NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
|
|
420241 |
2efz   |
15195 | cing | 4-filtered-FRED | STAR | entry | full | 75 |
data_FRED_restraints_with_modified_coordinates_PDB_code_2efz
# This FRED archive file contains, for PDB entry <2efz>:
#
# - 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, W Vranken, C Penkett, J Lin, CF Schulte, G Vuister, G Vriend,
# JL Markley, EL Ulrich. BioMagResBank database `NMR Restraints Grid` with
# curated sets of experimental NMR restraints for over 4,000 protein and nucleic
# acid PDB entries. (in preparation)
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_2efz
_Assembly.Sf_category assembly
_Assembly.Entry_ID 1
_Assembly.ID 1
_Assembly.Name 2efz
_Assembly.Number_of_components 1
_Assembly.Organic_ligands .
_Assembly.Metal_ions .
_Assembly.Paramagnetic .
_Assembly.Thiol_state "all disulfide bound"
_Assembly.Molecular_mass 1709.86
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 $M_conotoxin_Mr3_4 A . 1 1
stop_
save_
save_M_conotoxin_Mr3_4
_Entity.Sf_category entity
_Entity.Entry_ID 1
_Entity.ID 1
_Entity.Name "M conotoxin Mr3 4"
_Entity.Type polymer
_Entity.Polymer_type polypeptide(L)
_Entity.Polymer_seq_one_letter_code VCCPFGGCHELCYCCD
_Entity.Number_of_monomers 16
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 VAL . 1 1
2 CYS . 1 1
3 CYS . 1 1
4 PRO . 1 1
5 PHE . 1 1
6 GLY . 1 1
7 GLY . 1 1
8 CYS . 1 1
9 HIS . 1 1
10 GLU . 1 1
11 LEU . 1 1
12 CYS . 1 1
13 TYR . 1 1
14 CYS . 1 1
15 CYS . 1 1
16 ASP . 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
VAL 1 1 1 1
CYS 2 2 1 1
CYS 3 3 1 1
PRO 4 4 1 1
PHE 5 5 1 1
GLY 6 6 1 1
GLY 7 7 1 1
CYS 8 8 1 1
HIS 9 9 1 1
GLU 10 10 1 1
LEU 11 11 1 1
CYS 12 12 1 1
TYR 13 13 1 1
CYS 14 14 1 1
CYS 15 15 1 1
ASP 16 16 1 1
stop_
save_
save_DYANA/DIANA_distance_constraints_2_1
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID 1
_Distance_constraint_list.ID 1
_Distance_constraint_list.Constraint_type NOE
_Distance_constraint_list.Constraint_file_ID .
_Distance_constraint_list.Block_ID .
loop_
_Dist_constraint_tree.Constraint_ID
_Dist_constraint_tree.Node_ID
_Dist_constraint_tree.Down_node_ID
_Dist_constraint_tree.Right_node_ID
_Dist_constraint_tree.Logic_operation
_Dist_constraint_tree.Entry_ID
