 1.00 . A A . 3 ARG HD2 1 1
8 1288 1 1 3 ARG HD3 H -2.158 -0.835 -3.952 1.00 . A A . 3 ARG HD3 1 1
8 1289 1 1 3 ARG HE H -4.021 -2.045 -5.928 1.00 . A A . 3 ARG HE 1 1
8 1290 1 1 3 ARG HG2 H -1.821 -2.197 -6.321 1.00 . A A . 3 ARG HG2 1 1
8 1291 1 1 3 ARG HG3 H -1.599 -3.487 -5.138 1.00 . A A . 3 ARG HG3 1 1
8 1292 1 1 3 ARG HH11 H -4.426 -0.454 -3.051 1.00 . A A . 3 ARG HH11 1 1
8 1293 1 1 3 ARG HH12 H -5.202 0.948 -3.708 1.00 . A A . 3 ARG HH12 1 1
8 1294 1 1 3 ARG HH21 H -4.529 0.105 -7.002 1.00 . A A . 3 ARG HH21 1 1
8 1295 1 1 3 ARG HH22 H -5.260 1.264 -5.943 1.00 . A A . 3 ARG HH22 1 1
8 1296 1 1 3 ARG N N 1.199 -1.647 -6.944 1.00 . A A . 3 ARG N 1 1
8 1297 1 1 3 ARG NE N -3.745 -1.420 -5.225 1.00 . A A . 3 ARG NE 1 1
8 1298 1 1 3 ARG NH1 N -4.700 0.093 -3.841 1.00 . A A . 3 ARG NH1 1 1
8 1299 1 1 3 ARG NH2 N -4.758 0.410 -6.077 1.00 . A A . 3 ARG NH2 1 1
8 1300 1 1 3 ARG O O 0.774 0.601 -4.262 1.00 . A A . 3 ARG O 1 1
8 1301 1 1 4 VAL C C 2.533 3.333 -6.664 1.00 . A A . 4 VAL C 1 1
8 1302 1 1 4 VAL CA C 2.447 2.221 -5.617 1.00 . A A . 4 VAL CA 1 1
8 1303 1 1 4 VAL CB C 3.846 1.733 -5.235 1.00 . A A . 4 VAL CB 1 1
8 1304 1 1 4 VAL CG1 C 4.540 2.803 -4.392 1.00 . A A . 4 VAL CG1 1 1
8 1305 1 1 4 VAL CG2 C 3.740 0.442 -4.419 1.00 . A A . 4 VAL CG2 1 1
8 1306 1 1 4 VAL H H 1.874 0.787 -7.127 1.00 . A A . 4 VAL H 1 1
8 1307 1 1 4 VAL HA H 1.930 2.574 -4.739 1.00 . A A . 4 VAL HA 1 1
8 1308 1 1 4 VAL HB H 4.420 1.549 -6.132 1.00 . A A . 4 VAL HB 1 1
8 1309 1 1 4 VAL HG11 H 5.313 2.343 -3.795 1.00 . A A . 4 VAL HG11 1 1
8 1310 1 1 4 VAL HG12 H 3.818 3.274 -3.742 1.00 . A A . 4 VAL HG12 1 1
8 1311 1 1 4 VAL HG13 H 4.979 3.546 -5.039 1.00 . A A . 4 VAL HG13 1 1
8 1312 1 1 4 VAL HG21 H 3.463 -0.373 -5.071 1.00 . A A . 4 VAL HG21 1 1
8 1313 1 1 4 VAL HG22 H 2.989 0.562 -3.653 1.00 . A A . 4 VAL HG22 1 1
8 1314 1 1 4 VAL HG23 H 4.693 0.228 -3.959 1.00 . A A . 4 VAL HG23 1 1
8 1315 1 1 4 VAL N N 1.744 1.031 -6.187 1.00 . A A . 4 VAL N 1 1
8 1316 1 1 4 VAL O O 2.214 3.132 -7.821 1.00 . A A . 4 VAL O 1 1
8 1317 1 1 5 VAL C C 4.391 6.349 -7.181 1.00 . A A . 5 VAL C 1 1
8 1318 1 1 5 VAL CA C 3.034 5.616 -7.267 1.00 . A A . 5 VAL CA 1 1
8 1319 1 1 5 VAL CB C 1.862 6.545 -6.926 1.00 . A A . 5 VAL CB 1 1
8 1320 1 1 5 VAL CG1 C 1.629 7.509 -8.092 1.00 . A A . 5 VAL CG1 1 1
8 1321 1 1 5 VAL CG2 C 0.590 5.718 -6.697 1.00 . A A . 5 VAL CG2 1 1
8 1322 1 1 5 VAL H H 3.205 4.663 -5.340 1.00 . A A . 5 VAL H 1 1
8 1323 1 1 5 VAL HA H 2.897 5.215 -8.252 1.00 . A A . 5 VAL HA 1 1
8 1324 1 1 5 VAL HB H 2.095 7.107 -6.034 1.00 . A A . 5 VAL HB 1 1
8 1325 1 1 5 VAL HG11 H 2.577 7.774 -8.535 1.00 . A A . 5 VAL HG11 1 1
8 1326 1 1 5 VAL HG12 H 1.138 8.399 -7.730 1.00 . A A . 5 VAL HG12 1 1
8 1327 1 1 5 VAL HG13 H 1.006 7.031 -8.836 1.00 . A A . 5 VAL HG13 1 1
8 1328 1 1 5 VAL HG21 H -0.261 6.379 -6.626 1.00 . A A . 5 VAL HG21 1 1
8 1329 1 1 5 VAL HG22 H 0.687 5.156 -5.779 1.00 . A A . 5 VAL HG22 1 1
8 1330 1 1 5 VAL HG23 H 0.449 5.035 -7.522 1.00 . A A . 5 VAL HG23 1 1
8 1331 1 1 5 VAL N N 2.953 4.509 -6.276 1.00 . A A . 5 VAL N 1 1
8 1332 1 1 5 VAL O O 5.442 5.750 -7.350 1.00 . A A . 5 VAL O 1 1
8 1333 1 1 6 ARG C C 6.412 8.064 -5.564 1.00 . A A . 6 ARG C 1 1
8 1334 1 1 6 ARG CA C 5.686 8.372 -6.865 1.00 . A A . 6 ARG CA 1 1
8 1335 1 1 6 ARG CB C 5.320 9.856 -6.943 1.00 . A A . 6 ARG CB 1 1
8 1336 1 1 6 ARG CD C 7.688 10.677 -7.100 1.00 . A A . 6 ARG CD 1 1
8 1337 1 1 6 ARG CG C 6.340 10.584 -7.826 1.00 . A A . 6 ARG CG 1 1
8 1338 1 1 6 ARG CZ C 8.596 12.462 -5.735 1.00 . A A . 6 ARG CZ 1 1
8 1339 1 1 6 ARG H H 3.550 8.114 -6.787 1.00 . A A . 6 ARG H 1 1
8 1340 1 1 6 ARG HA H 6.303 8.104 -7.710 1.00 . A A . 6 ARG HA 1 1
8 1341 1 1 6 ARG HB2 H 4.333 9.960 -7.369 1.00 . A A . 6 ARG HB2 1 1
8 1342 1 1 6 ARG HB3 H 5.333 10.284 -5.952 1.00 . A A . 6 ARG HB3 1 1
8 1343 1 1 6 ARG HD2 H 7.681 10.061 -6.211 1.00 . A A . 6 ARG HD2 1 1
8 1344 1 1 6 ARG HD3 H 8.491 10.381 -7.758 1.00 . A A . 6 ARG HD3 1 1
8 1345 1 1 6 ARG HE H 7.354 12.799 -7.248 1.00 . A A . 6 ARG HE 1 1
8 1346 1 1 6 ARG HG2 H 6.468 10.038 -8.750 1.00 . A A . 6 ARG HG2 1 1
8 1347 1 1 6 ARG HG3 H 5.982 11.578 -8.043 1.00 . A A . 6 ARG HG3 1 1
8 1348 1 1 6 ARG HH11 H 10.260 12.573 -6.844 1.00 . A A . 6 ARG HH11 1 1
8 1349 1 1 6 ARG HH12 H 10.455 12.946 -5.164 1.00 . A A . 6 ARG HH12 1 1
8 1350 1 1 6 ARG HH21 H 7.109 12.435 -4.395 1.00 . A A . 6 ARG HH21 1 1
8 1351 1 1 6 ARG HH22 H 8.668 12.867 -3.775 1.00 . A A . 6 ARG HH22 1 1
8 1352 1 1 6 ARG N N 4.392 7.636 -6.921 1.00 . A A . 6 ARG N 1 1
8 1353 1 1 6 ARG NE N 7.833 12.114 -6.735 1.00 . A A . 6 ARG NE 1 1
8 1354 1 1 6 ARG NH1 N 9.870 12.677 -5.929 1.00 . A A . 6 ARG NH1 1 1
8 1355 1 1 6 ARG NH2 N 8.085 12.598 -4.542 1.00 . A A . 6 ARG NH2 1 1
8 1356 1 1 6 ARG O O 5.835 8.031 -4.495 1.00 . A A . 6 ARG O 1 1
8 1357 1 1 7 GLY C C 8.829 5.939 -4.645 1.00 . A A . 7 GLY C 1 1
8 1358 1 1 7 GLY CA C 8.486 7.417 -4.491 1.00 . A A . 7 GLY CA 1 1
8 1359 1 1 7 GLY H H 8.093 7.789 -6.564 1.00 . A A . 7 GLY H 1 1
8 1360 1 1 7 GLY HA2 H 9.391 8.011 -4.461 1.00 . A A . 7 GLY HA2 1 1
8 1361 1 1 7 GLY HA3 H 7.915 7.566 -3.589 1.00 . A A . 7 GLY HA3 1 1
8 1362 1 1 7 GLY N N 7.677 7.787 -5.677 1.00 . A A . 7 GLY N 1 1
8 1363 1 1 7 GLY O O 9.912 5.496 -4.316 1.00 . A A . 7 GLY O 1 1
8 1364 1 1 8 ASP C C 7.339 3.267 -6.618 1.00 . A A . 8 ASP C 1 1
8 1365 1 1 8 ASP CA C 8.149 3.727 -5.403 1.00 . A A . 8 ASP CA 1 1
8 1366 1 1 8 ASP CB C 7.666 3.034 -4.127 1.00 . A A . 8 ASP CB 1 1
8 1367 1 1 8 ASP CG C 8.802 2.996 -3.101 1.00 . A A . 8 ASP CG 1 1
8 1368 1 1 8 ASP H H 7.044 5.573 -5.460 1.00 . A A . 8 ASP H 1 1
8 1369 1 1 8 ASP HA H 9.200 3.539 -5.554 1.00 . A A . 8 ASP HA 1 1
8 1370 1 1 8 ASP HB2 H 6.828 3.581 -3.718 1.00 . A A . 8 ASP HB2 1 1
8 1371 1 1 8 ASP HB3 H 7.359 2.026 -4.360 1.00 . A A . 8 ASP HB3 1 1
8 1372 1 1 8 ASP N N 7.903 5.178 -5.179 1.00 . A A . 8 ASP N 1 1
8 1373 1 1 8 ASP O O 6.292 2.668 -6.481 1.00 . A A . 8 ASP O 1 1
8 1374 1 1 8 ASP OD1 O 9.776 2.305 -3.349 1.00 . A A . 8 ASP OD1 1 1
8 1375 1 1 8 ASP OD2 O 8.676 3.656 -2.082 1.00 . A A . 8 ASP OD2 1 1
8 1376 1 1 9 TYR C C 7.303 1.726 -9.421 1.00 . A A . 9 TYR C 1 1
8 1377 1 1 9 TYR CA C 7.010 3.173 -9.014 1.00 . A A . 9 TYR CA 1 1
8 1378 1 1 9 TYR CB C 7.475 4.131 -10.111 1.00 . A A . 9 TYR CB 1 1
8 1379 1 1 9 TYR CD1 C 5.139 4.800 -10.773 1.00 . A A . 9 TYR CD1 1 1
8 1380 1 1 9 TYR CD2 C 6.713 6.527 -10.128 1.00 . A A . 9 TYR CD2 1 1
8 1381 1 1 9 TYR CE1 C 4.156 5.773 -10.984 1.00 . A A . 9 TYR CE1 1 1
8 1382 1 1 9 TYR CE2 C 5.730 7.502 -10.340 1.00 . A A . 9 TYR CE2 1 1
8 1383 1 1 9 TYR CG C 6.417 5.179 -10.345 1.00 . A A . 9 TYR CG 1 1
8 1384 1 1 9 TYR CZ C 4.451 7.126 -10.768 1.00 . A A . 9 TYR CZ 1 1
8 1385 1 1 9 TYR H H 8.623 4.077 -7.902 1.00 . A A . 9 TYR H 1 1
8 1386 1 1 9 TYR HA H 5.951 3.310 -8.837 1.00 . A A . 9 TYR HA 1 1
8 1387 1 1 9 TYR HB2 H 8.394 4.610 -9.806 1.00 . A A . 9 TYR HB2 1 1
8 1388 1 1 9 TYR HB3 H 7.642 3.580 -11.024 1.00 . A A . 9 TYR HB3 1 1
8 1389 1 1 9 TYR HD1 H 4.913 3.757 -10.940 1.00 . A A . 9 TYR HD1 1 1
8 1390 1 1 9 TYR HD2 H 7.699 6.814 -9.792 1.00 . A A . 9 TYR HD2 1 1
8 1391 1 1 9 TYR HE1 H 3.170 5.480 -11.314 1.00 . A A . 9 TYR HE1 1 1
8 1392 1 1 9 TYR HE2 H 5.958 8.545 -10.173 1.00 . A A . 9 TYR HE2 1 1
8 1393 1 1 9 TYR HH H 2.752 7.682 -11.448 1.00 . A A . 9 TYR HH 1 1
8 1394 1 1 9 TYR N N 7.793 3.566 -7.805 1.00 . A A . 9 TYR N 1 1
8 1395 1 1 9 TYR O O 8.371 1.398 -9.896 1.00 . A A . 9 TYR O 1 1
8 1396 1 1 9 TYR OH O 3.482 8.088 -10.975 1.00 . A A . 9 TYR OH 1 1
8 1397 1 1 10 LEU C C 5.156 -1.049 -10.203 1.00 . A A . 10 LEU C 1 1
8 1398 1 1 10 LEU CA C 6.488 -0.562 -9.634 1.00 . A A . 10 LEU CA 1 1
8 1399 1 1 10 LEU CB C 6.839 -1.311 -8.342 1.00 . A A . 10 LEU CB 1 1
8 1400 1 1 10 LEU CD1 C 5.032 -2.178 -6.831 1.00 . A A . 10 LEU CD1 1 1
8 1401 1 1 10 LEU CD2 C 6.623 -0.437 -6.007 1.00 . A A . 10 LEU CD2 1 1
8 1402 1 1 10 LEU CG C 5.849 -0.945 -7.228 1.00 . A A . 10 LEU CG 1 1
8 1403 1 1 10 LEU H H 5.480 1.180 -8.883 1.00 . A A . 10 LEU H 1 1
8 1404 1 1 10 LEU HA H 7.277 -0.678 -10.361 1.00 . A A . 10 LEU HA 1 1
8 1405 1 1 10 LEU HB2 H 6.797 -2.375 -8.526 1.00 . A A . 10 LEU HB2 1 1
8 1406 1 1 10 LEU HB3 H 7.839 -1.042 -8.036 1.00 . A A . 10 LEU HB3 1 1
8 1407 1 1 10 LEU HD11 H 5.029 -2.279 -5.756 1.00 . A A . 10 LEU HD11 1 1
8 1408 1 1 10 LEU HD12 H 5.470 -3.061 -7.274 1.00 . A A . 10 LEU HD12 1 1
8 1409 1 1 10 LEU HD13 H 4.019 -2.066 -7.184 1.00 . A A . 10 LEU HD13 1 1
8 1410 1 1 10 LEU HD21 H 6.854 -1.268 -5.358 1.00 . A A . 10 LEU HD21 1 1
8 1411 1 1 10 LEU HD22 H 6.022 0.281 -5.472 1.00 . A A . 10 LEU HD22 1 1
8 1412 1 1 10 LEU HD23 H 7.540 0.031 -6.333 1.00 . A A . 10 LEU HD23 1 1
8 1413 1 1 10 LEU HG H 5.179 -0.173 -7.576 1.00 . A A . 10 LEU HG 1 1
8 1414 1 1 10 LEU N N 6.333 0.871 -9.251 1.00 . A A . 10 LEU N 1 1
8 1415 1 1 10 LEU O O 4.624 -2.063 -9.798 1.00 . A A . 10 LEU O 1 1
8 1416 1 1 11 ASP C C 3.499 -1.609 -12.929 1.00 . A A . 11 ASP C 1 1
8 1417 1 1 11 ASP CA C 3.296 -0.690 -11.725 1.00 . A A . 11 ASP CA 1 1
8 1418 1 1 11 ASP CB C 2.669 0.637 -12.156 1.00 . A A . 11 ASP CB 1 1
8 1419 1 1 11 ASP CG C 1.206 0.411 -12.536 1.00 . A A . 11 ASP CG 1 1
8 1420 1 1 11 ASP H H 5.055 0.511 -11.425 1.00 . A A . 11 ASP H 1 1
8 1421 1 1 11 ASP HA H 2.669 -1.167 -10.986 1.00 . A A . 11 ASP HA 1 1
8 1422 1 1 11 ASP HB2 H 2.724 1.342 -11.338 1.00 . A A . 11 ASP HB2 1 1
8 1423 1 1 11 ASP HB3 H 3.206 1.030 -13.006 1.00 . A A . 11 ASP HB3 1 1
8 1424 1 1 11 ASP N N 4.608 -0.310 -11.131 1.00 . A A . 11 ASP N 1 1
8 1425 1 1 11 ASP O O 4.553 -1.635 -13.535 1.00 . A A . 11 ASP O 1 1
8 1426 1 1 11 ASP OD1 O 0.968 -0.129 -13.603 1.00 . A A . 11 ASP OD1 1 1
8 1427 1 1 11 ASP OD2 O 0.346 0.782 -11.752 1.00 . A A . 11 ASP OD2 1 1
8 1428 1 1 12 CYS C C 1.367 -3.265 -15.290 1.00 . A A . 12 CYS C 1 1
8 1429 1 1 12 CYS CA C 2.626 -3.315 -14.416 1.00 . A A . 12 CYS CA 1 1
8 1430 1 1 12 CYS CB C 2.786 -4.699 -13.775 1.00 . A A . 12 CYS CB 1 1
8 1431 1 1 12 CYS H H 1.666 -2.345 -12.752 1.00 . A A . 12 CYS H 1 1
8 1432 1 1 12 CYS HA H 3.500 -3.078 -14.999 1.00 . A A . 12 CYS HA 1 1
8 1433 1 1 12 CYS HB2 H 2.788 -5.455 -14.546 1.00 . A A . 12 CYS HB2 1 1
8 1434 1 1 12 CYS HB3 H 3.721 -4.737 -13.234 1.00 . A A . 12 CYS HB3 1 1
8 1435 1 1 12 CYS N N 2.500 -2.377 -13.265 1.00 . A A . 12 CYS N 1 1
8 1436 1 1 12 CYS O O 0.684 -4.255 -15.456 1.00 . A A . 12 CYS O 1 1
8 1437 1 1 12 CYS SG S 1.416 -5.010 -12.629 1.00 . A A . 12 CYS SG 1 1
8 1438 1 1 13 NH2 HN1 H 1.581 -1.340 -15.735 1.00 . A A . 13 NH2 HN1 1 1
8 1439 1 1 13 NH2 HN2 H 0.231 -2.100 -16.428 1.00 . A A . 13 NH2 HN2 1 1
8 1440 1 1 13 NH2 N N 1.033 -2.142 -15.865 1.00 . A A . 13 NH2 N 1 1
9 1441 1 1 1 ACE C C 1.590 -5.491 -9.591 1.00 . A A . 1 ACE C 1 1
9 1442 1 1 1 ACE CH3 C 0.744 -6.617 -8.993 1.00 . A A . 1 ACE CH3 1 1
9 1443 1 1 1 ACE H1 H 1.355 -7.496 -8.865 1.00 . A A . 1 ACE H1 1 1
9 1444 1 1 1 ACE H2 H -0.077 -6.842 -9.660 1.00 . A A . 1 ACE H2 1 1
9 1445 1 1 1 ACE H3 H 0.355 -6.304 -8.036 1.00 . A A . 1 ACE H3 1 1
9 1446 1 1 1 ACE O O 2.563 -5.057 -9.006 1.00 . A A . 1 ACE O 1 1
9 1447 1 1 2 CYS C C 1.414 -2.556 -11.010 1.00 . A A . 2 CYS C 1 1
9 1448 1 1 2 CYS CA C 2.014 -3.915 -11.384 1.00 . A A . 2 CYS CA 1 1
9 1449 1 1 2 CYS CB C 1.898 -4.161 -12.889 1.00 . A A . 2 CYS CB 1 1
9 1450 1 1 2 CYS H H 0.441 -5.379 -11.208 1.00 . A A . 2 CYS H 1 1
9 1451 1 1 2 CYS HA H 3.046 -3.969 -11.078 1.00 . A A . 2 CYS HA 1 1
9 1452 1 1 2 CYS HB2 H 0.978 -4.686 -13.098 1.00 . A A . 2 CYS HB2 1 1
9 1453 1 1 2 CYS HB3 H 1.902 -3.215 -13.409 1.00 . A A . 2 CYS HB3 1 1
9 1454 1 1 2 CYS N N 1.228 -5.014 -10.752 1.00 . A A . 2 CYS N 1 1
9 1455 1 1 2 CYS O O 0.612 -2.000 -11.735 1.00 . A A . 2 CYS O 1 1
9 1456 1 1 2 CYS SG S 3.301 -5.161 -13.445 1.00 . A A . 2 CYS SG 1 1
9 1457 1 1 3 ARG C C 2.387 0.298 -9.235 1.00 . A A . 3 ARG C 1 1
9 1458 1 1 3 ARG CA C 1.248 -0.698 -9.451 1.00 . A A . 3 ARG CA 1 1
9 1459 1 1 3 ARG CB C 0.538 -0.979 -8.127 1.00 . A A . 3 ARG CB 1 1
9 1460 1 1 3 ARG CD C -1.569 -1.824 -7.093 1.00 . A A . 3 ARG CD 1 1
9 1461 1 1 3 ARG CG C -0.923 -1.339 -8.392 1.00 . A A . 3 ARG CG 1 1
9 1462 1 1 3 ARG CZ C -1.811 -0.637 -4.996 1.00 . A A . 3 ARG CZ 1 1
9 1463 1 1 3 ARG H H 2.441 -2.488 -9.311 1.00 . A A . 3 ARG H 1 1
9 1464 1 1 3 ARG HA H 0.544 -0.325 -10.178 1.00 . A A . 3 ARG HA 1 1
9 1465 1 1 3 ARG HB2 H 1.027 -1.802 -7.626 1.00 . A A . 3 ARG HB2 1 1
9 1466 1 1 3 ARG HB3 H 0.583 -0.100 -7.501 1.00 . A A . 3 ARG HB3 1 1
9 1467 1 1 3 ARG HD2 H -2.502 -2.330 -7.304 1.00 . A A . 3 ARG HD2 1 1
9 1468 1 1 3 ARG HD3 H -0.897 -2.479 -6.561 1.00 . A A . 3 ARG HD3 1 1
9 1469 1 1 3 ARG HE H -1.974 0.264 -6.757 1.00 . A A . 3 ARG HE 1 1
9 1470 1 1 3 ARG HG2 H -1.448 -0.467 -8.755 1.00 . A A . 3 ARG HG2 1 1
9 1471 1 1 3 ARG HG3 H -0.972 -2.124 -9.132 1.00 . A A . 3 ARG HG3 1 1
9 1472 1 1 3 ARG HH11 H -3.583 -1.561 -4.878 1.00 . A A . 3 ARG HH11 1 1
9 1473 1 1 3 ARG HH12 H -2.813 -1.221 -3.364 1.00 . A A . 3 ARG HH12 1 1
9 1474 1 1 3 ARG HH21 H -0.038 0.275 -4.809 1.00 . A A . 3 ARG HH21 1 1
9 1475 1 1 3 ARG HH22 H -0.806 -0.181 -3.325 1.00 . A A . 3 ARG HH22 1 1
9 1476 1 1 3 ARG N N 1.795 -2.021 -9.879 1.00 . A A . 3 ARG N 1 1
9 1477 1 1 3 ARG NE N -1.812 -0.587 -6.300 1.00 . A A . 3 ARG NE 1 1
9 1478 1 1 3 ARG NH1 N -2.814 -1.182 -4.363 1.00 . A A . 3 ARG NH1 1 1
9 1479 1 1 3 ARG NH2 N -0.807 -0.143 -4.324 1.00 . A A . 3 ARG NH2 1 1
9 1480 1 1 3 ARG O O 3.496 -0.080 -8.908 1.00 . A A . 3 ARG O 1 1
9 1481 1 1 4 VAL C C 2.821 3.648 -8.206 1.00 . A A . 4 VAL C 1 1
9 1482 1 1 4 VAL CA C 3.226 2.570 -9.214 1.00 . A A . 4 VAL CA 1 1
9 1483 1 1 4 VAL CB C 3.469 3.205 -10.590 1.00 . A A . 4 VAL CB 1 1
9 1484 1 1 4 VAL CG1 C 2.392 4.252 -10.888 1.00 . A A . 4 VAL CG1 1 1
9 1485 1 1 4 VAL CG2 C 4.838 3.889 -10.590 1.00 . A A . 4 VAL CG2 1 1
9 1486 1 1 4 VAL H H 1.239 1.866 -9.683 1.00 . A A . 4 VAL H 1 1
9 1487 1 1 4 VAL HA H 4.125 2.073 -8.883 1.00 . A A . 4 VAL HA 1 1
9 1488 1 1 4 VAL HB H 3.447 2.443 -11.351 1.00 . A A . 4 VAL HB 1 1
9 1489 1 1 4 VAL HG11 H 2.336 4.417 -11.954 1.00 . A A . 4 VAL HG11 1 1
9 1490 1 1 4 VAL HG12 H 2.647 5.179 -10.393 1.00 . A A . 4 VAL HG12 1 1
9 1491 1 1 4 VAL HG13 H 1.440 3.900 -10.524 1.00 . A A . 4 VAL HG13 1 1
9 1492 1 1 4 VAL HG21 H 5.000 4.375 -9.638 1.00 . A A . 4 VAL HG21 1 1
9 1493 1 1 4 VAL HG22 H 4.875 4.625 -11.378 1.00 . A A . 4 VAL HG22 1 1
9 1494 1 1 4 VAL HG23 H 5.611 3.151 -10.750 1.00 . A A . 4 VAL HG23 1 1
9 1495 1 1 4 VAL N N 2.136 1.571 -9.417 1.00 . A A . 4 VAL N 1 1
9 1496 1 1 4 VAL O O 1.668 4.027 -8.103 1.00 . A A . 4 VAL O 1 1
9 1497 1 1 5 VAL C C 4.547 6.362 -6.772 1.00 . A A . 5 VAL C 1 1
9 1498 1 1 5 VAL CA C 3.499 5.276 -6.534 1.00 . A A . 5 VAL CA 1 1
9 1499 1 1 5 VAL CB C 3.642 4.697 -5.120 1.00 . A A . 5 VAL CB 1 1
9 1500 1 1 5 VAL CG1 C 2.618 5.369 -4.202 1.00 . A A . 5 VAL CG1 1 1
9 1501 1 1 5 VAL CG2 C 3.388 3.187 -5.129 1.00 . A A . 5 VAL CG2 1 1
9 1502 1 1 5 VAL H H 4.703 3.876 -7.634 1.00 . A A . 5 VAL H 1 1
9 1503 1 1 5 VAL HA H 2.505 5.669 -6.685 1.00 . A A . 5 VAL HA 1 1
9 1504 1 1 5 VAL HB H 4.637 4.901 -4.751 1.00 . A A . 5 VAL HB 1 1
9 1505 1 1 5 VAL HG11 H 2.615 6.434 -4.384 1.00 . A A . 5 VAL HG11 1 1
9 1506 1 1 5 VAL HG12 H 2.880 5.181 -3.172 1.00 . A A . 5 VAL HG12 1 1
9 1507 1 1 5 VAL HG13 H 1.636 4.967 -4.405 1.00 . A A . 5 VAL HG13 1 1
9 1508 1 1 5 VAL HG21 H 4.170 2.695 -5.688 1.00 . A A . 5 VAL HG21 1 1
9 1509 1 1 5 VAL HG22 H 2.434 2.986 -5.592 1.00 . A A . 5 VAL HG22 1 1
9 1510 1 1 5 VAL HG23 H 3.380 2.815 -4.114 1.00 . A A . 5 VAL HG23 1 1
9 1511 1 1 5 VAL N N 3.779 4.177 -7.500 1.00 . A A . 5 VAL N 1 1
9 1512 1 1 5 VAL O O 5.621 6.084 -7.276 1.00 . A A . 5 VAL O 1 1
9 1513 1 1 6 ARG C C 6.393 8.513 -5.596 1.00 . A A . 6 ARG C 1 1
9 1514 1 1 6 ARG CA C 5.305 8.643 -6.660 1.00 . A A . 6 ARG CA 1 1
9 1515 1 1 6 ARG CB C 4.571 9.983 -6.558 1.00 . A A . 6 ARG CB 1 1
9 1516 1 1 6 ARG CD C 4.210 11.450 -4.582 1.00 . A A . 6 ARG CD 1 1
9 1517 1 1 6 ARG CG C 3.887 10.090 -5.200 1.00 . A A . 6 ARG CG 1 1
9 1518 1 1 6 ARG CZ C 2.169 12.636 -4.047 1.00 . A A . 6 ARG CZ 1 1
9 1519 1 1 6 ARG H H 3.420 7.810 -5.999 1.00 . A A . 6 ARG H 1 1
9 1520 1 1 6 ARG HA H 5.720 8.532 -7.647 1.00 . A A . 6 ARG HA 1 1
9 1521 1 1 6 ARG HB2 H 5.285 10.789 -6.673 1.00 . A A . 6 ARG HB2 1 1
9 1522 1 1 6 ARG HB3 H 3.829 10.048 -7.343 1.00 . A A . 6 ARG HB3 1 1
9 1523 1 1 6 ARG HD2 H 5.129 11.391 -4.013 1.00 . A A . 6 ARG HD2 1 1
9 1524 1 1 6 ARG HD3 H 4.290 12.200 -5.351 1.00 . A A . 6 ARG HD3 1 1
9 1525 1 1 6 ARG HE H 2.972 11.288 -2.830 1.00 . A A . 6 ARG HE 1 1
9 1526 1 1 6 ARG HG2 H 2.818 9.989 -5.324 1.00 . A A . 6 ARG HG2 1 1
9 1527 1 1 6 ARG HG3 H 4.250 9.306 -4.553 1.00 . A A . 6 ARG HG3 1 1
9 1528 1 1 6 ARG HH11 H 3.353 14.209 -3.675 1.00 . A A . 6 ARG HH11 1 1
9 1529 1 1 6 ARG HH12 H 1.769 14.586 -4.265 1.00 . A A . 6 ARG HH12 1 1
9 1530 1 1 6 ARG HH21 H 0.776 11.273 -4.501 1.00 . A A . 6 ARG HH21 1 1
9 1531 1 1 6 ARG HH22 H 0.311 12.925 -4.733 1.00 . A A . 6 ARG HH22 1 1
9 1532 1 1 6 ARG N N 4.276 7.588 -6.418 1.00 . A A . 6 ARG N 1 1
9 1533 1 1 6 ARG NE N 3.060 11.751 -3.689 1.00 . A A . 6 ARG NE 1 1
9 1534 1 1 6 ARG NH1 N 2.453 13.909 -3.992 1.00 . A A . 6 ARG NH1 1 1
9 1535 1 1 6 ARG NH2 N 0.994 12.248 -4.458 1.00 . A A . 6 ARG NH2 1 1
9 1536 1 1 6 ARG O O 6.442 9.244 -4.627 1.00 . A A . 6 ARG O 1 1
9 1537 1 1 7 GLY C C 8.607 5.774 -4.824 1.00 . A A . 7 GLY C 1 1
9 1538 1 1 7 GLY CA C 8.354 7.278 -4.820 1.00 . A A . 7 GLY CA 1 1
9 1539 1 1 7 GLY H H 7.163 6.971 -6.572 1.00 . A A . 7 GLY H 1 1
9 1540 1 1 7 GLY HA2 H 9.247 7.801 -5.128 1.00 . A A . 7 GLY HA2 1 1
9 1541 1 1 7 GLY HA3 H 8.063 7.593 -3.830 1.00 . A A . 7 GLY HA3 1 1
9 1542 1 1 7 GLY N N 7.255 7.547 -5.786 1.00 . A A . 7 GLY N 1 1
9 1543 1 1 7 GLY O O 9.726 5.312 -4.711 1.00 . A A . 7 GLY O 1 1
9 1544 1 1 8 ASP C C 7.315 3.085 -6.472 1.00 . A A . 8 ASP C 1 1
9 1545 1 1 8 ASP CA C 7.713 3.531 -5.069 1.00 . A A . 8 ASP CA 1 1
9 1546 1 1 8 ASP CB C 6.748 2.968 -4.021 1.00 . A A . 8 ASP CB 1 1
9 1547 1 1 8 ASP CG C 7.241 3.340 -2.621 1.00 . A A . 8 ASP CG 1 1
9 1548 1 1 8 ASP H H 6.675 5.412 -5.132 1.00 . A A . 8 ASP H 1 1
9 1549 1 1 8 ASP HA H 8.727 3.240 -4.847 1.00 . A A . 8 ASP HA 1 1
9 1550 1 1 8 ASP HB2 H 5.764 3.385 -4.179 1.00 . A A . 8 ASP HB2 1 1
9 1551 1 1 8 ASP HB3 H 6.703 1.894 -4.111 1.00 . A A . 8 ASP HB3 1 1
9 1552 1 1 8 ASP N N 7.562 5.008 -5.004 1.00 . A A . 8 ASP N 1 1
9 1553 1 1 8 ASP O O 6.339 2.385 -6.661 1.00 . A A . 8 ASP O 1 1
9 1554 1 1 8 ASP OD1 O 7.563 4.499 -2.417 1.00 . A A . 8 ASP OD1 1 1
9 1555 1 1 8 ASP OD2 O 7.289 2.460 -1.778 1.00 . A A . 8 ASP OD2 1 1
9 1556 1 1 9 TYR C C 8.131 1.683 -9.114 1.00 . A A . 9 TYR C 1 1
9 1557 1 1 9 TYR CA C 7.708 3.134 -8.857 1.00 . A A . 9 TYR CA 1 1
9 1558 1 1 9 TYR CB C 8.530 4.081 -9.753 1.00 . A A . 9 TYR CB 1 1
9 1559 1 1 9 TYR CD1 C 7.207 6.233 -9.913 1.00 . A A . 9 TYR CD1 1 1
9 1560 1 1 9 TYR CD2 C 9.186 6.190 -8.512 1.00 . A A . 9 TYR CD2 1 1
9 1561 1 1 9 TYR CE1 C 7.002 7.576 -9.581 1.00 . A A . 9 TYR CE1 1 1
9 1562 1 1 9 TYR CE2 C 8.981 7.535 -8.179 1.00 . A A . 9 TYR CE2 1 1
9 1563 1 1 9 TYR CG C 8.297 5.535 -9.379 1.00 . A A . 9 TYR CG 1 1
9 1564 1 1 9 TYR CZ C 7.887 8.229 -8.714 1.00 . A A . 9 TYR CZ 1 1
9 1565 1 1 9 TYR H H 8.826 4.084 -7.287 1.00 . A A . 9 TYR H 1 1
9 1566 1 1 9 TYR HA H 6.650 3.273 -9.041 1.00 . A A . 9 TYR HA 1 1
9 1567 1 1 9 TYR HB2 H 9.577 3.853 -9.639 1.00 . A A . 9 TYR HB2 1 1
9 1568 1 1 9 TYR HB3 H 8.247 3.930 -10.787 1.00 . A A . 9 TYR HB3 1 1
9 1569 1 1 9 TYR HD1 H 6.523 5.734 -10.581 1.00 . A A . 9 TYR HD1 1 1
9 1570 1 1 9 TYR HD2 H 10.029 5.659 -8.100 1.00 . A A . 9 TYR HD2 1 1
9 1571 1 1 9 TYR HE1 H 6.161 8.109 -9.995 1.00 . A A . 9 TYR HE1 1 1
9 1572 1 1 9 TYR HE2 H 9.665 8.036 -7.508 1.00 . A A . 9 TYR HE2 1 1
9 1573 1 1 9 TYR HH H 8.113 10.097 -9.057 1.00 . A A . 9 TYR HH 1 1
9 1574 1 1 9 TYR N N 8.057 3.505 -7.461 1.00 . A A . 9 TYR N 1 1
9 1575 1 1 9 TYR O O 9.037 1.417 -9.875 1.00 . A A . 9 TYR O 1 1
9 1576 1 1 9 TYR OH O 7.685 9.556 -8.388 1.00 . A A . 9 TYR OH 1 1
9 1577 1 1 10 LEU C C 6.864 -1.325 -9.704 1.00 . A A . 10 LEU C 1 1
9 1578 1 1 10 LEU CA C 7.820 -0.693 -8.688 1.00 . A A . 10 LEU CA 1 1
9 1579 1 1 10 LEU CB C 7.610 -1.348 -7.316 1.00 . A A . 10 LEU CB 1 1
9 1580 1 1 10 LEU CD1 C 10.106 -1.348 -7.015 1.00 . A A . 10 LEU CD1 1 1
9 1581 1 1 10 LEU CD2 C 8.729 0.464 -5.984 1.00 . A A . 10 LEU CD2 1 1
9 1582 1 1 10 LEU CG C 8.766 -1.020 -6.358 1.00 . A A . 10 LEU CG 1 1
9 1583 1 1 10 LEU H H 6.737 0.983 -7.883 1.00 . A A . 10 LEU H 1 1
9 1584 1 1 10 LEU HA H 8.846 -0.797 -9.005 1.00 . A A . 10 LEU HA 1 1
9 1585 1 1 10 LEU HB2 H 6.686 -0.982 -6.894 1.00 . A A . 10 LEU HB2 1 1
9 1586 1 1 10 LEU HB3 H 7.543 -2.418 -7.440 1.00 . A A . 10 LEU HB3 1 1
9 1587 1 1 10 LEU HD11 H 10.003 -2.243 -7.611 1.00 . A A . 10 LEU HD11 1 1
9 1588 1 1 10 LEU HD12 H 10.852 -1.508 -6.251 1.00 . A A . 10 LEU HD12 1 1
9 1589 1 1 10 LEU HD13 H 10.406 -0.526 -7.648 1.00 . A A . 10 LEU HD13 1 1
9 1590 1 1 10 LEU HD21 H 7.721 0.744 -5.714 1.00 . A A . 10 LEU HD21 1 1
9 1591 1 1 10 LEU HD22 H 9.053 1.057 -6.826 1.00 . A A . 10 LEU HD22 1 1
9 1592 1 1 10 LEU HD23 H 9.387 0.639 -5.145 1.00 . A A . 10 LEU HD23 1 1
9 1593 1 1 10 LEU HG H 8.655 -1.615 -5.462 1.00 . A A . 10 LEU HG 1 1
9 1594 1 1 10 LEU N N 7.469 0.742 -8.485 1.00 . A A . 10 LEU N 1 1
9 1595 1 1 10 LEU O O 6.640 -2.523 -9.687 1.00 . A A . 10 LEU O 1 1
9 1596 1 1 11 ASP C C 6.090 -1.642 -12.770 1.00 . A A . 11 ASP C 1 1
9 1597 1 1 11 ASP CA C 5.323 -1.103 -11.566 1.00 . A A . 11 ASP CA 1 1
9 1598 1 1 11 ASP CB C 4.437 0.071 -11.987 1.00 . A A . 11 ASP CB 1 1
9 1599 1 1 11 ASP CG C 3.066 -0.437 -12.454 1.00 . A A . 11 ASP CG 1 1
9 1600 1 1 11 ASP H H 6.465 0.428 -10.560 1.00 . A A . 11 ASP H 1 1
9 1601 1 1 11 ASP HA H 4.724 -1.878 -11.112 1.00 . A A . 11 ASP HA 1 1
9 1602 1 1 11 ASP HB2 H 4.305 0.736 -11.150 1.00 . A A . 11 ASP HB2 1 1
9 1603 1 1 11 ASP HB3 H 4.913 0.603 -12.797 1.00 . A A . 11 ASP HB3 1 1
9 1604 1 1 11 ASP N N 6.283 -0.534 -10.573 1.00 . A A . 11 ASP N 1 1
9 1605 1 1 11 ASP O O 7.304 -1.606 -12.808 1.00 . A A . 11 ASP O 1 1
9 1606 1 1 11 ASP OD1 O 3.036 -1.297 -13.318 1.00 . A A . 11 ASP OD1 1 1
9 1607 1 1 11 ASP OD2 O 2.069 0.059 -11.952 1.00 . A A . 11 ASP OD2 1 1
9 1608 1 1 12 CYS C C 5.678 -1.949 -16.214 1.00 . A A . 12 CYS C 1 1
9 1609 1 1 12 CYS CA C 6.106 -2.694 -14.947 1.00 . A A . 12 CYS CA 1 1
9 1610 1 1 12 CYS CB C 5.689 -4.162 -15.015 1.00 . A A . 12 CYS CB 1 1
9 1611 1 1 12 CYS H H 4.421 -2.176 -13.705 1.00 . A A . 12 CYS H 1 1
9 1612 1 1 12 CYS HA H 7.173 -2.623 -14.813 1.00 . A A . 12 CYS HA 1 1
9 1613 1 1 12 CYS HB2 H 6.153 -4.627 -15.872 1.00 . A A . 12 CYS HB2 1 1
9 1614 1 1 12 CYS HB3 H 6.010 -4.668 -14.115 1.00 . A A . 12 CYS HB3 1 1
9 1615 1 1 12 CYS N N 5.400 -2.148 -13.753 1.00 . A A . 12 CYS N 1 1
9 1616 1 1 12 CYS O O 5.734 -2.488 -17.301 1.00 . A A . 12 CYS O 1 1
9 1617 1 1 12 CYS SG S 3.889 -4.284 -15.166 1.00 . A A . 12 CYS SG 1 1
9 1618 1 1 13 NH2 HN1 H 5.204 -0.289 -15.238 1.00 . A A . 13 NH2 HN1 1 1
9 1619 1 1 13 NH2 HN2 H 4.977 -0.236 -16.921 1.00 . A A . 13 NH2 HN2 1 1
9 1620 1 1 13 NH2 N N 5.249 -0.724 -16.116 1.00 . A A . 13 NH2 N 1 1
10 1621 1 1 1 ACE C C 0.797 -5.086 -4.926 1.00 . A A . 1 ACE C 1 1
10 1622 1 1 1 ACE CH3 C 1.101 -6.297 -4.041 1.00 . A A . 1 ACE CH3 1 1
10 1623 1 1 1 ACE H1 H 1.856 -6.033 -3.315 1.00 . A A . 1 ACE H1 1 1
10 1624 1 1 1 ACE H2 H 1.461 -7.109 -4.655 1.00 . A A . 1 ACE H2 1 1
10 1625 1 1 1 ACE H3 H 0.200 -6.603 -3.530 1.00 . A A . 1 ACE H3 1 1
10 1626 1 1 1 ACE O O -0.344 -4.786 -5.212 1.00 . A A . 1 ACE O 1 1
10 1627 1 1 2 CYS C C 0.609 -2.218 -5.591 1.00 . A A . 2 CYS C 1 1
10 1628 1 1 2 CYS CA C 1.605 -3.193 -6.233 1.00 . A A . 2 CYS CA 1 1
10 1629 1 1 2 CYS CB C 1.041 -3.743 -7.547 1.00 . A A . 2 CYS CB 1 1
10 1630 1 1 2 CYS H H 2.727 -4.657 -5.114 1.00 . A A . 2 CYS H 1 1
10 1631 1 1 2 CYS HA H 2.545 -2.698 -6.416 1.00 . A A . 2 CYS HA 1 1
10 1632 1 1 2 CYS HB2 H 0.231 -4.424 -7.333 1.00 . A A . 2 CYS HB2 1 1
10 1633 1 1 2 CYS HB3 H 0.673 -2.926 -8.150 1.00 . A A . 2 CYS HB3 1 1
10 1634 1 1 2 CYS N N 1.817 -4.390 -5.360 1.00 . A A . 2 CYS N 1 1
10 1635 1 1 2 CYS O O -0.579 -2.279 -5.842 1.00 . A A . 2 CYS O 1 1
10 1636 1 1 2 CYS SG S 2.340 -4.622 -8.451 1.00 . A A . 2 CYS SG 1 1
10 1637 1 1 3 ARG C C 0.845 1.016 -3.923 1.00 . A A . 3 ARG C 1 1
10 1638 1 1 3 ARG CA C 0.159 -0.343 -4.115 1.00 . A A . 3 ARG CA 1 1
10 1639 1 1 3 ARG CB C -0.170 -0.973 -2.761 1.00 . A A . 3 ARG CB 1 1
10 1640 1 1 3 ARG CD C -2.646 -0.745 -2.532 1.00 . A A . 3 ARG CD 1 1
10 1641 1 1 3 ARG CG C -1.507 -1.712 -2.852 1.00 . A A . 3 ARG CG 1 1
10 1642 1 1 3 ARG CZ C -4.552 -2.167 -2.083 1.00 . A A . 3 ARG CZ 1 1
10 1643 1 1 3 ARG H H 2.044 -1.280 -4.580 1.00 . A A . 3 ARG H 1 1
10 1644 1 1 3 ARG HA H -0.742 -0.231 -4.697 1.00 . A A . 3 ARG HA 1 1