_Dist_constraint_tree.Distance_constraint_list_ID
1 1 . . . 1 1
2 1 . . . 1 1
3 1 . . . 1 1
4 1 . . . 1 1
5 1 . . . 1 1
6 1 . . . 1 1
7 1 . . . 1 1
8 1 . . . 1 1
9 1 . . . 1 1
10 1 . . . 1 1
11 1 . . . 1 1
12 1 . . . 1 1
13 1 . . . 1 1
14 1 . . . 1 1
15 1 . . . 1 1
16 1 . . . 1 1
17 1 . . . 1 1
18 1 . . . 1 1
19 1 . . . 1 1
20 1 . . . 1 1
21 1 . . . 1 1
22 1 . . . 1 1
23 1 . . . 1 1
24 1 . . . 1 1
25 1 . . . 1 1
26 1 . . . 1 1
27 1 . . . 1 1
28 1 . . . 1 1
29 1 . . . 1 1
30 1 . . . 1 1
31 1 . . . 1 1
32 1 . . . 1 1
33 1 . . . 1 1
34 1 . . . 1 1
35 1 . . . 1 1
36 1 . . . 1 1
37 1 . . . 1 1
38 1 . . . 1 1
39 1 . . . 1 1
40 1 . . . 1 1
41 1 . . . 1 1
42 1 . . . 1 1
43 1 . . . 1 1
44 1 . . . 1 1
45 1 . . . 1 1
46 1 . . . 1 1
47 1 . . . 1 1
48 1 . . . 1 1
49 1 . . . 1 1
50 1 . . . 1 1
51 1 . . . 1 1
52 1 . . . 1 1
53 1 . . . 1 1
54 1 . . . 1 1
55 1 . . . 1 1
56 1 . . . 1 1
57 1 . . . 1 1
58 1 . . . 1 1
59 1 . . . 1 1
60 1 . . . 1 1
61 1 . . . 1 1
62 1 . . . 1 1
63 1 . . . 1 1
64 1 . . . 1 1
65 1 . . . 1 1
66 1 . . . 1 1
67 1 . . . 1 1
68 1 . . . 1 1
69 1 . . . 1 1
stop_
loop_
_Dist_constraint.Tree_node_member_constraint_ID
_Dist_constraint.Tree_node_member_node_ID
_Dist_constraint.Constraint_tree_node_member_ID
_Dist_constraint.Entity_assembly_ID
_Dist_constraint.Entity_ID
_Dist_constraint.Comp_index_ID
_Dist_constraint.Comp_ID
_Dist_constraint.Atom_ID
_Dist_constraint.Auth_asym_ID
_Dist_constraint.Auth_seq_ID
_Dist_constraint.Auth_comp_ID
_Dist_constraint.Auth_atom_ID
_Dist_constraint.Entry_ID
_Dist_constraint.Distance_constraint_list_ID
1 1 1 1 1 1 VAL HA . 1 VAL HA 1 1
1 1 2 1 1 2 CYS H . 2 CYSS HN 1 1
2 1 1 1 1 1 VAL HB . 1 VAL HB 1 1
2 1 2 1 1 2 CYS H . 2 CYSS HN 1 1
3 1 1 1 1 1 VAL QG . 1 VAL QQG 1 1
3 1 2 1 1 2 CYS H . 2 CYSS HN 1 1
4 1 1 1 1 2 CYS H . 2 CYSS HN 1 1
4 1 2 1 1 2 CYS HB3 . 2 CYSS HB3 1 1
5 1 1 1 1 2 CYS HA . 2 CYSS HA 1 1
5 1 2 1 1 2 CYS HB3 . 2 CYSS HB3 1 1
6 1 1 1 1 2 CYS HA . 2 CYSS HA 1 1
6 1 2 1 1 3 CYS H . 3 CYSS HN 1 1
7 1 1 1 1 2 CYS HA . 2 CYSS HA 1 1
7 1 2 1 1 14 CYS H . 14 CYSS HN 1 1
8 1 1 1 1 2 CYS HB3 . 2 CYSS HB3 1 1
8 1 2 1 1 3 CYS H . 3 CYSS HN 1 1
9 1 1 1 1 2 CYS HB3 . 2 CYSS HB3 1 1
9 1 2 1 1 15 CYS H . 15 CYSS HN 1 1
10 1 1 1 1 3 CYS H . 3 CYSS HN 1 1
10 1 2 1 1 3 CYS HB3 . 3 CYSS HB3 1 1