10 1645 1 1 3 ARG HB2 H 0.611 -1.669 -2.490 1.00 . A A . 3 ARG HB2 1 1
10 1646 1 1 3 ARG HB3 H -0.238 -0.200 -2.010 1.00 . A A . 3 ARG HB3 1 1
10 1647 1 1 3 ARG HD2 H -2.671 -0.532 -1.472 1.00 . A A . 3 ARG HD2 1 1
10 1648 1 1 3 ARG HD3 H -2.535 0.167 -3.098 1.00 . A A . 3 ARG HD3 1 1
10 1649 1 1 3 ARG HE H -4.197 -1.394 -3.877 1.00 . A A . 3 ARG HE 1 1
10 1650 1 1 3 ARG HG2 H -1.634 -2.102 -3.851 1.00 . A A . 3 ARG HG2 1 1
10 1651 1 1 3 ARG HG3 H -1.517 -2.526 -2.142 1.00 . A A . 3 ARG HG3 1 1
10 1652 1 1 3 ARG HH11 H -5.186 -0.578 -1.043 1.00 . A A . 3 ARG HH11 1 1
10 1653 1 1 3 ARG HH12 H -5.713 -2.119 -0.453 1.00 . A A . 3 ARG HH12 1 1
10 1654 1 1 3 ARG HH21 H -4.074 -3.921 -2.921 1.00 . A A . 3 ARG HH21 1 1
10 1655 1 1 3 ARG HH22 H -5.083 -4.012 -1.517 1.00 . A A . 3 ARG HH22 1 1
10 1656 1 1 3 ARG N N 1.083 -1.316 -4.768 1.00 . A A . 3 ARG N 1 1
10 1657 1 1 3 ARG NE N -3.884 -1.458 -2.950 1.00 . A A . 3 ARG NE 1 1
10 1658 1 1 3 ARG NH1 N -5.202 -1.575 -1.118 1.00 . A A . 3 ARG NH1 1 1
10 1659 1 1 3 ARG NH2 N -4.572 -3.468 -2.181 1.00 . A A . 3 ARG NH2 1 1
10 1660 1 1 3 ARG O O 0.644 1.681 -2.925 1.00 . A A . 3 ARG O 1 1
10 1661 1 1 4 VAL C C 2.657 3.381 -6.074 1.00 . A A . 4 VAL C 1 1
10 1662 1 1 4 VAL CA C 2.359 2.746 -4.703 1.00 . A A . 4 VAL CA 1 1
10 1663 1 1 4 VAL CB C 3.645 2.407 -3.949 1.00 . A A . 4 VAL CB 1 1
10 1664 1 1 4 VAL CG1 C 4.475 1.409 -4.762 1.00 . A A . 4 VAL CG1 1 1
10 1665 1 1 4 VAL CG2 C 4.453 3.684 -3.713 1.00 . A A . 4 VAL CG2 1 1
10 1666 1 1 4 VAL H H 1.821 0.883 -5.654 1.00 . A A . 4 VAL H 1 1
10 1667 1 1 4 VAL HA H 1.759 3.414 -4.109 1.00 . A A . 4 VAL HA 1 1
10 1668 1 1 4 VAL HB H 3.389 1.964 -2.997 1.00 . A A . 4 VAL HB 1 1
10 1669 1 1 4 VAL HG11 H 4.150 0.404 -4.537 1.00 . A A . 4 VAL HG11 1 1
10 1670 1 1 4 VAL HG12 H 5.517 1.516 -4.507 1.00 . A A . 4 VAL HG12 1 1
10 1671 1 1 4 VAL HG13 H 4.340 1.601 -5.816 1.00 . A A . 4 VAL HG13 1 1
10 1672 1 1 4 VAL HG21 H 3.802 4.454 -3.322 1.00 . A A . 4 VAL HG21 1 1
10 1673 1 1 4 VAL HG22 H 4.883 4.017 -4.645 1.00 . A A . 4 VAL HG22 1 1
10 1674 1 1 4 VAL HG23 H 5.240 3.484 -3.002 1.00 . A A . 4 VAL HG23 1 1
10 1675 1 1 4 VAL N N 1.662 1.432 -4.858 1.00 . A A . 4 VAL N 1 1
10 1676 1 1 4 VAL O O 2.514 2.751 -7.103 1.00 . A A . 4 VAL O 1 1
10 1677 1 1 5 VAL C C 4.596 6.218 -7.267 1.00 . A A . 5 VAL C 1 1
10 1678 1 1 5 VAL CA C 3.360 5.310 -7.387 1.00 . A A . 5 VAL CA 1 1
10 1679 1 1 5 VAL CB C 2.082 6.105 -7.725 1.00 . A A . 5 VAL CB 1 1
10 1680 1 1 5 VAL CG1 C 1.498 6.777 -6.474 1.00 . A A . 5 VAL CG1 1 1
10 1681 1 1 5 VAL CG2 C 2.381 7.168 -8.793 1.00 . A A . 5 VAL CG2 1 1
10 1682 1 1 5 VAL H H 3.169 5.119 -5.254 1.00 . A A . 5 VAL H 1 1
10 1683 1 1 5 VAL HA H 3.531 4.577 -8.144 1.00 . A A . 5 VAL HA 1 1
10 1684 1 1 5 VAL HB H 1.353 5.421 -8.109 1.00 . A A . 5 VAL HB 1 1
10 1685 1 1 5 VAL HG11 H 2.217 6.735 -5.671 1.00 . A A . 5 VAL HG11 1 1
10 1686 1 1 5 VAL HG12 H 0.599 6.260 -6.176 1.00 . A A . 5 VAL HG12 1 1
10 1687 1 1 5 VAL HG13 H 1.261 7.809 -6.695 1.00 . A A . 5 VAL HG13 1 1
10 1688 1 1 5 VAL HG21 H 1.595 7.168 -9.533 1.00 . A A . 5 VAL HG21 1 1
10 1689 1 1 5 VAL HG22 H 3.323 6.943 -9.272 1.00 . A A . 5 VAL HG22 1 1
10 1690 1 1 5 VAL HG23 H 2.438 8.141 -8.329 1.00 . A A . 5 VAL HG23 1 1
10 1691 1 1 5 VAL N N 3.063 4.630 -6.091 1.00 . A A . 5 VAL N 1 1
10 1692 1 1 5 VAL O O 5.710 5.807 -7.538 1.00 . A A . 5 VAL O 1 1
10 1693 1 1 6 ARG C C 6.369 8.020 -5.493 1.00 . A A . 6 ARG C 1 1
10 1694 1 1 6 ARG CA C 5.569 8.376 -6.738 1.00 . A A . 6 ARG CA 1 1
10 1695 1 1 6 ARG CB C 4.958 9.773 -6.617 1.00 . A A . 6 ARG CB 1 1
10 1696 1 1 6 ARG CD C 6.946 10.941 -7.605 1.00 . A A . 6 ARG CD 1 1
10 1697 1 1 6 ARG CG C 6.064 10.805 -6.359 1.00 . A A . 6 ARG CG 1 1
10 1698 1 1 6 ARG CZ C 9.323 11.352 -7.355 1.00 . A A . 6 ARG CZ 1 1
10 1699 1 1 6 ARG H H 3.511 7.743 -6.658 1.00 . A A . 6 ARG H 1 1
10 1700 1 1 6 ARG HA H 6.195 8.322 -7.608 1.00 . A A . 6 ARG HA 1 1
10 1701 1 1 6 ARG HB2 H 4.442 10.018 -7.535 1.00 . A A . 6 ARG HB2 1 1
10 1702 1 1 6 ARG HB3 H 4.256 9.787 -5.797 1.00 . A A . 6 ARG HB3 1 1
10 1703 1 1 6 ARG HD2 H 7.282 9.967 -7.933 1.00 . A A . 6 ARG HD2 1 1
10 1704 1 1 6 ARG HD3 H 6.406 11.440 -8.395 1.00 . A A . 6 ARG HD3 1 1
10 1705 1 1 6 ARG HE H 7.944 12.644 -6.741 1.00 . A A . 6 ARG HE 1 1
10 1706 1 1 6 ARG HG2 H 5.617 11.762 -6.130 1.00 . A A . 6 ARG HG2 1 1
10 1707 1 1 6 ARG HG3 H 6.670 10.484 -5.527 1.00 . A A . 6 ARG HG3 1 1
10 1708 1 1 6 ARG HH11 H 9.254 11.550 -9.346 1.00 . A A . 6 ARG HH11 1 1
10 1709 1 1 6 ARG HH12 H 10.749 10.957 -8.702 1.00 . A A . 6 ARG HH12 1 1
10 1710 1 1 6 ARG HH21 H 9.679 11.060 -5.406 1.00 . A A . 6 ARG HH21 1 1
10 1711 1 1 6 ARG HH22 H 10.990 10.681 -6.473 1.00 . A A . 6 ARG HH22 1 1
10 1712 1 1 6 ARG N N 4.409 7.440 -6.863 1.00 . A A . 6 ARG N 1 1
10 1713 1 1 6 ARG NE N 8.101 11.776 -7.169 1.00 . A A . 6 ARG NE 1 1
10 1714 1 1 6 ARG NH1 N 9.813 11.281 -8.562 1.00 . A A . 6 ARG NH1 1 1
10 1715 1 1 6 ARG NH2 N 10.054 11.004 -6.332 1.00 . A A . 6 ARG NH2 1 1
10 1716 1 1 6 ARG O O 5.836 7.846 -4.416 1.00 . A A . 6 ARG O 1 1
10 1717 1 1 7 GLY C C 8.819 5.965 -4.712 1.00 . A A . 7 GLY C 1 1
10 1718 1 1 7 GLY CA C 8.520 7.451 -4.533 1.00 . A A . 7 GLY CA 1 1
10 1719 1 1 7 GLY H H 8.037 7.967 -6.558 1.00 . A A . 7 GLY H 1 1
10 1720 1 1 7 GLY HA2 H 9.439 8.020 -4.552 1.00 . A A . 7 GLY HA2 1 1
10 1721 1 1 7 GLY HA3 H 8.008 7.609 -3.595 1.00 . A A . 7 GLY HA3 1 1
10 1722 1 1 7 GLY N N 7.651 7.857 -5.664 1.00 . A A . 7 GLY N 1 1
10 1723 1 1 7 GLY O O 9.890 5.485 -4.395 1.00 . A A . 7 GLY O 1 1
10 1724 1 1 8 ASP C C 7.077 3.351 -6.584 1.00 . A A . 8 ASP C 1 1
10 1725 1 1 8 ASP CA C 8.054 3.790 -5.490 1.00 . A A . 8 ASP CA 1 1
10 1726 1 1 8 ASP CB C 7.749 3.108 -4.157 1.00 . A A . 8 ASP CB 1 1
10 1727 1 1 8 ASP CG C 9.038 2.990 -3.342 1.00 . A A . 8 ASP CG 1 1
10 1728 1 1 8 ASP H H 7.024 5.657 -5.514 1.00 . A A . 8 ASP H 1 1
10 1729 1 1 8 ASP HA H 9.071 3.588 -5.789 1.00 . A A . 8 ASP HA 1 1
10 1730 1 1 8 ASP HB2 H 7.028 3.695 -3.609 1.00 . A A . 8 ASP HB2 1 1
10 1731 1 1 8 ASP HB3 H 7.350 2.122 -4.340 1.00 . A A . 8 ASP HB3 1 1
10 1732 1 1 8 ASP N N 7.867 5.238 -5.244 1.00 . A A . 8 ASP N 1 1
10 1733 1 1 8 ASP O O 5.942 3.021 -6.315 1.00 . A A . 8 ASP O 1 1
10 1734 1 1 8 ASP OD1 O 9.864 2.164 -3.695 1.00 . A A . 8 ASP OD1 1 1
10 1735 1 1 8 ASP OD2 O 9.178 3.729 -2.382 1.00 . A A . 8 ASP OD2 1 1
10 1736 1 1 9 TYR C C 6.570 1.464 -9.131 1.00 . A A . 9 TYR C 1 1
10 1737 1 1 9 TYR CA C 6.581 2.981 -8.930 1.00 . A A . 9 TYR CA 1 1
10 1738 1 1 9 TYR CB C 7.160 3.654 -10.172 1.00 . A A . 9 TYR CB 1 1
10 1739 1 1 9 TYR CD1 C 5.717 5.673 -10.599 1.00 . A A . 9 TYR CD1 1 1
10 1740 1 1 9 TYR CD2 C 7.866 5.977 -9.520 1.00 . A A . 9 TYR CD2 1 1
10 1741 1 1 9 TYR CE1 C 5.484 7.050 -10.525 1.00 . A A . 9 TYR CE1 1 1
10 1742 1 1 9 TYR CE2 C 7.632 7.354 -9.446 1.00 . A A . 9 TYR CE2 1 1
10 1743 1 1 9 TYR CG C 6.910 5.137 -10.096 1.00 . A A . 9 TYR CG 1 1
10 1744 1 1 9 TYR CZ C 6.441 7.890 -9.949 1.00 . A A . 9 TYR CZ 1 1
10 1745 1 1 9 TYR H H 8.406 3.671 -8.004 1.00 . A A . 9 TYR H 1 1
10 1746 1 1 9 TYR HA H 5.581 3.352 -8.750 1.00 . A A . 9 TYR HA 1 1
10 1747 1 1 9 TYR HB2 H 8.222 3.468 -10.219 1.00 . A A . 9 TYR HB2 1 1
10 1748 1 1 9 TYR HB3 H 6.684 3.253 -11.054 1.00 . A A . 9 TYR HB3 1 1
10 1749 1 1 9 TYR HD1 H 4.978 5.024 -11.045 1.00 . A A . 9 TYR HD1 1 1
10 1750 1 1 9 TYR HD2 H 8.783 5.563 -9.131 1.00 . A A . 9 TYR HD2 1 1
10 1751 1 1 9 TYR HE1 H 4.564 7.464 -10.911 1.00 . A A . 9 TYR HE1 1 1
10 1752 1 1 9 TYR HE2 H 8.371 8.005 -9.001 1.00 . A A . 9 TYR HE2 1 1
10 1753 1 1 9 TYR HH H 5.373 9.382 -9.424 1.00 . A A . 9 TYR HH 1 1
10 1754 1 1 9 TYR N N 7.500 3.371 -7.813 1.00 . A A . 9 TYR N 1 1
10 1755 1 1 9 TYR O O 7.421 0.904 -9.794 1.00 . A A . 9 TYR O 1 1
10 1756 1 1 9 TYR OH O 6.209 9.249 -9.876 1.00 . A A . 9 TYR OH 1 1
10 1757 1 1 10 LEU C C 4.017 -1.053 -8.908 1.00 . A A . 10 LEU C 1 1
10 1758 1 1 10 LEU CA C 5.489 -0.674 -8.751 1.00 . A A . 10 LEU CA 1 1
10 1759 1 1 10 LEU CB C 6.072 -1.278 -7.469 1.00 . A A . 10 LEU CB 1 1
10 1760 1 1 10 LEU CD1 C 7.551 0.473 -6.475 1.00 . A A . 10 LEU CD1 1 1
10 1761 1 1 10 LEU CD2 C 8.316 -1.902 -6.564 1.00 . A A . 10 LEU CD2 1 1
10 1762 1 1 10 LEU CG C 7.521 -0.819 -7.294 1.00 . A A . 10 LEU CG 1 1
10 1763 1 1 10 LEU H H 4.906 1.280 -8.068 1.00 . A A . 10 LEU H 1 1
10 1764 1 1 10 LEU HA H 6.058 -0.998 -9.610 1.00 . A A . 10 LEU HA 1 1
10 1765 1 1 10 LEU HB2 H 5.486 -0.952 -6.621 1.00 . A A . 10 LEU HB2 1 1
10 1766 1 1 10 LEU HB3 H 6.042 -2.356 -7.533 1.00 . A A . 10 LEU HB3 1 1
10 1767 1 1 10 LEU HD11 H 6.564 0.909 -6.457 1.00 . A A . 10 LEU HD11 1 1
10 1768 1 1 10 LEU HD12 H 8.244 1.168 -6.927 1.00 . A A . 10 LEU HD12 1 1
10 1769 1 1 10 LEU HD13 H 7.866 0.256 -5.465 1.00 . A A . 10 LEU HD13 1 1
10 1770 1 1 10 LEU HD21 H 9.332 -1.563 -6.418 1.00 . A A . 10 LEU HD21 1 1
10 1771 1 1 10 LEU HD22 H 8.320 -2.806 -7.154 1.00 . A A . 10 LEU HD22 1 1
10 1772 1 1 10 LEU HD23 H 7.860 -2.099 -5.605 1.00 . A A . 10 LEU HD23 1 1
10 1773 1 1 10 LEU HG H 7.962 -0.641 -8.264 1.00 . A A . 10 LEU HG 1 1
10 1774 1 1 10 LEU N N 5.592 0.802 -8.580 1.00 . A A . 10 LEU N 1 1
10 1775 1 1 10 LEU O O 3.475 -1.804 -8.127 1.00 . A A . 10 LEU O 1 1
10 1776 1 1 11 ASP C C 1.768 -2.151 -10.889 1.00 . A A . 11 ASP C 1 1
10 1777 1 1 11 ASP CA C 1.919 -0.850 -10.101 1.00 . A A . 11 ASP CA 1 1
10 1778 1 1 11 ASP CB C 1.357 0.330 -10.897 1.00 . A A . 11 ASP CB 1 1
10 1779 1 1 11 ASP CG C -0.143 0.127 -11.130 1.00 . A A . 11 ASP CG 1 1
10 1780 1 1 11 ASP H H 3.818 0.082 -10.528 1.00 . A A . 11 ASP H 1 1
10 1781 1 1 11 ASP HA H 1.419 -0.923 -9.147 1.00 . A A . 11 ASP HA 1 1
10 1782 1 1 11 ASP HB2 H 1.514 1.242 -10.342 1.00 . A A . 11 ASP HB2 1 1
10 1783 1 1 11 ASP HB3 H 1.862 0.395 -11.849 1.00 . A A . 11 ASP HB3 1 1
10 1784 1 1 11 ASP N N 3.363 -0.530 -9.911 1.00 . A A . 11 ASP N 1 1
10 1785 1 1 11 ASP O O 2.607 -2.505 -11.694 1.00 . A A . 11 ASP O 1 1
10 1786 1 1 11 ASP OD1 O -0.898 0.318 -10.192 1.00 . A A . 11 ASP OD1 1 1
10 1787 1 1 11 ASP OD2 O -0.508 -0.222 -12.241 1.00 . A A . 11 ASP OD2 1 1
10 1788 1 1 12 CYS C C -0.515 -3.993 -12.484 1.00 . A A . 12 CYS C 1 1
10 1789 1 1 12 CYS CA C 0.505 -4.167 -11.355 1.00 . A A . 12 CYS CA 1 1
10 1790 1 1 12 CYS CB C -0.030 -5.117 -10.283 1.00 . A A . 12 CYS CB 1 1
10 1791 1 1 12 CYS H H 0.058 -2.576 -9.976 1.00 . A A . 12 CYS H 1 1
10 1792 1 1 12 CYS HA H 1.439 -4.536 -11.742 1.00 . A A . 12 CYS HA 1 1
10 1793 1 1 12 CYS HB2 H -0.547 -4.548 -9.524 1.00 . A A . 12 CYS HB2 1 1
10 1794 1 1 12 CYS HB3 H -0.715 -5.820 -10.735 1.00 . A A . 12 CYS HB3 1 1
10 1795 1 1 12 CYS N N 0.712 -2.876 -10.642 1.00 . A A . 12 CYS N 1 1
10 1796 1 1 12 CYS O O -1.308 -4.873 -12.748 1.00 . A A . 12 CYS O 1 1
10 1797 1 1 12 CYS SG S 1.347 -6.018 -9.527 1.00 . A A . 12 CYS SG 1 1
10 1798 1 1 13 NH2 HN1 H 0.115 -2.171 -12.957 1.00 . A A . 13 NH2 HN1 1 1
10 1799 1 1 13 NH2 HN2 H -1.169 -2.761 -13.897 1.00 . A A . 13 NH2 HN2 1 1
10 1800 1 1 13 NH2 N N -0.524 -2.883 -13.169 1.00 . A A . 13 NH2 N 1 1
11 1801 1 1 1 ACE C C 2.589 -3.919 -3.965 1.00 . A A . 1 ACE C 1 1
11 1802 1 1 1 ACE CH3 C 2.577 -5.031 -2.915 1.00 . A A . 1 ACE CH3 1 1
11 1803 1 1 1 ACE H1 H 3.306 -5.781 -3.180 1.00 . A A . 1 ACE H1 1 1
11 1804 1 1 1 ACE H2 H 1.595 -5.481 -2.879 1.00 . A A . 1 ACE H2 1 1
11 1805 1 1 1 ACE H3 H 2.820 -4.617 -1.949 1.00 . A A . 1 ACE H3 1 1
11 1806 1 1 1 ACE O O 3.393 -3.010 -3.907 1.00 . A A . 1 ACE O 1 1
11 1807 1 1 2 CYS C C 0.569 -1.908 -5.680 1.00 . A A . 2 CYS C 1 1
11 1808 1 1 2 CYS CA C 1.665 -2.936 -5.989 1.00 . A A . 2 CYS CA 1 1
11 1809 1 1 2 CYS CB C 1.337 -3.692 -7.281 1.00 . A A . 2 CYS CB 1 1
11 1810 1 1 2 CYS H H 1.066 -4.730 -4.952 1.00 . A A . 2 CYS H 1 1
11 1811 1 1 2 CYS HA H 2.627 -2.454 -6.076 1.00 . A A . 2 CYS HA 1 1
11 1812 1 1 2 CYS HB2 H 0.398 -4.208 -7.163 1.00 . A A . 2 CYS HB2 1 1
11 1813 1 1 2 CYS HB3 H 1.264 -2.992 -8.098 1.00 . A A . 2 CYS HB3 1 1
11 1814 1 1 2 CYS N N 1.703 -3.987 -4.926 1.00 . A A . 2 CYS N 1 1
11 1815 1 1 2 CYS O O -0.577 -2.084 -6.049 1.00 . A A . 2 CYS O 1 1
11 1816 1 1 2 CYS SG S 2.644 -4.898 -7.634 1.00 . A A . 2 CYS SG 1 1
11 1817 1 1 3 ARG C C 0.441 1.604 -4.705 1.00 . A A . 3 ARG C 1 1
11 1818 1 1 3 ARG CA C -0.130 0.187 -4.668 1.00 . A A . 3 ARG CA 1 1
11 1819 1 1 3 ARG CB C -0.567 -0.151 -3.249 1.00 . A A . 3 ARG CB 1 1
11 1820 1 1 3 ARG CD C -2.049 -1.617 -1.892 1.00 . A A . 3 ARG CD 1 1
11 1821 1 1 3 ARG CG C -1.803 -1.045 -3.288 1.00 . A A . 3 ARG CG 1 1
11 1822 1 1 3 ARG CZ C -2.793 -0.483 0.110 1.00 . A A . 3 ARG CZ 1 1
11 1823 1 1 3 ARG H H 1.832 -0.721 -4.713 1.00 . A A . 3 ARG H 1 1
11 1824 1 1 3 ARG HA H -0.962 0.107 -5.334 1.00 . A A . 3 ARG HA 1 1
11 1825 1 1 3 ARG HB2 H 0.236 -0.666 -2.740 1.00 . A A . 3 ARG HB2 1 1
11 1826 1 1 3 ARG HB3 H -0.801 0.760 -2.718 1.00 . A A . 3 ARG HB3 1 1
11 1827 1 1 3 ARG HD2 H -2.609 -2.540 -1.957 1.00 . A A . 3 ARG HD2 1 1
11 1828 1 1 3 ARG HD3 H -1.113 -1.776 -1.382 1.00 . A A . 3 ARG HD3 1 1
11 1829 1 1 3 ARG HE H -3.397 0.050 -1.703 1.00 . A A . 3 ARG HE 1 1
11 1830 1 1 3 ARG HG2 H -2.659 -0.461 -3.597 1.00 . A A . 3 ARG HG2 1 1
11 1831 1 1 3 ARG HG3 H -1.644 -1.853 -3.985 1.00 . A A . 3 ARG HG3 1 1
11 1832 1 1 3 ARG HH11 H -3.405 -2.364 0.409 1.00 . A A . 3 ARG HH11 1 1
11 1833 1 1 3 ARG HH12 H -3.083 -1.445 1.841 1.00 . A A . 3 ARG HH12 1 1
11 1834 1 1 3 ARG HH21 H -2.166 1.419 0.112 1.00 . A A . 3 ARG HH21 1 1
11 1835 1 1 3 ARG HH22 H -2.380 0.699 1.673 1.00 . A A . 3 ARG HH22 1 1
11 1836 1 1 3 ARG N N 0.906 -0.840 -5.003 1.00 . A A . 3 ARG N 1 1
11 1837 1 1 3 ARG NE N -2.841 -0.571 -1.189 1.00 . A A . 3 ARG NE 1 1
11 1838 1 1 3 ARG NH1 N -3.119 -1.511 0.844 1.00 . A A . 3 ARG NH1 1 1
11 1839 1 1 3 ARG NH2 N -2.417 0.632 0.676 1.00 . A A . 3 ARG NH2 1 1
11 1840 1 1 3 ARG O O -0.276 2.568 -4.902 1.00 . A A . 3 ARG O 1 1
11 1841 1 1 4 VAL C C 2.762 3.500 -5.903 1.00 . A A . 4 VAL C 1 1
11 1842 1 1 4 VAL CA C 2.330 3.095 -4.492 1.00 . A A . 4 VAL CA 1 1
11 1843 1 1 4 VAL CB C 3.538 2.983 -3.556 1.00 . A A . 4 VAL CB 1 1
11 1844 1 1 4 VAL CG1 C 4.483 1.889 -4.057 1.00 . A A . 4 VAL CG1 1 1
11 1845 1 1 4 VAL CG2 C 4.283 4.319 -3.517 1.00 . A A . 4 VAL CG2 1 1
11 1846 1 1 4 VAL H H 2.258 0.952 -4.324 1.00 . A A . 4 VAL H 1 1
11 1847 1 1 4 VAL HA H 1.632 3.817 -4.097 1.00 . A A . 4 VAL HA 1 1
11 1848 1 1 4 VAL HB H 3.197 2.732 -2.562 1.00 . A A . 4 VAL HB 1 1
11 1849 1 1 4 VAL HG11 H 4.328 1.737 -5.115 1.00 . A A . 4 VAL HG11 1 1
11 1850 1 1 4 VAL HG12 H 4.280 0.970 -3.528 1.00 . A A . 4 VAL HG12 1 1
11 1851 1 1 4 VAL HG13 H 5.503 2.189 -3.881 1.00 . A A . 4 VAL HG13 1 1
11 1852 1 1 4 VAL HG21 H 3.583 5.118 -3.320 1.00 . A A . 4 VAL HG21 1 1
11 1853 1 1 4 VAL HG22 H 4.766 4.490 -4.467 1.00 . A A . 4 VAL HG22 1 1
11 1854 1 1 4 VAL HG23 H 5.028 4.294 -2.734 1.00 . A A . 4 VAL HG23 1 1
11 1855 1 1 4 VAL N N 1.714 1.739 -4.496 1.00 . A A . 4 VAL N 1 1
11 1856 1 1 4 VAL O O 2.819 2.691 -6.810 1.00 . A A . 4 VAL O 1 1
11 1857 1 1 5 VAL C C 4.662 6.188 -7.294 1.00 . A A . 5 VAL C 1 1
11 1858 1 1 5 VAL CA C 3.468 5.245 -7.431 1.00 . A A . 5 VAL CA 1 1
11 1859 1 1 5 VAL CB C 2.239 5.978 -7.978 1.00 . A A . 5 VAL CB 1 1
11 1860 1 1 5 VAL CG1 C 2.565 6.594 -9.339 1.00 . A A . 5 VAL CG1 1 1
11 1861 1 1 5 VAL CG2 C 1.086 4.984 -8.138 1.00 . A A . 5 VAL CG2 1 1
11 1862 1 1 5 VAL H H 2.991 5.389 -5.345 1.00 . A A . 5 VAL H 1 1
11 1863 1 1 5 VAL HA H 3.717 4.426 -8.066 1.00 . A A . 5 VAL HA 1 1
11 1864 1 1 5 VAL HB H 1.948 6.759 -7.291 1.00 . A A . 5 VAL HB 1 1
11 1865 1 1 5 VAL HG11 H 3.051 5.856 -9.960 1.00 . A A . 5 VAL HG11 1 1
11 1866 1 1 5 VAL HG12 H 3.222 7.441 -9.203 1.00 . A A . 5 VAL HG12 1 1
11 1867 1 1 5 VAL HG13 H 1.653 6.919 -9.815 1.00 . A A . 5 VAL HG13 1 1
11 1868 1 1 5 VAL HG21 H 0.616 4.822 -7.179 1.00 . A A . 5 VAL HG21 1 1
11 1869 1 1 5 VAL HG22 H 1.470 4.046 -8.511 1.00 . A A . 5 VAL HG22 1 1
11 1870 1 1 5 VAL HG23 H 0.362 5.380 -8.833 1.00 . A A . 5 VAL HG23 1 1
11 1871 1 1 5 VAL N N 3.051 4.759 -6.090 1.00 . A A . 5 VAL N 1 1
11 1872 1 1 5 VAL O O 5.795 5.830 -7.563 1.00 . A A . 5 VAL O 1 1
11 1873 1 1 6 ARG C C 6.341 8.012 -5.463 1.00 . A A . 6 ARG C 1 1
11 1874 1 1 6 ARG CA C 5.536 8.355 -6.703 1.00 . A A . 6 ARG CA 1 1
11 1875 1 1 6 ARG CB C 4.874 9.719 -6.583 1.00 . A A . 6 ARG CB 1 1
11 1876 1 1 6 ARG CD C 4.745 11.825 -7.916 1.00 . A A . 6 ARG CD 1 1
11 1877 1 1 6 ARG CG C 4.712 10.302 -7.986 1.00 . A A . 6 ARG CG 1 1
11 1878 1 1 6 ARG CZ C 2.994 13.478 -7.727 1.00 . A A . 6 ARG CZ 1 1
11 1879 1 1 6 ARG H H 3.505 7.640 -6.638 1.00 . A A . 6 ARG H 1 1
11 1880 1 1 6 ARG HA H 6.170 8.334 -7.569 1.00 . A A . 6 ARG HA 1 1
11 1881 1 1 6 ARG HB2 H 3.904 9.610 -6.117 1.00 . A A . 6 ARG HB2 1 1
11 1882 1 1 6 ARG HB3 H 5.494 10.373 -5.989 1.00 . A A . 6 ARG HB3 1 1
11 1883 1 1 6 ARG HD2 H 5.379 12.150 -7.103 1.00 . A A . 6 ARG HD2 1 1
11 1884 1 1 6 ARG HD3 H 5.089 12.237 -8.852 1.00 . A A . 6 ARG HD3 1 1
11 1885 1 1 6 ARG HE H 2.658 11.541 -7.471 1.00 . A A . 6 ARG HE 1 1
11 1886 1 1 6 ARG HG2 H 5.521 9.951 -8.611 1.00 . A A . 6 ARG HG2 1 1
11 1887 1 1 6 ARG HG3 H 3.770 9.980 -8.402 1.00 . A A . 6 ARG HG3 1 1
11 1888 1 1 6 ARG HH11 H 2.712 13.473 -9.708 1.00 . A A . 6 ARG HH11 1 1
11 1889 1 1 6 ARG HH12 H 2.427 14.985 -8.915 1.00 . A A . 6 ARG HH12 1 1
11 1890 1 1 6 ARG HH21 H 3.197 13.774 -5.759 1.00 . A A . 6 ARG HH21 1 1
11 1891 1 1 6 ARG HH22 H 2.701 15.157 -6.678 1.00 . A A . 6 ARG HH22 1 1
11 1892 1 1 6 ARG N N 4.419 7.385 -6.858 1.00 . A A . 6 ARG N 1 1
11 1893 1 1 6 ARG NE N 3.333 12.223 -7.672 1.00 . A A . 6 ARG NE 1 1
11 1894 1 1 6 ARG NH1 N 2.687 14.021 -8.872 1.00 . A A . 6 ARG NH1 1 1
11 1895 1 1 6 ARG NH2 N 2.961 14.192 -6.636 1.00 . A A . 6 ARG NH2 1 1
11 1896 1 1 6 ARG O O 5.813 7.827 -4.383 1.00 . A A . 6 ARG O 1 1
11 1897 1 1 7 GLY C C 8.820 5.973 -4.744 1.00 . A A . 7 GLY C 1 1
11 1898 1 1 7 GLY CA C 8.508 7.453 -4.528 1.00 . A A . 7 GLY CA 1 1
11 1899 1 1 7 GLY H H 7.996 7.972 -6.544 1.00 . A A . 7 GLY H 1 1
11 1900 1 1 7 GLY HA2 H 9.419 8.036 -4.549 1.00 . A A . 7 GLY HA2 1 1
11 1901 1 1 7 GLY HA3 H 8.002 7.583 -3.585 1.00 . A A . 7 GLY HA3 1 1
11 1902 1 1 7 GLY N N 7.620 7.861 -5.646 1.00 . A A . 7 GLY N 1 1
11 1903 1 1 7 GLY O O 9.924 5.512 -4.527 1.00 . A A . 7 GLY O 1 1
11 1904 1 1 8 ASP C C 7.005 3.388 -6.556 1.00 . A A . 8 ASP C 1 1
11 1905 1 1 8 ASP CA C 8.027 3.797 -5.494 1.00 . A A . 8 ASP CA 1 1
11 1906 1 1 8 ASP CB C 7.768 3.074 -4.170 1.00 . A A . 8 ASP CB 1 1
11 1907 1 1 8 ASP CG C 9.073 2.984 -3.375 1.00 . A A . 8 ASP CG 1 1
11 1908 1 1 8 ASP H H 6.973 5.652 -5.408 1.00 . A A . 8 ASP H 1 1
11 1909 1 1 8 ASP HA H 9.032 3.605 -5.837 1.00 . A A . 8 ASP HA 1 1
11 1910 1 1 8 ASP HB2 H 7.032 3.619 -3.596 1.00 . A A . 8 ASP HB2 1 1
11 1911 1 1 8 ASP HB3 H 7.403 2.077 -4.369 1.00 . A A . 8 ASP HB3 1 1
11 1912 1 1 8 ASP N N 7.840 5.239 -5.209 1.00 . A A . 8 ASP N 1 1
11 1913 1 1 8 ASP O O 5.903 2.983 -6.240 1.00 . A A . 8 ASP O 1 1
11 1914 1 1 8 ASP OD1 O 9.938 2.226 -3.783 1.00 . A A . 8 ASP OD1 1 1
11 1915 1 1 8 ASP OD2 O 9.185 3.673 -2.375 1.00 . A A . 8 ASP OD2 1 1
11 1916 1 1 9 TYR C C 6.300 1.634 -9.028 1.00 . A A . 9 TYR C 1 1
11 1917 1 1 9 TYR CA C 6.367 3.151 -8.881 1.00 . A A . 9 TYR CA 1 1
11 1918 1 1 9 TYR CB C 6.915 3.771 -10.170 1.00 . A A . 9 TYR CB 1 1
11 1919 1 1 9 TYR CD1 C 6.039 6.137 -10.200 1.00 . A A . 9 TYR CD1 1 1
11 1920 1 1 9 TYR CD2 C 8.353 5.754 -9.587 1.00 . A A . 9 TYR CD2 1 1
11 1921 1 1 9 TYR CE1 C 6.220 7.513 -10.019 1.00 . A A . 9 TYR CE1 1 1
11 1922 1 1 9 TYR CE2 C 8.532 7.130 -9.407 1.00 . A A . 9 TYR CE2 1 1
11 1923 1 1 9 TYR CG C 7.107 5.256 -9.982 1.00 . A A . 9 TYR CG 1 1
11 1924 1 1 9 TYR CZ C 7.467 8.008 -9.623 1.00 . A A . 9 TYR CZ 1 1
11 1925 1 1 9 TYR H H 8.226 3.860 -8.037 1.00 . A A . 9 TYR H 1 1
11 1926 1 1 9 TYR HA H 5.390 3.562 -8.662 1.00 . A A . 9 TYR HA 1 1
11 1927 1 1 9 TYR HB2 H 7.863 3.310 -10.411 1.00 . A A . 9 TYR HB2 1 1
11 1928 1 1 9 TYR HB3 H 6.215 3.596 -10.974 1.00 . A A . 9 TYR HB3 1 1
11 1929 1 1 9 TYR HD1 H 5.076 5.754 -10.503 1.00 . A A . 9 TYR HD1 1 1
11 1930 1 1 9 TYR HD2 H 9.176 5.074 -9.416 1.00 . A A . 9 TYR HD2 1 1
11 1931 1 1 9 TYR HE1 H 5.399 8.195 -10.186 1.00 . A A . 9 TYR HE1 1 1
11 1932 1 1 9 TYR HE2 H 9.496 7.513 -9.105 1.00 . A A . 9 TYR HE2 1 1
11 1933 1 1 9 TYR HH H 8.273 9.671 -10.110 1.00 . A A . 9 TYR HH 1 1
11 1934 1 1 9 TYR N N 7.346 3.510 -7.807 1.00 . A A . 9 TYR N 1 1
11 1935 1 1 9 TYR O O 6.901 1.049 -9.906 1.00 . A A . 9 TYR O 1 1
11 1936 1 1 9 TYR OH O 7.647 9.368 -9.447 1.00 . A A . 9 TYR OH 1 1
11 1937 1 1 10 LEU C C 3.983 -0.816 -8.631 1.00 . A A . 10 LEU C 1 1
11 1938 1 1 10 LEU CA C 5.417 -0.479 -8.233 1.00 . A A . 10 LEU CA 1 1
11 1939 1 1 10 LEU CB C 5.714 -0.964 -6.809 1.00 . A A . 10 LEU CB 1 1
11 1940 1 1 10 LEU CD1 C 8.008 0.017 -7.244 1.00 . A A . 10 LEU CD1 1 1
11 1941 1 1 10 LEU CD2 C 7.519 -1.123 -5.082 1.00 . A A . 10 LEU CD2 1 1
11 1942 1 1 10 LEU CG C 7.231 -1.130 -6.587 1.00 . A A . 10 LEU CG 1 1
11 1943 1 1 10 LEU H H 5.073 1.501 -7.478 1.00 . A A . 10 LEU H 1 1
11 1944 1 1 10 LEU HA H 6.123 -0.902 -8.933 1.00 . A A . 10 LEU HA 1 1
11 1945 1 1 10 LEU HB2 H 5.326 -0.244 -6.102 1.00 . A A . 10 LEU HB2 1 1
11 1946 1 1 10 LEU HB3 H 5.226 -1.915 -6.650 1.00 . A A . 10 LEU HB3 1 1
11 1947 1 1 10 LEU HD11 H 9.035 -0.005 -6.909 1.00 . A A . 10 LEU HD11 1 1
11 1948 1 1 10 LEU HD12 H 7.560 0.960 -6.969 1.00 . A A . 10 LEU HD12 1 1
11 1949 1 1 10 LEU HD13 H 7.977 -0.097 -8.318 1.00 . A A . 10 LEU HD13 1 1
11 1950 1 1 10 LEU HD21 H 7.060 -1.986 -4.623 1.00 . A A . 10 LEU HD21 1 1
11 1951 1 1 10 LEU HD22 H 7.114 -0.223 -4.644 1.00 . A A . 10 LEU HD22 1 1
11 1952 1 1 10 LEU HD23 H 8.586 -1.152 -4.921 1.00 . A A . 10 LEU HD23 1 1
11 1953 1 1 10 LEU HG H 7.554 -2.070 -7.009 1.00 . A A . 10 LEU HG 1 1
11 1954 1 1 10 LEU N N 5.555 0.999 -8.169 1.00 . A A . 10 LEU N 1 1
11 1955 1 1 10 LEU O O 3.263 -1.469 -7.906 1.00 . A A . 10 LEU O 1 1
11 1956 1 1 11 ASP C C 2.101 -1.969 -10.952 1.00 . A A . 11 ASP C 1 1
11 1957 1 1 11 ASP CA C 2.156 -0.642 -10.201 1.00 . A A . 11 ASP CA 1 1
11 1958 1 1 11 ASP CB C 1.770 0.517 -11.118 1.00 . A A . 11 ASP CB 1 1
11 1959 1 1 11 ASP CG C 0.245 0.621 -11.186 1.00 . A A . 11 ASP CG 1 1
11 1960 1 1 11 ASP H H 4.143 0.177 -10.347 1.00 . A A . 11 ASP H 1 1
11 1961 1 1 11 ASP HA H 1.501 -0.667 -9.345 1.00 . A A . 11 ASP HA 1 1
11 1962 1 1 11 ASP HB2 H 2.176 1.438 -10.725 1.00 . A A . 11 ASP HB2 1 1
11 1963 1 1 11 ASP HB3 H 2.164 0.343 -12.109 1.00 . A A . 11 ASP HB3 1 1
11 1964 1 1 11 ASP N N 3.553 -0.360 -9.776 1.00 . A A . 11 ASP N 1 1
11 1965 1 1 11 ASP O O 3.004 -2.315 -11.690 1.00 . A A . 11 ASP O 1 1
11 1966 1 1 11 ASP OD1 O -0.393 -0.407 -11.339 1.00 . A A . 11 ASP OD1 1 1
11 1967 1 1 11 ASP OD2 O -0.259 1.728 -11.084 1.00 . A A . 11 ASP OD2 1 1
11 1968 1 1 12 CYS C C -0.444 -4.233 -12.022 1.00 . A A . 12 CYS C 1 1
11 1969 1 1 12 CYS CA C 0.954 -4.050 -11.426 1.00 . A A . 12 CYS CA 1 1
11 1970 1 1 12 CYS CB C 1.209 -5.069 -10.313 1.00 . A A . 12 CYS CB 1 1
11 1971 1 1 12 CYS H H 0.355 -2.438 -10.132 1.00 . A A . 12 CYS H 1 1
11 1972 1 1 12 CYS HA H 1.709 -4.143 -12.189 1.00 . A A . 12 CYS HA 1 1
11 1973 1 1 12 CYS HB2 H 0.482 -4.930 -9.526 1.00 . A A . 12 CYS HB2 1 1
11 1974 1 1 12 CYS HB3 H 1.123 -6.069 -10.712 1.00 . A A . 12 CYS HB3 1 1
11 1975 1 1 12 CYS N N 1.060 -2.729 -10.747 1.00 . A A . 12 CYS N 1 1
11 1976 1 1 12 CYS O O -1.090 -5.238 -11.800 1.00 . A A . 12 CYS O 1 1
11 1977 1 1 12 CYS SG S 2.876 -4.827 -9.643 1.00 . A A . 12 CYS SG 1 1
11 1978 1 1 13 NH2 HN1 H -0.422 -2.484 -12.962 1.00 . A A . 13 NH2 HN1 1 1
11 1979 1 1 13 NH2 HN2 H -1.833 -3.403 -13.173 1.00 . A A . 13 NH2 HN2 1 1
11 1980 1 1 13 NH2 N N -0.941 -3.295 -12.781 1.00 . A A . 13 NH2 N 1 1
12 1981 1 1 1 ACE C C -2.177 -1.209 -15.643 1.00 . A A . 1 ACE C 1 1
12 1982 1 1 1 ACE CH3 C -3.368 -1.179 -16.605 1.00 . A A . 1 ACE CH3 1 1
12 1983 1 1 1 ACE H1 H -4.191 -1.730 -16.175 1.00 . A A . 1 ACE H1 1 1
12 1984 1 1 1 ACE H2 H -3.084 -1.630 -17.545 1.00 . A A . 1 ACE H2 1 1
12 1985 1 1 1 ACE H3 H -3.669 -0.155 -16.772 1.00 . A A . 1 ACE H3 1 1
12 1986 1 1 1 ACE O O -1.992 -2.153 -14.900 1.00 . A A . 1 ACE O 1 1
12 1987 1 1 2 CYS C C -0.341 1.018 -13.743 1.00 . A A . 2 CYS C 1 1
12 1988 1 1 2 CYS CA C -0.192 -0.140 -14.735 1.00 . A A . 2 CYS CA 1 1
12 1989 1 1 2 CYS CB C 1.015 0.096 -15.646 1.00 . A A . 2 CYS CB 1 1
12 1990 1 1 2 CYS H H -1.544 0.571 -16.256 1.00 . A A . 2 CYS H 1 1
12 1991 1 1 2 CYS HA H -0.085 -1.077 -14.212 1.00 . A A . 2 CYS HA 1 1
12 1992 1 1 2 CYS HB2 H 0.829 0.952 -16.278 1.00 . A A . 2 CYS HB2 1 1
12 1993 1 1 2 CYS HB3 H 1.892 0.278 -15.042 1.00 . A A . 2 CYS HB3 1 1
12 1994 1 1 2 CYS N N -1.372 -0.180 -15.651 1.00 . A A . 2 CYS N 1 1
12 1995 1 1 2 CYS O O -0.600 2.142 -14.126 1.00 . A A . 2 CYS O 1 1
12 1996 1 1 2 CYS SG S 1.293 -1.364 -16.682 1.00 . A A . 2 CYS SG 1 1
12 1997 1 1 3 ARG C C 1.094 2.438 -11.193 1.00 . A A . 3 ARG C 1 1
12 1998 1 1 3 ARG CA C -0.288 1.851 -11.470 1.00 . A A . 3 ARG CA 1 1
12 1999 1 1 3 ARG CB C -0.853 1.192 -10.211 1.00 . A A . 3 ARG CB 1 1
12 2000 1 1 3 ARG CD C -3.128 0.407 -10.877 1.00 . A A . 3 ARG CD 1 1
12 2001 1 1 3 ARG CG C -2.352 1.479 -10.109 1.00 . A A . 3 ARG CG 1 1
12 2002 1 1 3 ARG CZ C -5.432 -0.251 -10.520 1.00 . A A . 3 ARG CZ 1 1
12 2003 1 1 3 ARG H H 0.050 -0.155 -12.187 1.00 . A A . 3 ARG H 1 1
12 2004 1 1 3 ARG HA H -0.960 2.617 -11.825 1.00 . A A . 3 ARG HA 1 1
12 2005 1 1 3 ARG HB2 H -0.692 0.124 -10.260 1.00 . A A . 3 ARG HB2 1 1
12 2006 1 1 3 ARG HB3 H -0.353 1.592 -9.341 1.00 . A A . 3 ARG HB3 1 1
12 2007 1 1 3 ARG HD2 H -2.907 0.469 -11.934 1.00 . A A . 3 ARG HD2 1 1
12 2008 1 1 3 ARG HD3 H -2.891 -0.574 -10.498 1.00 . A A . 3 ARG HD3 1 1
12 2009 1 1 3 ARG HE H -4.855 1.649 -10.539 1.00 . A A . 3 ARG HE 1 1
12 2010 1 1 3 ARG HG2 H -2.652 1.467 -9.071 1.00 . A A . 3 ARG HG2 1 1
12 2011 1 1 3 ARG HG3 H -2.564 2.448 -10.534 1.00 . A A . 3 ARG HG3 1 1
12 2012 1 1 3 ARG HH11 H -4.652 -1.324 -12.020 1.00 . A A . 3 ARG HH11 1 1
12 2013 1 1 3 ARG HH12 H -6.033 -2.019 -11.242 1.00 . A A . 3 ARG HH12 1 1
12 2014 1 1 3 ARG HH21 H -6.414 0.596 -8.995 1.00 . A A . 3 ARG HH21 1 1
12 2015 1 1 3 ARG HH22 H -7.032 -0.931 -9.528 1.00 . A A . 3 ARG HH22 1 1
12 2016 1 1 3 ARG N N -0.166 0.756 -12.476 1.00 . A A . 3 ARG N 1 1
12 2017 1 1 3 ARG NE N -4.563 0.717 -10.626 1.00 . A A . 3 ARG NE 1 1
12 2018 1 1 3 ARG NH1 N -5.366 -1.278 -11.323 1.00 . A A . 3 ARG NH1 1 1
12 2019 1 1 3 ARG NH2 N -6.366 -0.191 -9.610 1.00 . A A . 3 ARG NH2 1 1
12 2020 1 1 3 ARG O O 2.102 1.823 -11.479 1.00 . A A . 3 ARG O 1 1
12 2021 1 1 4 VAL C C 2.417 5.123 -9.115 1.00 . A A . 4 VAL C 1 1
12 2022 1 1 4 VAL CA C 2.477 4.235 -10.363 1.00 . A A . 4 VAL CA 1 1
12 2023 1 1 4 VAL CB C 2.801 5.077 -11.605 1.00 . A A . 4 VAL CB 1 1
12 2024 1 1 4 VAL CG1 C 1.733 6.155 -11.796 1.00 . A A . 4 VAL CG1 1 1
12 2025 1 1 4 VAL CG2 C 4.171 5.743 -11.429 1.00 . A A . 4 VAL CG2 1 1
12 2026 1 1 4 VAL H H 0.327 4.101 -10.428 1.00 . A A . 4 VAL H 1 1
12 2027 1 1 4 VAL HA H 3.223 3.468 -10.242 1.00 . A A . 4 VAL HA 1 1
12 2028 1 1 4 VAL HB H 2.822 4.436 -12.477 1.00 . A A . 4 VAL HB 1 1
12 2029 1 1 4 VAL HG11 H 1.618 6.368 -12.848 1.00 . A A . 4 VAL HG11 1 1
12 2030 1 1 4 VAL HG12 H 2.033 7.055 -11.278 1.00 . A A . 4 VAL HG12 1 1
12 2031 1 1 4 VAL HG13 H 0.793 5.807 -11.395 1.00 . A A . 4 VAL HG13 1 1
12 2032 1 1 4 VAL HG21 H 4.325 5.982 -10.387 1.00 . A A . 4 VAL HG21 1 1
12 2033 1 1 4 VAL HG22 H 4.208 6.650 -12.015 1.00 . A A . 4 VAL HG22 1 1
12 2034 1 1 4 VAL HG23 H 4.946 5.068 -11.762 1.00 . A A . 4 VAL HG23 1 1
12 2035 1 1 4 VAL N N 1.151 3.620 -10.646 1.00 . A A . 4 VAL N 1 1
12 2036 1 1 4 VAL O O 1.858 6.201 -9.135 1.00 . A A . 4 VAL O 1 1
12 2037 1 1 5 VAL C C 4.336 6.360 -6.861 1.00 . A A . 5 VAL C 1 1
12 2038 1 1 5 VAL CA C 3.051 5.536 -6.822 1.00 . A A . 5 VAL CA 1 1
12 2039 1 1 5 VAL CB C 3.058 4.581 -5.620 1.00 . A A . 5 VAL CB 1 1
12 2040 1 1 5 VAL CG1 C 1.631 4.142 -5.295 1.00 . A A . 5 VAL CG1 1 1
12 2041 1 1 5 VAL CG2 C 3.912 3.339 -5.897 1.00 . A A . 5 VAL CG2 1 1
12 2042 1 1 5 VAL H H 3.503 3.843 -8.053 1.00 . A A . 5 VAL H 1 1
12 2043 1 1 5 VAL HA H 2.185 6.181 -6.787 1.00 . A A . 5 VAL HA 1 1
12 2044 1 1 5 VAL HB H 3.466 5.105 -4.779 1.00 . A A . 5 VAL HB 1 1
12 2045 1 1 5 VAL HG11 H 1.108 3.908 -6.210 1.00 . A A . 5 VAL HG11 1 1
12 2046 1 1 5 VAL HG12 H 1.118 4.939 -4.779 1.00 . A A . 5 VAL HG12 1 1
12 2047 1 1 5 VAL HG13 H 1.663 3.265 -4.664 1.00 . A A . 5 VAL HG13 1 1
12 2048 1 1 5 VAL HG21 H 3.326 2.611 -6.438 1.00 . A A . 5 VAL HG21 1 1
12 2049 1 1 5 VAL HG22 H 4.239 2.912 -4.961 1.00 . A A . 5 VAL HG22 1 1
12 2050 1 1 5 VAL HG23 H 4.771 3.617 -6.484 1.00 . A A . 5 VAL HG23 1 1
12 2051 1 1 5 VAL N N 3.029 4.695 -8.043 1.00 . A A . 5 VAL N 1 1
12 2052 1 1 5 VAL O O 5.410 5.844 -7.128 1.00 . A A . 5 VAL O 1 1
12 2053 1 1 6 ARG C C 6.377 8.231 -5.502 1.00 . A A . 6 ARG C 1 1
12 2054 1 1 6 ARG CA C 5.479 8.475 -6.708 1.00 . A A . 6 ARG CA 1 1
12 2055 1 1 6 ARG CB C 5.000 9.931 -6.754 1.00 . A A . 6 ARG CB 1 1
12 2056 1 1 6 ARG CD C 4.220 11.645 -5.119 1.00 . A A . 6 ARG CD 1 1
12 2057 1 1 6 ARG CG C 4.019 10.211 -5.614 1.00 . A A . 6 ARG CG 1 1
12 2058 1 1 6 ARG CZ C 4.848 11.681 -2.780 1.00 . A A . 6 ARG CZ 1 1
12 2059 1 1 6 ARG H H 3.379 8.043 -6.419 1.00 . A A . 6 ARG H 1 1
12 2060 1 1 6 ARG HA H 6.013 8.245 -7.619 1.00 . A A . 6 ARG HA 1 1
12 2061 1 1 6 ARG HB2 H 5.853 10.586 -6.659 1.00 . A A . 6 ARG HB2 1 1
12 2062 1 1 6 ARG HB3 H 4.511 10.116 -7.699 1.00 . A A . 6 ARG HB3 1 1
12 2063 1 1 6 ARG HD2 H 4.599 12.266 -5.919 1.00 . A A . 6 ARG HD2 1 1
12 2064 1 1 6 ARG HD3 H 3.295 12.047 -4.737 1.00 . A A . 6 ARG HD3 1 1
12 2065 1 1 6 ARG HE H 6.166 11.372 -4.234 1.00 . A A . 6 ARG HE 1 1
12 2066 1 1 6 ARG HG2 H 3.007 10.093 -5.975 1.00 . A A . 6 ARG HG2 1 1
12 2067 1 1 6 ARG HG3 H 4.194 9.523 -4.804 1.00 . A A . 6 ARG HG3 1 1
12 2068 1 1 6 ARG HH11 H 3.379 10.328 -2.914 1.00 . A A . 6 ARG HH11 1 1
12 2069 1 1 6 ARG HH12 H 3.564 11.082 -1.366 1.00 . A A . 6 ARG HH12 1 1
12 2070 1 1 6 ARG HH21 H 6.231 13.066 -2.354 1.00 . A A . 6 ARG HH21 1 1
12 2071 1 1 6 ARG HH22 H 5.177 12.632 -1.048 1.00 . A A . 6 ARG HH22 1 1
12 2072 1 1 6 ARG N N 4.247 7.637 -6.620 1.00 . A A . 6 ARG N 1 1
12 2073 1 1 6 ARG NE N 5.224 11.542 -4.022 1.00 . A A . 6 ARG NE 1 1
12 2074 1 1 6 ARG NH1 N 3.853 10.975 -2.318 1.00 . A A . 6 ARG NH1 1 1
12 2075 1 1 6 ARG NH2 N 5.468 12.525 -2.000 1.00 . A A . 6 ARG NH2 1 1
12 2076 1 1 6 ARG O O 6.021 8.475 -4.367 1.00 . A A . 6 ARG O 1 1
12 2077 1 1 7 GLY C C 8.902 5.924 -4.832 1.00 . A A . 7 GLY C 1 1
12 2078 1 1 7 GLY CA C 8.509 7.394 -4.685 1.00 . A A . 7 GLY CA 1 1
12 2079 1 1 7 GLY H H 7.782 7.514 -6.697 1.00 . A A . 7 GLY H 1 1
12 2080 1 1 7 GLY HA2 H 9.386 8.021 -4.782 1.00 . A A . 7 GLY HA2 1 1
12 2081 1 1 7 GLY HA3 H 8.048 7.549 -3.725 1.00 . A A . 7 GLY HA3 1 1
12 2082 1 1 7 GLY N N 7.545 7.714 -5.767 1.00 . A A . 7 GLY N 1 1
12 2083 1 1 7 GLY O O 10.051 5.554 -4.690 1.00 . A A . 7 GLY O 1 1
12 2084 1 1 8 ASP C C 7.210 3.037 -6.303 1.00 . A A . 8 ASP C 1 1
12 2085 1 1 8 ASP CA C 8.226 3.634 -5.326 1.00 . A A . 8 ASP CA 1 1
12 2086 1 1 8 ASP CB C 8.077 3.015 -3.933 1.00 . A A . 8 ASP CB 1 1
12 2087 1 1 8 ASP CG C 9.220 3.494 -3.035 1.00 . A A . 8 ASP CG 1 1
12 2088 1 1 8 ASP H H 7.023 5.427 -5.273 1.00 . A A . 8 ASP H 1 1
12 2089 1 1 8 ASP HA H 9.229 3.491 -5.690 1.00 . A A . 8 ASP HA 1 1
12 2090 1 1 8 ASP HB2 H 7.132 3.315 -3.504 1.00 . A A . 8 ASP HB2 1 1
12 2091 1 1 8 ASP HB3 H 8.113 1.938 -4.010 1.00 . A A . 8 ASP HB3 1 1
12 2092 1 1 8 ASP N N 7.940 5.089 -5.140 1.00 . A A . 8 ASP N 1 1
12 2093 1 1 8 ASP O O 6.398 2.208 -5.936 1.00 . A A . 8 ASP O 1 1
12 2094 1 1 8 ASP OD1 O 10.326 3.014 -3.215 1.00 . A A . 8 ASP OD1 1 1
12 2095 1 1 8 ASP OD2 O 8.970 4.334 -2.188 1.00 . A A . 8 ASP OD2 1 1
12 2096 1 1 9 TYR C C 6.767 1.762 -9.348 1.00 . A A . 9 TYR C 1 1
12 2097 1 1 9 TYR CA C 6.222 2.936 -8.523 1.00 . A A . 9 TYR CA 1 1
12 2098 1 1 9 TYR CB C 5.845 4.105 -9.455 1.00 . A A . 9 TYR CB 1 1
12 2099 1 1 9 TYR CD1 C 8.234 4.538 -10.185 1.00 . A A . 9 TYR CD1 1 1
12 2100 1 1 9 TYR CD2 C 6.865 6.410 -9.483 1.00 . A A . 9 TYR CD2 1 1
12 2101 1 1 9 TYR CE1 C 9.302 5.413 -10.426 1.00 . A A . 9 TYR CE1 1 1
12 2102 1 1 9 TYR CE2 C 7.931 7.284 -9.726 1.00 . A A . 9 TYR CE2 1 1
12 2103 1 1 9 TYR CG C 7.015 5.036 -9.712 1.00 . A A . 9 TYR CG 1 1
12 2104 1 1 9 TYR CZ C 9.149 6.786 -10.195 1.00 . A A . 9 TYR CZ 1 1
12 2105 1 1 9 TYR H H 7.875 4.149 -7.808 1.00 . A A . 9 TYR H 1 1
12 2106 1 1 9 TYR HA H 5.331 2.618 -7.993 1.00 . A A . 9 TYR HA 1 1
12 2107 1 1 9 TYR HB2 H 5.503 3.705 -10.395 1.00 . A A . 9 TYR HB2 1 1
12 2108 1 1 9 TYR HB3 H 5.042 4.666 -9.001 1.00 . A A . 9 TYR HB3 1 1
12 2109 1 1 9 TYR HD1 H 8.353 3.482 -10.367 1.00 . A A . 9 TYR HD1 1 1
12 2110 1 1 9 TYR HD2 H 5.925 6.795 -9.120 1.00 . A A . 9 TYR HD2 1 1
12 2111 1 1 9 TYR HE1 H 10.244 5.029 -10.790 1.00 . A A . 9 TYR HE1 1 1
12 2112 1 1 9 TYR HE2 H 7.813 8.344 -9.549 1.00 . A A . 9 TYR HE2 1 1
12 2113 1 1 9 TYR HH H 9.917 8.290 -11.092 1.00 . A A . 9 TYR HH 1 1
12 2114 1 1 9 TYR N N 7.226 3.468 -7.538 1.00 . A A . 9 TYR N 1 1
12 2115 1 1 9 TYR O O 7.956 1.609 -9.548 1.00 . A A . 9 TYR O 1 1
12 2116 1 1 9 TYR OH O 10.201 7.648 -10.435 1.00 . A A . 9 TYR OH 1 1
12 2117 1 1 10 LEU C C 5.213 -0.368 -11.798 1.00 . A A . 10 LEU C 1 1
12 2118 1 1 10 LEU CA C 6.251 -0.232 -10.676 1.00 . A A . 10 LEU CA 1 1
12 2119 1 1 10 LEU CB C 6.191 -1.455 -9.750 1.00 . A A . 10 LEU CB 1 1
12 2120 1 1 10 LEU CD1 C 6.829 -2.390 -7.527 1.00 . A A . 10 LEU CD1 1 1
12 2121 1 1 10 LEU CD2 C 8.478 -1.037 -8.823 1.00 . A A . 10 LEU CD2 1 1
12 2122 1 1 10 LEU CG C 6.997 -1.200 -8.475 1.00 . A A . 10 LEU CG 1 1
12 2123 1 1 10 LEU H H 4.925 1.107 -9.652 1.00 . A A . 10 LEU H 1 1
12 2124 1 1 10 LEU HA H 7.243 -0.110 -11.082 1.00 . A A . 10 LEU HA 1 1
12 2125 1 1 10 LEU HB2 H 5.161 -1.653 -9.489 1.00 . A A . 10 LEU HB2 1 1
12 2126 1 1 10 LEU HB3 H 6.600 -2.312 -10.263 1.00 . A A . 10 LEU HB3 1 1
12 2127 1 1 10 LEU HD11 H 5.948 -2.246 -6.919 1.00 . A A . 10 LEU HD11 1 1
12 2128 1 1 10 LEU HD12 H 7.697 -2.467 -6.889 1.00 . A A . 10 LEU HD12 1 1
12 2129 1 1 10 LEU HD13 H 6.724 -3.298 -8.103 1.00 . A A . 10 LEU HD13 1 1
12 2130 1 1 10 LEU HD21 H 8.573 -0.578 -9.795 1.00 . A A . 10 LEU HD21 1 1
12 2131 1 1 10 LEU HD22 H 8.954 -2.007 -8.835 1.00 . A A . 10 LEU HD22 1 1
12 2132 1 1 10 LEU HD23 H 8.954 -0.413 -8.082 1.00 . A A . 10 LEU HD23 1 1
12 2133 1 1 10 LEU HG H 6.635 -0.304 -7.992 1.00 . A A . 10 LEU HG 1 1
12 2134 1 1 10 LEU N N 5.871 0.941 -9.834 1.00 . A A . 10 LEU N 1 1
12 2135 1 1 10 LEU O O 4.460 -1.319 -11.847 1.00 . A A . 10 LEU O 1 1
12 2136 1 1 11 ASP C C 4.693 -0.099 -15.039 1.00 . A A . 11 ASP C 1 1
12 2137 1 1 11 ASP CA C 4.124 0.547 -13.772 1.00 . A A . 11 ASP CA 1 1
12 2138 1 1 11 ASP CB C 3.765 2.014 -14.033 1.00 . A A . 11 ASP CB 1 1
12 2139 1 1 11 ASP CG C 5.009 2.788 -14.484 1.00 . A A . 11 ASP CG 1 1
12 2140 1 1 11 ASP H H 5.745 1.369 -12.604 1.00 . A A . 11 ASP H 1 1
12 2141 1 1 11 ASP HA H 3.245 0.013 -13.441 1.00 . A A . 11 ASP HA 1 1
12 2142 1 1 11 ASP HB2 H 3.010 2.067 -14.804 1.00 . A A . 11 ASP HB2 1 1
12 2143 1 1 11 ASP HB3 H 3.382 2.455 -13.126 1.00 . A A . 11 ASP HB3 1 1
12 2144 1 1 11 ASP N N 5.144 0.597 -12.678 1.00 . A A . 11 ASP N 1 1
12 2145 1 1 11 ASP O O 5.034 0.577 -15.988 1.00 . A A . 11 ASP O 1 1
12 2146 1 1 11 ASP OD1 O 6.094 2.233 -14.406 1.00 . A A . 11 ASP OD1 1 1
12 2147 1 1 11 ASP OD2 O 4.855 3.924 -14.901 1.00 . A A . 11 ASP OD2 1 1
12 2148 1 1 12 CYS C C 6.250 -1.287 -17.090 1.00 . A A . 12 CYS C 1 1
12 2149 1 1 12 CYS CA C 5.293 -2.151 -16.259 1.00 . A A . 12 CYS CA 1 1
12 2150 1 1 12 CYS CB C 4.055 -2.527 -17.083 1.00 . A A . 12 CYS CB 1 1
12 2151 1 1 12 CYS H H 4.469 -1.917 -14.278 1.00 . A A . 12 CYS H 1 1
12 2152 1 1 12 CYS HA H 5.793 -3.049 -15.940 1.00 . A A . 12 CYS HA 1 1
12 2153 1 1 12 CYS HB2 H 4.369 -3.020 -17.990 1.00 . A A . 12 CYS HB2 1 1
12 2154 1 1 12 CYS HB3 H 3.432 -3.197 -16.509 1.00 . A A . 12 CYS HB3 1 1
12 2155 1 1 12 CYS N N 4.771 -1.410 -15.059 1.00 . A A . 12 CYS N 1 1
12 2156 1 1 12 CYS O O 6.130 -1.209 -18.297 1.00 . A A . 12 CYS O 1 1
12 2157 1 1 12 CYS SG S 3.107 -1.043 -17.511 1.00 . A A . 12 CYS SG 1 1
12 2158 1 1 13 NH2 HN1 H 7.299 -0.690 -15.515 1.00 . A A . 13 NH2 HN1 1 1
12 2159 1 1 13 NH2 HN2 H 7.814 -0.068 -17.008 1.00 . A A . 13 NH2 HN2 1 1
12 2160 1 1 13 NH2 N N 7.200 -0.629 -16.487 1.00 . A A . 13 NH2 N 1 1
13 2161 1 1 1 ACE C C -4.134 -2.657 -12.392 1.00 . A A . 1 ACE C 1 1
13 2162 1 1 1 ACE CH3 C -4.932 -2.797 -13.688 1.00 . A A . 1 ACE CH3 1 1
13 2163 1 1 1 ACE H1 H -4.252 -2.876 -14.524 1.00 . A A . 1 ACE H1 1 1
13 2164 1 1 1 ACE H2 H -5.562 -1.930 -13.818 1.00 . A A . 1 ACE H2 1 1
13 2165 1 1 1 ACE H3 H -5.546 -3.685 -13.639 1.00 . A A . 1 ACE H3 1 1
13 2166 1 1 1 ACE O O -4.659 -2.821 -11.308 1.00 . A A . 1 ACE O 1 1
13 2167 1 1 2 CYS C C -2.115 -0.748 -10.765 1.00 . A A . 2 CYS C 1 1
13 2168 1 1 2 CYS CA C -2.033 -2.195 -11.268 1.00 . A A . 2 CYS CA 1 1
13 2169 1 1 2 CYS CB C -0.611 -2.541 -11.714 1.00 . A A . 2 CYS CB 1 1
13 2170 1 1 2 CYS H H -2.466 -2.224 -13.380 1.00 . A A . 2 CYS H 1 1
13 2171 1 1 2 CYS HA H -2.359 -2.878 -10.503 1.00 . A A . 2 CYS HA 1 1
13 2172 1 1 2 CYS HB2 H -0.531 -2.426 -12.784 1.00 . A A . 2 CYS HB2 1 1
13 2173 1 1 2 CYS HB3 H 0.091 -1.882 -11.227 1.00 . A A . 2 CYS HB3 1 1
13 2174 1 1 2 CYS N N -2.868 -2.351 -12.495 1.00 . A A . 2 CYS N 1 1
13 2175 1 1 2 CYS O O -3.021 -0.018 -11.117 1.00 . A A . 2 CYS O 1 1
13 2176 1 1 2 CYS SG S -0.242 -4.254 -11.261 1.00 . A A . 2 CYS SG 1 1
13 2177 1 1 3 ARG C C 0.174 1.662 -9.320 1.00 . A A . 3 ARG C 1 1
13 2178 1 1 3 ARG CA C -1.238 1.075 -9.433 1.00 . A A . 3 ARG CA 1 1
13 2179 1 1 3 ARG CB C -1.900 0.974 -8.055 1.00 . A A . 3 ARG CB 1 1
13 2180 1 1 3 ARG CD C -3.477 2.839 -8.644 1.00 . A A . 3 ARG CD 1 1
13 2181 1 1 3 ARG CG C -3.374 1.389 -8.156 1.00 . A A . 3 ARG CG 1 1
13 2182 1 1 3 ARG CZ C -4.026 4.919 -7.531 1.00 . A A . 3 ARG CZ 1 1
13 2183 1 1 3 ARG H H -0.462 -0.924 -9.667 1.00 . A A . 3 ARG H 1 1
13 2184 1 1 3 ARG HA H -1.841 1.684 -10.086 1.00 . A A . 3 ARG HA 1 1
13 2185 1 1 3 ARG HB2 H -1.839 -0.045 -7.701 1.00 . A A . 3 ARG HB2 1 1
13 2186 1 1 3 ARG HB3 H -1.393 1.626 -7.361 1.00 . A A . 3 ARG HB3 1 1
13 2187 1 1 3 ARG HD2 H -2.549 3.148 -9.103 1.00 . A A . 3 ARG HD2 1 1
13 2188 1 1 3 ARG HD3 H -4.295 2.944 -9.340 1.00 . A A . 3 ARG HD3 1 1
13 2189 1 1 3 ARG HE H -3.708 3.229 -6.535 1.00 . A A . 3 ARG HE 1 1
13 2190 1 1 3 ARG HG2 H -3.881 0.738 -8.856 1.00 . A A . 3 ARG HG2 1 1
13 2191 1 1 3 ARG HG3 H -3.840 1.303 -7.186 1.00 . A A . 3 ARG HG3 1 1
13 2192 1 1 3 ARG HH11 H -2.143 5.460 -7.942 1.00 . A A . 3 ARG HH11 1 1
13 2193 1 1 3 ARG HH12 H -3.299 6.749 -7.898 1.00 . A A . 3 ARG HH12 1 1
13 2194 1 1 3 ARG HH21 H -5.977 4.677 -7.149 1.00 . A A . 3 ARG HH21 1 1
13 2195 1 1 3 ARG HH22 H -5.468 6.306 -7.450 1.00 . A A . 3 ARG HH22 1 1
13 2196 1 1 3 ARG N N -1.188 -0.326 -9.945 1.00 . A A . 3 ARG N 1 1
13 2197 1 1 3 ARG NE N -3.745 3.649 -7.421 1.00 . A A . 3 ARG NE 1 1
13 2198 1 1 3 ARG NH1 N -3.082 5.776 -7.812 1.00 . A A . 3 ARG NH1 1 1
13 2199 1 1 3 ARG NH2 N -5.253 5.333 -7.363 1.00 . A A . 3 ARG NH2 1 1
13 2200 1 1 3 ARG O O 1.088 1.023 -8.834 1.00 . A A . 3 ARG O 1 1
13 2201 1 1 4 VAL C C 1.834 4.385 -8.455 1.00 . A A . 4 VAL C 1 1
13 2202 1 1 4 VAL CA C 1.706 3.511 -9.715 1.00 . A A . 4 VAL CA 1 1
13 2203 1 1 4 VAL CB C 1.796 4.367 -10.986 1.00 . A A . 4 VAL CB 1 1
13 2204 1 1 4 VAL CG1 C 0.658 5.394 -11.009 1.00 . A A . 4 VAL CG1 1 1
13 2205 1 1 4 VAL CG2 C 3.139 5.102 -11.019 1.00 . A A . 4 VAL CG2 1 1
13 2206 1 1 4 VAL H H -0.398 3.357 -10.172 1.00 . A A . 4 VAL H 1 1
13 2207 1 1 4 VAL HA H 2.474 2.758 -9.725 1.00 . A A . 4 VAL HA 1 1
13 2208 1 1 4 VAL HB H 1.716 3.726 -11.853 1.00 . A A . 4 VAL HB 1 1
13 2209 1 1 4 VAL HG11 H 0.060 5.247 -11.899 1.00 . A A . 4 VAL HG11 1 1
13 2210 1 1 4 VAL HG12 H 1.069 6.392 -11.014 1.00 . A A . 4 VAL HG12 1 1
13 2211 1 1 4 VAL HG13 H 0.037 5.267 -10.135 1.00 . A A . 4 VAL HG13 1 1
13 2212 1 1 4 VAL HG21 H 3.940 4.397 -10.855 1.00 . A A . 4 VAL HG21 1 1
13 2213 1 1 4 VAL HG22 H 3.157 5.854 -10.244 1.00 . A A . 4 VAL HG22 1 1
13 2214 1 1 4 VAL HG23 H 3.266 5.574 -11.982 1.00 . A A . 4 VAL HG23 1 1
13 2215 1 1 4 VAL N N 0.356 2.871 -9.779 1.00 . A A . 4 VAL N 1 1
13 2216 1 1 4 VAL O O 0.873 4.969 -7.996 1.00 . A A . 4 VAL O 1 1
13 2217 1 1 5 VAL C C 4.405 6.280 -6.882 1.00 . A A . 5 VAL C 1 1
13 2218 1 1 5 VAL CA C 3.215 5.331 -6.683 1.00 . A A . 5 VAL CA 1 1
13 2219 1 1 5 VAL CB C 3.503 4.383 -5.510 1.00 . A A . 5 VAL CB 1 1
13 2220 1 1 5 VAL CG1 C 2.474 4.612 -4.402 1.00 . A A . 5 VAL CG1 1 1
13 2221 1 1 5 VAL CG2 C 3.441 2.916 -5.958 1.00 . A A . 5 VAL CG2 1 1
13 2222 1 1 5 VAL H H 3.784 4.012 -8.299 1.00 . A A . 5 VAL H 1 1
13 2223 1 1 5 VAL HA H 2.319 5.900 -6.483 1.00 . A A . 5 VAL HA 1 1
13 2224 1 1 5 VAL HB H 4.487 4.603 -5.124 1.00 . A A . 5 VAL HB 1 1
13 2225 1 1 5 VAL HG11 H 2.227 5.662 -4.351 1.00 . A A . 5 VAL HG11 1 1
13 2226 1 1 5 VAL HG12 H 2.888 4.292 -3.457 1.00 . A A . 5 VAL HG12 1 1
13 2227 1 1 5 VAL HG13 H 1.582 4.043 -4.615 1.00 . A A . 5 VAL HG13 1 1
13 2228 1 1 5 VAL HG21 H 4.092 2.769 -6.804 1.00 . A A . 5 VAL HG21 1 1
13 2229 1 1 5 VAL HG22 H 2.428 2.668 -6.236 1.00 . A A . 5 VAL HG22 1 1
13 2230 1 1 5 VAL HG23 H 3.759 2.280 -5.143 1.00 . A A . 5 VAL HG23 1 1
13 2231 1 1 5 VAL N N 3.021 4.484 -7.904 1.00 . A A . 5 VAL N 1 1
13 2232 1 1 5 VAL O O 5.440 5.903 -7.405 1.00 . A A . 5 VAL O 1 1
13 2233 1 1 6 ARG C C 6.422 8.285 -5.513 1.00 . A A . 6 ARG C 1 1
13 2234 1 1 6 ARG CA C 5.384 8.482 -6.615 1.00 . A A . 6 ARG CA 1 1
13 2235 1 1 6 ARG CB C 4.732 9.868 -6.514 1.00 . A A . 6 ARG CB 1 1
13 2236 1 1 6 ARG CD C 2.895 11.038 -5.287 1.00 . A A . 6 ARG CD 1 1
13 2237 1 1 6 ARG CG C 4.048 10.040 -5.154 1.00 . A A . 6 ARG CG 1 1
13 2238 1 1 6 ARG CZ C 0.622 10.529 -5.961 1.00 . A A . 6 ARG CZ 1 1
13 2239 1 1 6 ARG H H 3.435 7.769 -6.017 1.00 . A A . 6 ARG H 1 1
13 2240 1 1 6 ARG HA H 5.841 8.367 -7.587 1.00 . A A . 6 ARG HA 1 1
13 2241 1 1 6 ARG HB2 H 5.491 10.628 -6.631 1.00 . A A . 6 ARG HB2 1 1
13 2242 1 1 6 ARG HB3 H 3.999 9.976 -7.300 1.00 . A A . 6 ARG HB3 1 1
13 2243 1 1 6 ARG HD2 H 2.917 11.746 -4.470 1.00 . A A . 6 ARG HD2 1 1
13 2244 1 1 6 ARG HD3 H 2.949 11.554 -6.234 1.00 . A A . 6 ARG HD3 1 1
13 2245 1 1 6 ARG HE H 1.615 9.434 -4.635 1.00 . A A . 6 ARG HE 1 1
13 2246 1 1 6 ARG HG2 H 3.667 9.089 -4.816 1.00 . A A . 6 ARG HG2 1 1
13 2247 1 1 6 ARG HG3 H 4.764 10.414 -4.437 1.00 . A A . 6 ARG HG3 1 1
13 2248 1 1 6 ARG HH11 H 0.872 12.503 -5.739 1.00 . A A . 6 ARG HH11 1 1
13 2249 1 1 6 ARG HH12 H -0.476 12.023 -6.716 1.00 . A A . 6 ARG HH12 1 1
13 2250 1 1 6 ARG HH21 H 0.126 8.630 -6.354 1.00 . A A . 6 ARG HH21 1 1
13 2251 1 1 6 ARG HH22 H -0.898 9.834 -7.064 1.00 . A A . 6 ARG HH22 1 1
13 2252 1 1 6 ARG N N 4.268 7.502 -6.450 1.00 . A A . 6 ARG N 1 1
13 2253 1 1 6 ARG NE N 1.656 10.213 -5.227 1.00 . A A . 6 ARG NE 1 1
13 2254 1 1 6 ARG NH1 N 0.315 11.783 -6.154 1.00 . A A . 6 ARG NH1 1 1
13 2255 1 1 6 ARG NH2 N -0.106 9.591 -6.502 1.00 . A A . 6 ARG NH2 1 1
13 2256 1 1 6 ARG O O 6.229 8.668 -4.375 1.00 . A A . 6 ARG O 1 1
13 2257 1 1 7 GLY C C 8.847 5.908 -4.791 1.00 . A A . 7 GLY C 1 1
13 2258 1 1 7 GLY CA C 8.580 7.411 -4.846 1.00 . A A . 7 GLY CA 1 1
13 2259 1 1 7 GLY H H 7.641 7.361 -6.774 1.00 . A A . 7 GLY H 1 1
13 2260 1 1 7 GLY HA2 H 9.484 7.936 -5.127 1.00 . A A . 7 GLY HA2 1 1
13 2261 1 1 7 GLY HA3 H 8.250 7.749 -3.876 1.00 . A A . 7 GLY HA3 1 1
13 2262 1 1 7 GLY N N 7.521 7.670 -5.851 1.00 . A A . 7 GLY N 1 1
13 2263 1 1 7 GLY O O 9.886 5.471 -4.336 1.00 . A A . 7 GLY O 1 1
13 2264 1 1 8 ASP C C 7.312 3.001 -6.368 1.00 . A A . 8 ASP C 1 1
13 2265 1 1 8 ASP CA C 8.125 3.638 -5.248 1.00 . A A . 8 ASP CA 1 1
13 2266 1 1 8 ASP CB C 7.632 3.174 -3.880 1.00 . A A . 8 ASP CB 1 1
13 2267 1 1 8 ASP CG C 8.756 3.343 -2.857 1.00 . A A . 8 ASP CG 1 1
13 2268 1 1 8 ASP H H 7.093 5.474 -5.649 1.00 . A A . 8 ASP H 1 1
13 2269 1 1 8 ASP HA H 9.173 3.404 -5.365 1.00 . A A . 8 ASP HA 1 1
13 2270 1 1 8 ASP HB2 H 6.778 3.766 -3.585 1.00 . A A . 8 ASP HB2 1 1
13 2271 1 1 8 ASP HB3 H 7.350 2.132 -3.933 1.00 . A A . 8 ASP HB3 1 1
13 2272 1 1 8 ASP N N 7.918 5.107 -5.265 1.00 . A A . 8 ASP N 1 1
13 2273 1 1 8 ASP O O 6.158 2.664 -6.196 1.00 . A A . 8 ASP O 1 1
13 2274 1 1 8 ASP OD1 O 9.807 2.758 -3.059 1.00 . A A . 8 ASP OD1 1 1
13 2275 1 1 8 ASP OD2 O 8.548 4.059 -1.892 1.00 . A A . 8 ASP OD2 1 1
13 2276 1 1 9 TYR C C 7.031 0.729 -8.471 1.00 . A A . 9 TYR C 1 1
13 2277 1 1 9 TYR CA C 7.154 2.242 -8.656 1.00 . A A . 9 TYR CA 1 1
13 2278 1 1 9 TYR CB C 8.010 2.561 -9.884 1.00 . A A . 9 TYR CB 1 1
13 2279 1 1 9 TYR CD1 C 6.322 2.630 -11.745 1.00 . A A . 9 TYR CD1 1 1
13 2280 1 1 9 TYR CD2 C 7.232 4.713 -10.904 1.00 . A A . 9 TYR CD2 1 1
13 2281 1 1 9 TYR CE1 C 5.532 3.341 -12.654 1.00 . A A . 9 TYR CE1 1 1
13 2282 1 1 9 TYR CE2 C 6.442 5.426 -11.814 1.00 . A A . 9 TYR CE2 1 1
13 2283 1 1 9 TYR CG C 7.172 3.319 -10.873 1.00 . A A . 9 TYR CG 1 1
13 2284 1 1 9 TYR CZ C 5.591 4.739 -12.690 1.00 . A A . 9 TYR CZ 1 1
13 2285 1 1 9 TYR H H 8.821 3.145 -7.628 1.00 . A A . 9 TYR H 1 1
13 2286 1 1 9 TYR HA H 6.179 2.698 -8.759 1.00 . A A . 9 TYR HA 1 1
13 2287 1 1 9 TYR HB2 H 8.855 3.168 -9.591 1.00 . A A . 9 TYR HB2 1 1
13 2288 1 1 9 TYR HB3 H 8.360 1.644 -10.336 1.00 . A A . 9 TYR HB3 1 1
13 2289 1 1 9 TYR HD1 H 6.277 1.552 -11.717 1.00 . A A . 9 TYR HD1 1 1
13 2290 1 1 9 TYR HD2 H 7.888 5.237 -10.223 1.00 . A A . 9 TYR HD2 1 1
13 2291 1 1 9 TYR HE1 H 4.874 2.812 -13.328 1.00 . A A . 9 TYR HE1 1 1
13 2292 1 1 9 TYR HE2 H 6.488 6.507 -11.842 1.00 . A A . 9 TYR HE2 1 1
13 2293 1 1 9 TYR HH H 4.038 4.908 -13.795 1.00 . A A . 9 TYR HH 1 1
13 2294 1 1 9 TYR N N 7.899 2.843 -7.512 1.00 . A A . 9 TYR N 1 1
13 2295 1 1 9 TYR O O 7.834 0.105 -7.805 1.00 . A A . 9 TYR O 1 1
13 2296 1 1 9 TYR OH O 4.808 5.443 -13.585 1.00 . A A . 9 TYR OH 1 1
13 2297 1 1 10 LEU C C 6.358 -2.073 -10.105 1.00 . A A . 10 LEU C 1 1
13 2298 1 1 10 LEU CA C 5.805 -1.324 -8.886 1.00 . A A . 10 LEU CA 1 1
13 2299 1 1 10 LEU CB C 4.286 -1.474 -8.796 1.00 . A A . 10 LEU CB 1 1
13 2300 1 1 10 LEU CD1 C 3.786 -2.035 -6.410 1.00 . A A . 10 LEU CD1 1 1
13 2301 1 1 10 LEU CD2 C 2.598 -3.226 -8.256 1.00 . A A . 10 LEU CD2 1 1
13 2302 1 1 10 LEU CG C 3.925 -2.599 -7.826 1.00 . A A . 10 LEU CG 1 1
13 2303 1 1 10 LEU H H 5.367 0.674 -9.554 1.00 . A A . 10 LEU H 1 1
13 2304 1 1 10 LEU HA H 6.266 -1.682 -7.980 1.00 . A A . 10 LEU HA 1 1
13 2305 1 1 10 LEU HB2 H 3.853 -0.549 -8.447 1.00 . A A . 10 LEU HB2 1 1
13 2306 1 1 10 LEU HB3 H 3.892 -1.709 -9.773 1.00 . A A . 10 LEU HB3 1 1
13 2307 1 1 10 LEU HD11 H 3.117 -2.661 -5.839 1.00 . A A . 10 LEU HD11 1 1
13 2308 1 1 10 LEU HD12 H 3.386 -1.032 -6.459 1.00 . A A . 10 LEU HD12 1 1
13 2309 1 1 10 LEU HD13 H 4.754 -2.014 -5.931 1.00 . A A . 10 LEU HD13 1 1
13 2310 1 1 10 LEU HD21 H 2.412 -4.112 -7.668 1.00 . A A . 10 LEU HD21 1 1
13 2311 1 1 10 LEU HD22 H 2.646 -3.490 -9.301 1.00 . A A . 10 LEU HD22 1 1
13 2312 1 1 10 LEU HD23 H 1.799 -2.516 -8.100 1.00 . A A . 10 LEU HD23 1 1
13 2313 1 1 10 LEU HG H 4.704 -3.350 -7.839 1.00 . A A . 10 LEU HG 1 1
13 2314 1 1 10 LEU N N 6.012 0.144 -9.038 1.00 . A A . 10 LEU N 1 1
13 2315 1 1 10 LEU O O 7.360 -1.690 -10.679 1.00 . A A . 10 LEU O 1 1
13 2316 1 1 11 ASP C C 5.011 -4.414 -12.501 1.00 . A A . 11 ASP C 1 1
13 2317 1 1 11 ASP CA C 6.202 -3.917 -11.675 1.00 . A A . 11 ASP CA 1 1
13 2318 1 1 11 ASP CB C 6.972 -5.091 -11.069 1.00 . A A . 11 ASP CB 1 1
13 2319 1 1 11 ASP CG C 8.045 -5.562 -12.051 1.00 . A A . 11 ASP CG 1 1
13 2320 1 1 11 ASP H H 4.916 -3.434 -10.019 1.00 . A A . 11 ASP H 1 1
13 2321 1 1 11 ASP HA H 6.862 -3.317 -12.286 1.00 . A A . 11 ASP HA 1 1
13 2322 1 1 11 ASP HB2 H 7.439 -4.776 -10.146 1.00 . A A . 11 ASP HB2 1 1
13 2323 1 1 11 ASP HB3 H 6.290 -5.903 -10.866 1.00 . A A . 11 ASP HB3 1 1
13 2324 1 1 11 ASP N N 5.717 -3.140 -10.500 1.00 . A A . 11 ASP N 1 1
13 2325 1 1 11 ASP O O 4.715 -5.593 -12.533 1.00 . A A . 11 ASP O 1 1
13 2326 1 1 11 ASP OD1 O 8.934 -4.780 -12.348 1.00 . A A . 11 ASP OD1 1 1
13 2327 1 1 11 ASP OD2 O 7.960 -6.697 -12.491 1.00 . A A . 11 ASP OD2 1 1
13 2328 1 1 12 CYS C C 3.189 -3.304 -15.374 1.00 . A A . 12 CYS C 1 1
13 2329 1 1 12 CYS CA C 3.145 -3.948 -13.984 1.00 . A A . 12 CYS CA 1 1
13 2330 1 1 12 CYS CB C 1.923 -3.457 -13.206 1.00 . A A . 12 CYS CB 1 1
13 2331 1 1 12 CYS H H 4.572 -2.576 -13.127 1.00 . A A . 12 CYS H 1 1
13 2332 1 1 12 CYS HA H 3.116 -5.022 -14.068 1.00 . A A . 12 CYS HA 1 1
13 2333 1 1 12 CYS HB2 H 2.067 -2.424 -12.922 1.00 . A A . 12 CYS HB2 1 1
13 2334 1 1 12 CYS HB3 H 1.042 -3.540 -13.827 1.00 . A A . 12 CYS HB3 1 1
13 2335 1 1 12 CYS N N 4.320 -3.522 -13.168 1.00 . A A . 12 CYS N 1 1
13 2336 1 1 12 CYS O O 2.164 -3.009 -15.956 1.00 . A A . 12 CYS O 1 1
13 2337 1 1 12 CYS SG S 1.711 -4.467 -11.721 1.00 . A A . 12 CYS SG 1 1
13 2338 1 1 13 NH2 HN1 H 5.170 -3.316 -15.470 1.00 . A A . 13 NH2 HN1 1 1
13 2339 1 1 13 NH2 HN2 H 4.381 -2.677 -16.828 1.00 . A A . 13 NH2 HN2 1 1
13 2340 1 1 13 NH2 N N 4.342 -3.080 -15.937 1.00 . A A . 13 NH2 N 1 1
14 2341 1 1 1 ACE C C 0.862 -4.635 -5.315 1.00 . A A . 1 ACE C 1 1
14 2342 1 1 1 ACE CH3 C 1.637 -5.640 -4.459 1.00 . A A . 1 ACE CH3 1 1
14 2343 1 1 1 ACE H1 H 1.316 -5.562 -3.430 1.00 . A A . 1 ACE H1 1 1
14 2344 1 1 1 ACE H2 H 2.695 -5.427 -4.523 1.00 . A A . 1 ACE H2 1 1
14 2345 1 1 1 ACE H3 H 1.450 -6.640 -4.820 1.00 . A A . 1 ACE H3 1 1
14 2346 1 1 1 ACE O O -0.337 -4.489 -5.183 1.00 . A A . 1 ACE O 1 1
14 2347 1 1 2 CYS C C -0.001 -1.981 -6.228 1.00 . A A . 2 CYS C 1 1
14 2348 1 1 2 CYS CA C 0.849 -2.944 -7.069 1.00 . A A . 2 CYS CA 1 1
14 2349 1 1 2 CYS CB C -0.043 -3.778 -7.994 1.00 . A A . 2 CYS CB 1 1
14 2350 1 1 2 CYS H H 2.507 -4.080 -6.281 1.00 . A A . 2 CYS H 1 1
14 2351 1 1 2 CYS HA H 1.570 -2.395 -7.654 1.00 . A A . 2 CYS HA 1 1
14 2352 1 1 2 CYS HB2 H 0.378 -4.765 -8.110 1.00 . A A . 2 CYS HB2 1 1
14 2353 1 1 2 CYS HB3 H -1.032 -3.857 -7.564 1.00 . A A . 2 CYS HB3 1 1
14 2354 1 1 2 CYS N N 1.540 -3.942 -6.194 1.00 . A A . 2 CYS N 1 1
14 2355 1 1 2 CYS O O -1.206 -1.916 -6.376 1.00 . A A . 2 CYS O 1 1
14 2356 1 1 2 CYS SG S -0.153 -2.968 -9.610 1.00 . A A . 2 CYS SG 1 1
14 2357 1 1 3 ARG C C 0.605 1.017 -4.249 1.00 . A A . 3 ARG C 1 1
14 2358 1 1 3 ARG CA C -0.174 -0.282 -4.502 1.00 . A A . 3 ARG CA 1 1
14 2359 1 1 3 ARG CB C -0.401 -1.023 -3.184 1.00 . A A . 3 ARG CB 1 1
14 2360 1 1 3 ARG CD C -2.352 -1.712 -1.780 1.00 . A A . 3 ARG CD 1 1
14 2361 1 1 3 ARG CG C -1.778 -1.691 -3.199 1.00 . A A . 3 ARG CG 1 1
14 2362 1 1 3 ARG CZ C -4.671 -1.771 -2.477 1.00 . A A . 3 ARG CZ 1 1
14 2363 1 1 3 ARG H H 1.585 -1.296 -5.237 1.00 . A A . 3 ARG H 1 1
14 2364 1 1 3 ARG HA H -1.122 -0.068 -4.967 1.00 . A A . 3 ARG HA 1 1
14 2365 1 1 3 ARG HB2 H 0.363 -1.777 -3.058 1.00 . A A . 3 ARG HB2 1 1
14 2366 1 1 3 ARG HB3 H -0.354 -0.322 -2.364 1.00 . A A . 3 ARG HB3 1 1
14 2367 1 1 3 ARG HD2 H -1.701 -2.271 -1.121 1.00 . A A . 3 ARG HD2 1 1
14 2368 1 1 3 ARG HD3 H -2.486 -0.706 -1.413 1.00 . A A . 3 ARG HD3 1 1
14 2369 1 1 3 ARG HE H -3.792 -3.299 -1.565 1.00 . A A . 3 ARG HE 1 1
14 2370 1 1 3 ARG HG2 H -2.439 -1.135 -3.848 1.00 . A A . 3 ARG HG2 1 1
14 2371 1 1 3 ARG HG3 H -1.684 -2.703 -3.562 1.00 . A A . 3 ARG HG3 1 1
14 2372 1 1 3 ARG HH11 H -5.123 -0.685 -0.856 1.00 . A A . 3 ARG HH11 1 1
14 2373 1 1 3 ARG HH12 H -6.125 -0.414 -2.242 1.00 . A A . 3 ARG HH12 1 1
14 2374 1 1 3 ARG HH21 H -4.456 -2.713 -4.230 1.00 . A A . 3 ARG HH21 1 1
14 2375 1 1 3 ARG HH22 H -5.748 -1.562 -4.151 1.00 . A A . 3 ARG HH22 1 1
14 2376 1 1 3 ARG N N 0.614 -1.232 -5.345 1.00 . A A . 3 ARG N 1 1
14 2377 1 1 3 ARG NE N -3.672 -2.389 -1.908 1.00 . A A . 3 ARG NE 1 1
14 2378 1 1 3 ARG NH1 N -5.360 -0.888 -1.805 1.00 . A A . 3 ARG NH1 1 1
14 2379 1 1 3 ARG NH2 N -4.983 -2.036 -3.716 1.00 . A A . 3 ARG NH2 1 1
14 2380 1 1 3 ARG O O 0.357 1.712 -3.282 1.00 . A A . 3 ARG O 1 1
14 2381 1 1 4 VAL C C 2.641 3.314 -6.200 1.00 . A A . 4 VAL C 1 1
14 2382 1 1 4 VAL CA C 2.324 2.613 -4.869 1.00 . A A . 4 VAL CA 1 1
14 2383 1 1 4 VAL CB C 3.596 2.163 -4.153 1.00 . A A . 4 VAL CB 1 1
14 2384 1 1 4 VAL CG1 C 4.416 1.240 -5.061 1.00 . A A . 4 VAL CG1 1 1
14 2385 1 1 4 VAL CG2 C 4.422 3.393 -3.771 1.00 . A A . 4 VAL CG2 1 1
14 2386 1 1 4 VAL H H 1.742 0.786 -5.869 1.00 . A A . 4 VAL H 1 1
14 2387 1 1 4 VAL HA H 1.767 3.278 -4.229 1.00 . A A . 4 VAL HA 1 1
14 2388 1 1 4 VAL HB H 3.326 1.624 -3.255 1.00 . A A . 4 VAL HB 1 1
14 2389 1 1 4 VAL HG11 H 5.459 1.299 -4.788 1.00 . A A . 4 VAL HG11 1 1
14 2390 1 1 4 VAL HG12 H 4.296 1.544 -6.090 1.00 . A A . 4 VAL HG12 1 1
14 2391 1 1 4 VAL HG13 H 4.072 0.224 -4.944 1.00 . A A . 4 VAL HG13 1 1
14 2392 1 1 4 VAL HG21 H 5.093 3.138 -2.964 1.00 . A A . 4 VAL HG21 1 1
14 2393 1 1 4 VAL HG22 H 3.760 4.184 -3.454 1.00 . A A . 4 VAL HG22 1 1
14 2394 1 1 4 VAL HG23 H 4.993 3.724 -4.624 1.00 . A A . 4 VAL HG23 1 1
14 2395 1 1 4 VAL N N 1.545 1.355 -5.095 1.00 . A A . 4 VAL N 1 1
14 2396 1 1 4 VAL O O 2.487 2.742 -7.262 1.00 . A A . 4 VAL O 1 1
14 2397 1 1 5 VAL C C 4.590 6.214 -7.265 1.00 . A A . 5 VAL C 1 1
14 2398 1 1 5 VAL CA C 3.363 5.297 -7.413 1.00 . A A . 5 VAL CA 1 1
14 2399 1 1 5 VAL CB C 2.078 6.095 -7.716 1.00 . A A . 5 VAL CB 1 1
14 2400 1 1 5 VAL CG1 C 1.513 6.747 -6.444 1.00 . A A . 5 VAL CG1 1 1
14 2401 1 1 5 VAL CG2 C 2.362 7.179 -8.768 1.00 . A A . 5 VAL CG2 1 1
14 2402 1 1 5 VAL H H 3.168 5.002 -5.289 1.00 . A A . 5 VAL H 1 1
14 2403 1 1 5 VAL HA H 3.536 4.601 -8.205 1.00 . A A . 5 VAL HA 1 1
14 2404 1 1 5 VAL HB H 1.344 5.419 -8.102 1.00 . A A . 5 VAL HB 1 1
14 2405 1 1 5 VAL HG11 H 2.195 6.592 -5.622 1.00 . A A . 5 VAL HG11 1 1
14 2406 1 1 5 VAL HG12 H 0.559 6.302 -6.207 1.00 . A A . 5 VAL HG12 1 1
14 2407 1 1 5 VAL HG13 H 1.382 7.807 -6.609 1.00 . A A . 5 VAL HG13 1 1
14 2408 1 1 5 VAL HG21 H 1.606 7.139 -9.538 1.00 . A A . 5 VAL HG21 1 1
14 2409 1 1 5 VAL HG22 H 3.333 7.009 -9.210 1.00 . A A . 5 VAL HG22 1 1
14 2410 1 1 5 VAL HG23 H 2.345 8.151 -8.299 1.00 . A A . 5 VAL HG23 1 1
14 2411 1 1 5 VAL N N 3.062 4.556 -6.150 1.00 . A A . 5 VAL N 1 1
14 2412 1 1 5 VAL O O 5.707 5.840 -7.576 1.00 . A A . 5 VAL O 1 1
14 2413 1 1 6 ARG C C 6.386 8.019 -5.480 1.00 . A A . 6 ARG C 1 1
14 2414 1 1 6 ARG CA C 5.522 8.379 -6.684 1.00 . A A . 6 ARG CA 1 1
14 2415 1 1 6 ARG CB C 4.866 9.749 -6.487 1.00 . A A . 6 ARG CB 1 1
14 2416 1 1 6 ARG CD C 4.751 10.423 -4.080 1.00 . A A . 6 ARG CD 1 1
14 2417 1 1 6 ARG CG C 4.000 9.735 -5.222 1.00 . A A . 6 ARG CG 1 1
14 2418 1 1 6 ARG CZ C 3.430 12.218 -3.133 1.00 . A A . 6 ARG CZ 1 1
14 2419 1 1 6 ARG H H 3.482 7.695 -6.597 1.00 . A A . 6 ARG H 1 1
14 2420 1 1 6 ARG HA H 6.116 8.384 -7.583 1.00 . A A . 6 ARG HA 1 1
14 2421 1 1 6 ARG HB2 H 5.633 10.504 -6.391 1.00 . A A . 6 ARG HB2 1 1
14 2422 1 1 6 ARG HB3 H 4.246 9.974 -7.342 1.00 . A A . 6 ARG HB3 1 1
14 2423 1 1 6 ARG HD2 H 4.529 9.935 -3.140 1.00 . A A . 6 ARG HD2 1 1
14 2424 1 1 6 ARG HD3 H 5.813 10.415 -4.269 1.00 . A A . 6 ARG HD3 1 1
14 2425 1 1 6 ARG HE H 4.521 12.447 -4.775 1.00 . A A . 6 ARG HE 1 1
14 2426 1 1 6 ARG HG2 H 3.075 10.261 -5.414 1.00 . A A . 6 ARG HG2 1 1
14 2427 1 1 6 ARG HG3 H 3.782 8.715 -4.945 1.00 . A A . 6 ARG HG3 1 1
14 2428 1 1 6 ARG HH11 H 4.897 12.755 -1.881 1.00 . A A . 6 ARG HH11 1 1
14 2429 1 1 6 ARG HH12 H 3.285 12.996 -1.294 1.00 . A A . 6 ARG HH12 1 1
14 2430 1 1 6 ARG HH21 H 1.773 11.775 -4.166 1.00 . A A . 6 ARG HH21 1 1
14 2431 1 1 6 ARG HH22 H 1.516 12.441 -2.588 1.00 . A A . 6 ARG HH22 1 1
14 2432 1 1 6 ARG N N 4.386 7.418 -6.815 1.00 . A A . 6 ARG N 1 1
14 2433 1 1 6 ARG NE N 4.243 11.822 -4.074 1.00 . A A . 6 ARG NE 1 1
14 2434 1 1 6 ARG NH1 N 3.908 12.693 -2.016 1.00 . A A . 6 ARG NH1 1 1
14 2435 1 1 6 ARG NH2 N 2.139 12.138 -3.310 1.00 . A A . 6 ARG NH2 1 1
14 2436 1 1 6 ARG O O 5.908 7.846 -4.377 1.00 . A A . 6 ARG O 1 1
14 2437 1 1 7 GLY C C 8.826 5.972 -4.723 1.00 . A A . 7 GLY C 1 1
14 2438 1 1 7 GLY CA C 8.588 7.478 -4.618 1.00 . A A . 7 GLY CA 1 1
14 2439 1 1 7 GLY H H 8.008 7.989 -6.622 1.00 . A A . 7 GLY H 1 1
14 2440 1 1 7 GLY HA2 H 9.525 8.009 -4.724 1.00 . A A . 7 GLY HA2 1 1
14 2441 1 1 7 GLY HA3 H 8.142 7.704 -3.663 1.00 . A A . 7 GLY HA3 1 1
14 2442 1 1 7 GLY N N 7.663 7.869 -5.712 1.00 . A A . 7 GLY N 1 1
14 2443 1 1 7 GLY O O 9.876 5.466 -4.377 1.00 . A A . 7 GLY O 1 1
14 2444 1 1 8 ASP C C 7.089 3.364 -6.552 1.00 . A A . 8 ASP C 1 1
14 2445 1 1 8 ASP CA C 7.982 3.792 -5.388 1.00 . A A . 8 ASP CA 1 1
14 2446 1 1 8 ASP CB C 7.510 3.194 -4.064 1.00 . A A . 8 ASP CB 1 1
14 2447 1 1 8 ASP CG C 8.704 3.047 -3.117 1.00 . A A . 8 ASP CG 1 1
14 2448 1 1 8 ASP H H 7.024 5.697 -5.517 1.00 . A A . 8 ASP H 1 1
14 2449 1 1 8 ASP HA H 9.009 3.523 -5.578 1.00 . A A . 8 ASP HA 1 1
14 2450 1 1 8 ASP HB2 H 6.779 3.849 -3.617 1.00 . A A . 8 ASP HB2 1 1
14 2451 1 1 8 ASP HB3 H 7.070 2.224 -4.239 1.00 . A A . 8 ASP HB3 1 1
14 2452 1 1 8 ASP N N 7.850 5.259 -5.222 1.00 . A A . 8 ASP N 1 1
14 2453 1 1 8 ASP O O 5.933 3.039 -6.376 1.00 . A A . 8 ASP O 1 1
14 2454 1 1 8 ASP OD1 O 9.788 2.763 -3.600 1.00 . A A . 8 ASP OD1 1 1
14 2455 1 1 8 ASP OD2 O 8.512 3.221 -1.924 1.00 . A A . 8 ASP OD2 1 1
14 2456 1 1 9 TYR C C 6.680 1.518 -9.082 1.00 . A A . 9 TYR C 1 1
14 2457 1 1 9 TYR CA C 6.778 3.035 -8.931 1.00 . A A . 9 TYR CA 1 1
14 2458 1 1 9 TYR CB C 7.515 3.642 -10.127 1.00 . A A . 9 TYR CB 1 1
14 2459 1 1 9 TYR CD1 C 6.449 5.921 -10.227 1.00 . A A . 9 TYR CD1 1 1
14 2460 1 1 9 TYR CD2 C 8.771 5.750 -9.551 1.00 . A A . 9 TYR CD2 1 1
14 2461 1 1 9 TYR CE1 C 6.507 7.311 -10.072 1.00 . A A . 9 TYR CE1 1 1
14 2462 1 1 9 TYR CE2 C 8.828 7.139 -9.394 1.00 . A A . 9 TYR CE2 1 1
14 2463 1 1 9 TYR CG C 7.582 5.142 -9.967 1.00 . A A . 9 TYR CG 1 1
14 2464 1 1 9 TYR CZ C 7.695 7.920 -9.656 1.00 . A A . 9 TYR CZ 1 1
14 2465 1 1 9 TYR H H 8.527 3.694 -7.857 1.00 . A A . 9 TYR H 1 1
14 2466 1 1 9 TYR HA H 5.792 3.471 -8.851 1.00 . A A . 9 TYR HA 1 1
14 2467 1 1 9 TYR HB2 H 8.517 3.240 -10.174 1.00 . A A . 9 TYR HB2 1 1
14 2468 1 1 9 TYR HB3 H 6.987 3.400 -11.036 1.00 . A A . 9 TYR HB3 1 1
14 2469 1 1 9 TYR HD1 H 5.531 5.451 -10.548 1.00 . A A . 9 TYR HD1 1 1
14 2470 1 1 9 TYR HD2 H 9.646 5.147 -9.351 1.00 . A A . 9 TYR HD2 1 1
14 2471 1 1 9 TYR HE1 H 5.634 7.914 -10.273 1.00 . A A . 9 TYR HE1 1 1
14 2472 1 1 9 TYR HE2 H 9.746 7.609 -9.074 1.00 . A A . 9 TYR HE2 1 1
14 2473 1 1 9 TYR HH H 7.303 9.691 -10.249 1.00 . A A . 9 TYR HH 1 1
14 2474 1 1 9 TYR N N 7.607 3.397 -7.742 1.00 . A A . 9 TYR N 1 1
14 2475 1 1 9 TYR O O 7.037 0.956 -10.100 1.00 . A A . 9 TYR O 1 1
14 2476 1 1 9 TYR OH O 7.753 9.290 -9.502 1.00 . A A . 9 TYR OH 1 1
14 2477 1 1 10 LEU C C 4.540 -0.935 -8.484 1.00 . A A . 10 LEU C 1 1
14 2478 1 1 10 LEU CA C 6.001 -0.618 -8.155 1.00 . A A . 10 LEU CA 1 1
14 2479 1 1 10 LEU CB C 6.360 -1.128 -6.757 1.00 . A A . 10 LEU CB 1 1
14 2480 1 1 10 LEU CD1 C 8.593 -0.002 -6.937 1.00 . A A . 10 LEU CD1 1 1
14 2481 1 1 10 LEU CD2 C 8.219 -1.776 -5.221 1.00 . A A . 10 LEU CD2 1 1
14 2482 1 1 10 LEU CG C 7.875 -1.322 -6.642 1.00 . A A . 10 LEU CG 1 1
14 2483 1 1 10 LEU H H 5.864 1.342 -7.284 1.00 . A A . 10 LEU H 1 1
14 2484 1 1 10 LEU HA H 6.663 -1.042 -8.893 1.00 . A A . 10 LEU HA 1 1
14 2485 1 1 10 LEU HB2 H 6.033 -0.410 -6.019 1.00 . A A . 10 LEU HB2 1 1
14 2486 1 1 10 LEU HB3 H 5.865 -2.071 -6.582 1.00 . A A . 10 LEU HB3 1 1
14 2487 1 1 10 LEU HD11 H 9.613 -0.060 -6.587 1.00 . A A . 10 LEU HD11 1 1
14 2488 1 1 10 LEU HD12 H 8.084 0.806 -6.433 1.00 . A A . 10 LEU HD12 1 1
14 2489 1 1 10 LEU HD13 H 8.588 0.179 -8.003 1.00 . A A . 10 LEU HD13 1 1
14 2490 1 1 10 LEU HD21 H 7.726 -2.714 -5.014 1.00 . A A . 10 LEU HD21 1 1
14 2491 1 1 10 LEU HD22 H 7.885 -1.030 -4.514 1.00 . A A . 10 LEU HD22 1 1
14 2492 1 1 10 LEU HD23 H 9.287 -1.903 -5.132 1.00 . A A . 10 LEU HD23 1 1
14 2493 1 1 10 LEU HG H 8.197 -2.073 -7.348 1.00 . A A . 10 LEU HG 1 1
14 2494 1 1 10 LEU N N 6.165 0.859 -8.081 1.00 . A A . 10 LEU N 1 1
14 2495 1 1 10 LEU O O 3.809 -1.460 -7.669 1.00 . A A . 10 LEU O 1 1
14 2496 1 1 11 ASP C C 2.569 -2.179 -10.811 1.00 . A A . 11 ASP C 1 1
14 2497 1 1 11 ASP CA C 2.690 -0.854 -10.055 1.00 . A A . 11 ASP CA 1 1
14 2498 1 1 11 ASP CB C 2.300 0.321 -10.959 1.00 . A A . 11 ASP CB 1 1
14 2499 1 1 11 ASP CG C 3.212 0.356 -12.188 1.00 . A A . 11 ASP CG 1 1
14 2500 1 1 11 ASP H H 4.716 -0.161 -10.305 1.00 . A A . 11 ASP H 1 1
14 2501 1 1 11 ASP HA H 2.061 -0.863 -9.178 1.00 . A A . 11 ASP HA 1 1
14 2502 1 1 11 ASP HB2 H 1.274 0.204 -11.275 1.00 . A A . 11 ASP HB2 1 1
14 2503 1 1 11 ASP HB3 H 2.405 1.245 -10.410 1.00 . A A . 11 ASP HB3 1 1
14 2504 1 1 11 ASP N N 4.109 -0.597 -9.671 1.00 . A A . 11 ASP N 1 1
14 2505 1 1 11 ASP O O 1.971 -2.244 -11.866 1.00 . A A . 11 ASP O 1 1
14 2506 1 1 11 ASP OD1 O 4.397 0.590 -12.016 1.00 . A A . 11 ASP OD1 1 1
14 2507 1 1 11 ASP OD2 O 2.710 0.148 -13.280 1.00 . A A . 11 ASP OD2 1 1
14 2508 1 1 12 CYS C C 2.976 -4.482 -12.433 1.00 . A A . 12 CYS C 1 1
14 2509 1 1 12 CYS CA C 3.048 -4.582 -10.902 1.00 . A A . 12 CYS CA 1 1
14 2510 1 1 12 CYS CB C 1.779 -5.228 -10.322 1.00 . A A . 12 CYS CB 1 1
14 2511 1 1 12 CYS H H 3.583 -3.133 -9.400 1.00 . A A . 12 CYS H 1 1
14 2512 1 1 12 CYS HA H 3.906 -5.166 -10.615 1.00 . A A . 12 CYS HA 1 1
14 2513 1 1 12 CYS HB2 H 1.755 -6.272 -10.596 1.00 . A A . 12 CYS HB2 1 1
14 2514 1 1 12 CYS HB3 H 1.801 -5.145 -9.246 1.00 . A A . 12 CYS HB3 1 1
14 2515 1 1 12 CYS N N 3.121 -3.230 -10.258 1.00 . A A . 12 CYS N 1 1
14 2516 1 1 12 CYS O O 2.186 -5.153 -13.066 1.00 . A A . 12 CYS O 1 1
14 2517 1 1 12 CYS SG S 0.289 -4.410 -10.961 1.00 . A A . 12 CYS SG 1 1
14 2518 1 1 13 NH2 HN1 H 4.418 -3.122 -12.548 1.00 . A A . 13 NH2 HN1 1 1
14 2519 1 1 13 NH2 HN2 H 3.741 -3.588 -14.033 1.00 . A A . 13 NH2 HN2 1 1
14 2520 1 1 13 NH2 N N 3.778 -3.662 -13.057 1.00 . A A . 13 NH2 N 1 1
15 2521 1 1 1 ACE C C 4.522 -4.297 -4.163 1.00 . A A . 1 ACE C 1 1
15 2522 1 1 1 ACE CH3 C 4.493 -5.605 -3.369 1.00 . A A . 1 ACE CH3 1 1
15 2523 1 1 1 ACE H1 H 4.493 -5.386 -2.311 1.00 . A A . 1 ACE H1 1 1
15 2524 1 1 1 ACE H2 H 5.364 -6.194 -3.616 1.00 . A A . 1 ACE H2 1 1
15 2525 1 1 1 ACE H3 H 3.602 -6.160 -3.621 1.00 . A A . 1 ACE H3 1 1
15 2526 1 1 1 ACE O O 5.004 -3.285 -3.693 1.00 . A A . 1 ACE O 1 1
15 2527 1 1 2 CYS C C 2.624 -2.413 -6.141 1.00 . A A . 2 CYS C 1 1
15 2528 1 1 2 CYS CA C 4.007 -3.072 -6.194 1.00 . A A . 2 CYS CA 1 1
15 2529 1 1 2 CYS CB C 4.324 -3.543 -7.620 1.00 . A A . 2 CYS CB 1 1
15 2530 1 1 2 CYS H H 3.628 -5.141 -5.722 1.00 . A A . 2 CYS H 1 1
15 2531 1 1 2 CYS HA H 4.766 -2.388 -5.852 1.00 . A A . 2 CYS HA 1 1
15 2532 1 1 2 CYS HB2 H 3.552 -4.221 -7.953 1.00 . A A . 2 CYS HB2 1 1
15 2533 1 1 2 CYS HB3 H 4.361 -2.689 -8.279 1.00 . A A . 2 CYS HB3 1 1
15 2534 1 1 2 CYS N N 4.010 -4.313 -5.364 1.00 . A A . 2 CYS N 1 1
15 2535 1 1 2 CYS O O 1.786 -2.639 -6.992 1.00 . A A . 2 CYS O 1 1
15 2536 1 1 2 CYS SG S 5.924 -4.398 -7.649 1.00 . A A . 2 CYS SG 1 1
15 2537 1 1 3 ARG C C 1.214 0.565 -4.753 1.00 . A A . 3 ARG C 1 1
15 2538 1 1 3 ARG CA C 1.044 -0.935 -5.033 1.00 . A A . 3 ARG CA 1 1
15 2539 1 1 3 ARG CB C 0.355 -1.628 -3.854 1.00 . A A . 3 ARG CB 1 1
15 2540 1 1 3 ARG CD C -0.905 -3.666 -3.133 1.00 . A A . 3 ARG CD 1 1
15 2541 1 1 3 ARG CG C -0.183 -2.990 -4.302 1.00 . A A . 3 ARG CG 1 1
15 2542 1 1 3 ARG CZ C -2.387 -2.136 -1.979 1.00 . A A . 3 ARG CZ 1 1
15 2543 1 1 3 ARG H H 3.064 -1.437 -4.466 1.00 . A A . 3 ARG H 1 1
15 2544 1 1 3 ARG HA H 0.473 -1.087 -5.935 1.00 . A A . 3 ARG HA 1 1
15 2545 1 1 3 ARG HB2 H 1.067 -1.768 -3.054 1.00 . A A . 3 ARG HB2 1 1
15 2546 1 1 3 ARG HB3 H -0.465 -1.018 -3.505 1.00 . A A . 3 ARG HB3 1 1
15 2547 1 1 3 ARG HD2 H -1.088 -4.708 -3.357 1.00 . A A . 3 ARG HD2 1 1
15 2548 1 1 3 ARG HD3 H -0.328 -3.570 -2.227 1.00 . A A . 3 ARG HD3 1 1
15 2549 1 1 3 ARG HE H -2.891 -3.036 -3.676 1.00 . A A . 3 ARG HE 1 1
15 2550 1 1 3 ARG HG2 H -0.873 -2.852 -5.122 1.00 . A A . 3 ARG HG2 1 1
15 2551 1 1 3 ARG HG3 H 0.638 -3.613 -4.624 1.00 . A A . 3 ARG HG3 1 1
15 2552 1 1 3 ARG HH11 H -1.785 -3.482 -0.625 1.00 . A A . 3 ARG HH11 1 1
15 2553 1 1 3 ARG HH12 H -2.280 -1.948 0.010 1.00 . A A . 3 ARG HH12 1 1
15 2554 1 1 3 ARG HH21 H -3.033 -0.606 -3.096 1.00 . A A . 3 ARG HH21 1 1
15 2555 1 1 3 ARG HH22 H -2.987 -0.321 -1.389 1.00 . A A . 3 ARG HH22 1 1
15 2556 1 1 3 ARG N N 2.376 -1.601 -5.144 1.00 . A A . 3 ARG N 1 1
15 2557 1 1 3 ARG NE N -2.192 -2.928 -2.999 1.00 . A A . 3 ARG NE 1 1
15 2558 1 1 3 ARG NH1 N -2.131 -2.555 -0.770 1.00 . A A . 3 ARG NH1 1 1
15 2559 1 1 3 ARG NH2 N -2.838 -0.927 -2.169 1.00 . A A . 3 ARG NH2 1 1
15 2560 1 1 3 ARG O O 0.343 1.205 -4.195 1.00 . A A . 3 ARG O 1 1
15 2561 1 1 4 VAL C C 2.990 3.265 -6.211 1.00 . A A . 4 VAL C 1 1
15 2562 1 1 4 VAL CA C 2.556 2.588 -4.900 1.00 . A A . 4 VAL CA 1 1
15 2563 1 1 4 VAL CB C 3.651 2.649 -3.822 1.00 . A A . 4 VAL CB 1 1
15 2564 1 1 4 VAL CG1 C 4.784 1.680 -4.165 1.00 . A A . 4 VAL CG1 1 1
15 2565 1 1 4 VAL CG2 C 4.211 4.071 -3.723 1.00 . A A . 4 VAL CG2 1 1
15 2566 1 1 4 VAL H H 3.014 0.596 -5.589 1.00 . A A . 4 VAL H 1 1
15 2567 1 1 4 VAL HA H 1.653 3.045 -4.529 1.00 . A A . 4 VAL HA 1 1
15 2568 1 1 4 VAL HB H 3.223 2.368 -2.870 1.00 . A A . 4 VAL HB 1 1
15 2569 1 1 4 VAL HG11 H 5.730 2.144 -3.944 1.00 . A A . 4 VAL HG11 1 1
15 2570 1 1 4 VAL HG12 H 4.741 1.432 -5.215 1.00 . A A . 4 VAL HG12 1 1
15 2571 1 1 4 VAL HG13 H 4.680 0.780 -3.577 1.00 . A A . 4 VAL HG13 1 1
15 2572 1 1 4 VAL HG21 H 4.888 4.134 -2.884 1.00 . A A . 4 VAL HG21 1 1
15 2573 1 1 4 VAL HG22 H 3.399 4.770 -3.585 1.00 . A A . 4 VAL HG22 1 1
15 2574 1 1 4 VAL HG23 H 4.741 4.312 -4.632 1.00 . A A . 4 VAL HG23 1 1
15 2575 1 1 4 VAL N N 2.327 1.130 -5.139 1.00 . A A . 4 VAL N 1 1
15 2576 1 1 4 VAL O O 3.236 2.605 -7.201 1.00 . A A . 4 VAL O 1 1
15 2577 1 1 5 VAL C C 4.647 6.212 -7.290 1.00 . A A . 5 VAL C 1 1
15 2578 1 1 5 VAL CA C 3.452 5.268 -7.497 1.00 . A A . 5 VAL CA 1 1
15 2579 1 1 5 VAL CB C 2.199 6.044 -7.910 1.00 . A A . 5 VAL CB 1 1
15 2580 1 1 5 VAL CG1 C 2.493 6.885 -9.155 1.00 . A A . 5 VAL CG1 1 1
15 2581 1 1 5 VAL CG2 C 1.077 5.054 -8.226 1.00 . A A . 5 VAL CG2 1 1
15 2582 1 1 5 VAL H H 2.843 5.092 -5.437 1.00 . A A . 5 VAL H 1 1
15 2583 1 1 5 VAL HA H 3.685 4.549 -8.251 1.00 . A A . 5 VAL HA 1 1
15 2584 1 1 5 VAL HB H 1.891 6.690 -7.101 1.00 . A A . 5 VAL HB 1 1
15 2585 1 1 5 VAL HG11 H 2.856 6.245 -9.946 1.00 . A A . 5 VAL HG11 1 1
15 2586 1 1 5 VAL HG12 H 3.243 7.626 -8.918 1.00 . A A . 5 VAL HG12 1 1
15 2587 1 1 5 VAL HG13 H 1.589 7.380 -9.477 1.00 . A A . 5 VAL HG13 1 1
15 2588 1 1 5 VAL HG21 H 0.137 5.583 -8.282 1.00 . A A . 5 VAL HG21 1 1
15 2589 1 1 5 VAL HG22 H 1.025 4.308 -7.446 1.00 . A A . 5 VAL HG22 1 1
15 2590 1 1 5 VAL HG23 H 1.277 4.572 -9.172 1.00 . A A . 5 VAL HG23 1 1
15 2591 1 1 5 VAL N N 3.062 4.572 -6.235 1.00 . A A . 5 VAL N 1 1
15 2592 1 1 5 VAL O O 5.785 5.861 -7.543 1.00 . A A . 5 VAL O 1 1
15 2593 1 1 6 ARG C C 6.332 8.047 -5.431 1.00 . A A . 6 ARG C 1 1
15 2594 1 1 6 ARG CA C 5.509 8.392 -6.667 1.00 . A A . 6 ARG CA 1 1
15 2595 1 1 6 ARG CB C 4.817 9.748 -6.501 1.00 . A A . 6 ARG CB 1 1
15 2596 1 1 6 ARG CD C 5.410 12.132 -6.059 1.00 . A A . 6 ARG CD 1 1
15 2597 1 1 6 ARG CG C 5.803 10.871 -6.824 1.00 . A A . 6 ARG CG 1 1
15 2598 1 1 6 ARG CZ C 4.508 14.062 -7.194 1.00 . A A . 6 ARG CZ 1 1
15 2599 1 1 6 ARG H H 3.473 7.672 -6.668 1.00 . A A . 6 ARG H 1 1
15 2600 1 1 6 ARG HA H 6.140 8.409 -7.538 1.00 . A A . 6 ARG HA 1 1
15 2601 1 1 6 ARG HB2 H 3.974 9.806 -7.173 1.00 . A A . 6 ARG HB2 1 1
15 2602 1 1 6 ARG HB3 H 4.473 9.855 -5.485 1.00 . A A . 6 ARG HB3 1 1
15 2603 1 1 6 ARG HD2 H 4.982 11.870 -5.099 1.00 . A A . 6 ARG HD2 1 1
15 2604 1 1 6 ARG HD3 H 6.265 12.774 -5.930 1.00 . A A . 6 ARG HD3 1 1
15 2605 1 1 6 ARG HE H 3.647 12.280 -7.283 1.00 . A A . 6 ARG HE 1 1
15 2606 1 1 6 ARG HG2 H 6.798 10.575 -6.533 1.00 . A A . 6 ARG HG2 1 1
15 2607 1 1 6 ARG HG3 H 5.783 11.077 -7.883 1.00 . A A . 6 ARG HG3 1 1
15 2608 1 1 6 ARG HH11 H 6.479 13.968 -7.544 1.00 . A A . 6 ARG HH11 1 1
15 2609 1 1 6 ARG HH12 H 5.760 15.533 -7.721 1.00 . A A . 6 ARG HH12 1 1
15 2610 1 1 6 ARG HH21 H 2.566 14.445 -6.905 1.00 . A A . 6 ARG HH21 1 1
15 2611 1 1 6 ARG HH22 H 3.539 15.804 -7.358 1.00 . A A . 6 ARG HH22 1 1
15 2612 1 1 6 ARG N N 4.395 7.412 -6.849 1.00 . A A . 6 ARG N 1 1
15 2613 1 1 6 ARG NE N 4.397 12.795 -6.920 1.00 . A A . 6 ARG NE 1 1
15 2614 1 1 6 ARG NH1 N 5.673 14.561 -7.511 1.00 . A A . 6 ARG NH1 1 1
15 2615 1 1 6 ARG NH2 N 3.456 14.831 -7.149 1.00 . A A . 6 ARG NH2 1 1
15 2616 1 1 6 ARG O O 5.833 7.972 -4.325 1.00 . A A . 6 ARG O 1 1
15 2617 1 1 7 GLY C C 8.851 5.939 -4.766 1.00 . A A . 7 GLY C 1 1
15 2618 1 1 7 GLY CA C 8.507 7.403 -4.540 1.00 . A A . 7 GLY CA 1 1
15 2619 1 1 7 GLY H H 7.948 7.834 -6.559 1.00 . A A . 7 GLY H 1 1
15 2620 1 1 7 GLY HA2 H 9.405 8.009 -4.570 1.00 . A A . 7 GLY HA2 1 1
15 2621 1 1 7 GLY HA3 H 8.011 7.517 -3.590 1.00 . A A . 7 GLY HA3 1 1
15 2622 1 1 7 GLY N N 7.598 7.796 -5.645 1.00 . A A . 7 GLY N 1 1
15 2623 1 1 7 GLY O O 9.967 5.498 -4.579 1.00 . A A . 7 GLY O 1 1
15 2624 1 1 8 ASP C C 6.972 3.382 -6.504 1.00 . A A . 8 ASP C 1 1
15 2625 1 1 8 ASP CA C 8.074 3.772 -5.532 1.00 . A A . 8 ASP CA 1 1
15 2626 1 1 8 ASP CB C 7.951 3.025 -4.205 1.00 . A A . 8 ASP CB 1 1
15 2627 1 1 8 ASP CG C 9.325 2.970 -3.536 1.00 . A A . 8 ASP CG 1 1
15 2628 1 1 8 ASP H H 7.005 5.609 -5.403 1.00 . A A . 8 ASP H 1 1
15 2629 1 1 8 ASP HA H 9.045 3.609 -5.971 1.00 . A A . 8 ASP HA 1 1
15 2630 1 1 8 ASP HB2 H 7.253 3.541 -3.562 1.00 . A A . 8 ASP HB2 1 1
15 2631 1 1 8 ASP HB3 H 7.605 2.020 -4.389 1.00 . A A . 8 ASP HB3 1 1
15 2632 1 1 8 ASP N N 7.880 5.200 -5.219 1.00 . A A . 8 ASP N 1 1
15 2633 1 1 8 ASP O O 5.867 3.081 -6.108 1.00 . A A . 8 ASP O 1 1
15 2634 1 1 8 ASP OD1 O 10.173 2.243 -4.029 1.00 . A A . 8 ASP OD1 1 1
15 2635 1 1 8 ASP OD2 O 9.511 3.660 -2.548 1.00 . A A . 8 ASP OD2 1 1
15 2636 1 1 9 TYR C C 5.971 1.606 -8.860 1.00 . A A . 9 TYR C 1 1
15 2637 1 1 9 TYR CA C 6.178 3.112 -8.761 1.00 . A A . 9 TYR CA 1 1
15 2638 1 1 9 TYR CB C 6.690 3.673 -10.089 1.00 . A A . 9 TYR CB 1 1
15 2639 1 1 9 TYR CD1 C 5.299 5.720 -10.551 1.00 . A A . 9 TYR CD1 1 1
15 2640 1 1 9 TYR CD2 C 7.516 6.001 -9.613 1.00 . A A . 9 TYR CD2 1 1
15 2641 1 1 9 TYR CE1 C 5.116 7.108 -10.537 1.00 . A A . 9 TYR CE1 1 1
15 2642 1 1 9 TYR CE2 C 7.334 7.388 -9.600 1.00 . A A . 9 TYR CE2 1 1
15 2643 1 1 9 TYR CG C 6.499 5.168 -10.090 1.00 . A A . 9 TYR CG 1 1
15 2644 1 1 9 TYR CZ C 6.134 7.941 -10.061 1.00 . A A . 9 TYR CZ 1 1
15 2645 1 1 9 TYR H H 8.126 3.718 -8.065 1.00 . A A . 9 TYR H 1 1
15 2646 1 1 9 TYR HA H 5.258 3.604 -8.489 1.00 . A A . 9 TYR HA 1 1
15 2647 1 1 9 TYR HB2 H 7.739 3.440 -10.201 1.00 . A A . 9 TYR HB2 1 1
15 2648 1 1 9 TYR HB3 H 6.134 3.238 -10.905 1.00 . A A . 9 TYR HB3 1 1
15 2649 1 1 9 TYR HD1 H 4.515 5.076 -10.920 1.00 . A A . 9 TYR HD1 1 1
15 2650 1 1 9 TYR HD2 H 8.442 5.574 -9.259 1.00 . A A . 9 TYR HD2 1 1
15 2651 1 1 9 TYR HE1 H 4.188 7.534 -10.888 1.00 . A A . 9 TYR HE1 1 1
15 2652 1 1 9 TYR HE2 H 8.120 8.032 -9.230 1.00 . A A . 9 TYR HE2 1 1
15 2653 1 1 9 TYR HH H 6.270 9.660 -10.887 1.00 . A A . 9 TYR HH 1 1
15 2654 1 1 9 TYR N N 7.243 3.431 -7.770 1.00 . A A . 9 TYR N 1 1
15 2655 1 1 9 TYR O O 6.870 0.825 -8.621 1.00 . A A . 9 TYR O 1 1
15 2656 1 1 9 TYR OH O 5.956 9.310 -10.048 1.00 . A A . 9 TYR OH 1 1
15 2657 1 1 10 LEU C C 4.626 -0.738 -10.722 1.00 . A A . 10 LEU C 1 1
15 2658 1 1 10 LEU CA C 4.481 -0.255 -9.281 1.00 . A A . 10 LEU CA 1 1
15 2659 1 1 10 LEU CB C 3.029 -0.382 -8.815 1.00 . A A . 10 LEU CB 1 1
15 2660 1 1 10 LEU CD1 C 0.986 -0.534 -10.247 1.00 . A A . 10 LEU CD1 1 1
15 2661 1 1 10 LEU CD2 C 1.519 1.597 -9.063 1.00 . A A . 10 LEU CD2 1 1
15 2662 1 1 10 LEU CG C 2.113 0.384 -9.777 1.00 . A A . 10 LEU CG 1 1
15 2663 1 1 10 LEU H H 4.067 1.853 -9.362 1.00 . A A . 10 LEU H 1 1
15 2664 1 1 10 LEU HA H 5.129 -0.811 -8.627 1.00 . A A . 10 LEU HA 1 1
15 2665 1 1 10 LEU HB2 H 2.748 -1.425 -8.798 1.00 . A A . 10 LEU HB2 1 1
15 2666 1 1 10 LEU HB3 H 2.934 0.032 -7.823 1.00 . A A . 10 LEU HB3 1 1
15 2667 1 1 10 LEU HD11 H 0.470 -0.939 -9.389 1.00 . A A . 10 LEU HD11 1 1
15 2668 1 1 10 LEU HD12 H 1.399 -1.343 -10.832 1.00 . A A . 10 LEU HD12 1 1
15 2669 1 1 10 LEU HD13 H 0.291 0.029 -10.850 1.00 . A A . 10 LEU HD13 1 1
15 2670 1 1 10 LEU HD21 H 2.158 2.454 -9.217 1.00 . A A . 10 LEU HD21 1 1
15 2671 1 1 10 LEU HD22 H 1.439 1.392 -8.007 1.00 . A A . 10 LEU HD22 1 1
15 2672 1 1 10 LEU HD23 H 0.538 1.804 -9.465 1.00 . A A . 10 LEU HD23 1 1
15 2673 1 1 10 LEU HG H 2.685 0.713 -10.633 1.00 . A A . 10 LEU HG 1 1
15 2674 1 1 10 LEU N N 4.776 1.199 -9.188 1.00 . A A . 10 LEU N 1 1
15 2675 1 1 10 LEU O O 3.789 -1.456 -11.233 1.00 . A A . 10 LEU O 1 1
15 2676 1 1 11 ASP C C 6.678 -2.126 -12.736 1.00 . A A . 11 ASP C 1 1
15 2677 1 1 11 ASP CA C 5.892 -0.820 -12.775 1.00 . A A . 11 ASP CA 1 1
15 2678 1 1 11 ASP CB C 6.689 0.296 -13.459 1.00 . A A . 11 ASP CB 1 1
15 2679 1 1 11 ASP CG C 6.992 -0.106 -14.902 1.00 . A A . 11 ASP CG 1 1
15 2680 1 1 11 ASP H H 6.359 0.203 -10.939 1.00 . A A . 11 ASP H 1 1
15 2681 1 1 11 ASP HA H 4.943 -0.963 -13.270 1.00 . A A . 11 ASP HA 1 1
15 2682 1 1 11 ASP HB2 H 6.106 1.206 -13.454 1.00 . A A . 11 ASP HB2 1 1
15 2683 1 1 11 ASP HB3 H 7.616 0.459 -12.929 1.00 . A A . 11 ASP HB3 1 1
15 2684 1 1 11 ASP N N 5.690 -0.365 -11.375 1.00 . A A . 11 ASP N 1 1
15 2685 1 1 11 ASP O O 7.783 -2.227 -13.232 1.00 . A A . 11 ASP O 1 1
15 2686 1 1 11 ASP OD1 O 6.075 -0.546 -15.578 1.00 . A A . 11 ASP OD1 1 1
15 2687 1 1 11 ASP OD2 O 8.134 0.032 -15.308 1.00 . A A . 11 ASP OD2 1 1
15 2688 1 1 12 CYS C C 6.303 -5.384 -13.095 1.00 . A A . 12 CYS C 1 1
15 2689 1 1 12 CYS CA C 6.782 -4.435 -11.992 1.00 . A A . 12 CYS CA 1 1
15 2690 1 1 12 CYS CB C 6.367 -4.952 -10.610 1.00 . A A . 12 CYS CB 1 1
15 2691 1 1 12 CYS H H 5.218 -2.992 -11.713 1.00 . A A . 12 CYS H 1 1
15 2692 1 1 12 CYS HA H 7.850 -4.312 -12.035 1.00 . A A . 12 CYS HA 1 1
15 2693 1 1 12 CYS HB2 H 5.297 -5.104 -10.591 1.00 . A A . 12 CYS HB2 1 1
15 2694 1 1 12 CYS HB3 H 6.865 -5.889 -10.410 1.00 . A A . 12 CYS HB3 1 1
15 2695 1 1 12 CYS N N 6.103 -3.120 -12.117 1.00 . A A . 12 CYS N 1 1
15 2696 1 1 12 CYS O O 6.192 -6.575 -12.886 1.00 . A A . 12 CYS O 1 1
15 2697 1 1 12 CYS SG S 6.825 -3.740 -9.337 1.00 . A A . 12 CYS SG 1 1
15 2698 1 1 13 NH2 HN1 H 6.100 -3.940 -14.441 1.00 . A A . 13 NH2 HN1 1 1
15 2699 1 1 13 NH2 HN2 H 5.703 -5.498 -14.984 1.00 . A A . 13 NH2 HN2 1 1
15 2700 1 1 13 NH2 N N 6.012 -4.900 -14.271 1.00 . A A . 13 NH2 N 1 1
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