11 1 1 1 1 3 CYS H . 3 CYSS HN 1 1
11 1 2 1 1 14 CYS H . 14 CYSS HN 1 1
12 1 1 1 1 3 CYS H . 3 CYSS HN 1 1
12 1 2 1 1 15 CYS HA . 15 CYSS HA 1 1
13 1 1 1 1 3 CYS HA . 3 CYSS HA 1 1
13 1 2 1 1 4 PRO HG3 . 4 PRO HG3 1 1
14 1 1 1 1 4 PRO HA . 4 PRO HA 1 1
14 1 2 1 1 4 PRO HG3 . 4 PRO HG3 1 1
15 1 1 1 1 4 PRO HA . 4 PRO HA 1 1
15 1 2 1 1 5 PHE H . 5 PHE HN 1 1
16 1 1 1 1 4 PRO HA . 4 PRO HA 1 1
16 1 2 1 1 16 ASP HB3 . 16 ASP HB3 1 1
17 1 1 1 1 4 PRO HB3 . 4 PRO HB3 1 1
17 1 2 1 1 4 PRO HD3 . 4 PRO HD3 1 1
18 1 1 1 1 4 PRO HB3 . 4 PRO HB3 1 1
18 1 2 1 1 5 PHE H . 5 PHE HN 1 1
19 1 1 1 1 4 PRO HB3 . 4 PRO HB3 1 1
19 1 2 1 1 7 GLY H . 7 GLY HN 1 1
20 1 1 1 1 4 PRO HG3 . 4 PRO HG3 1 1
20 1 2 1 1 7 GLY H . 7 GLY HN 1 1
21 1 1 1 1 4 PRO HG3 . 4 PRO HG3 1 1
21 1 2 1 1 7 GLY HA3 . 7 GLY HA2 1 1
22 1 1 1 1 5 PHE H . 5 PHE HN 1 1
22 1 2 1 1 5 PHE QD . 5 PHE QD 1 1
23 1 1 1 1 5 PHE HA . 5 PHE HA 1 1
23 1 2 1 1 6 GLY H . 6 GLY HN 1 1
24 1 1 1 1 5 PHE HA . 5 PHE HA 1 1
24 1 2 1 1 7 GLY H . 7 GLY HN 1 1
25 1 1 1 1 5 PHE QD . 5 PHE QD 1 1
25 1 2 1 1 6 GLY H . 6 GLY HN 1 1
26 1 1 1 1 6 GLY H . 6 GLY HN 1 1
26 1 2 1 1 6 GLY HA3 . 6 GLY HA2 1 1
27 1 1 1 1 6 GLY HA2 . 6 GLY HA1 1 1
27 1 2 1 1 7 GLY H . 7 GLY HN 1 1
28 1 1 1 1 6 GLY HA3 . 6 GLY HA2 1 1
28 1 2 1 1 7 GLY H . 7 GLY HN 1 1
29 1 1 1 1 7 GLY H . 7 GLY HN 1 1
29 1 2 1 1 7 GLY HA3 . 7 GLY HA2 1 1
30 1 1 1 1 7 GLY HA2 . 7 GLY HA1 1 1
30 1 2 1 1 8 CYS H . 8 CYSS HN 1 1
31 1 1 1 1 7 GLY HA3 . 7 GLY HA2 1 1
31 1 2 1 1 8 CYS H . 8 CYSS HN 1 1
32 1 1 1 1 8 CYS H . 8 CYSS HN 1 1
32 1 2 1 1 9 HIS H . 9 HIS HN 1 1
33 1 1 1 1 9 HIS H . 9 HIS HN 1 1
33 1 2 1 1 9 HIS HB3 . 9 HIS HB3 1 1
34 1 1 1 1 9 HIS H . 9 HIS HN 1 1
34 1 2 1 1 11 LEU H . 11 LEU HN 1 1
35 1 1 1 1 9 HIS HB3 . 9 HIS HB3 1 1
35 1 2 1 1 10 GLU H . 10 GLU HN 1 1
36 1 1 1 1 10 GLU HA . 10 GLU HA 1 1
36 1 2 1 1 11 LEU H . 11 LEU HN 1 1
37 1 1 1 1 10 GLU HA . 10 GLU HA 1 1
37 1 2 1 1 12 CYS H . 12 CYSS HN 1 1
38 1 1 1 1 11 LEU H . 11 LEU HN 1 1
38 1 2 1 1 11 LEU HA . 11 LEU HA 1 1
39 1 1 1 1 11 LEU H . 11 LEU HN 1 1
39 1 2 1 1 11 LEU HB3 . 11 LEU HB3 1 1
40 1 1 1 1 11 LEU H . 11 LEU HN 1 1
40 1 2 1 1 11 LEU HG . 11 LEU HG 1 1
41 1 1 1 1 11 LEU H . 11 LEU HN 1 1
41 1 2 1 1 12 CYS H . 12 CYSS HN 1 1
42 1 1 1 1 11 LEU HA . 11 LEU HA 1 1
42 1 2 1 1 11 LEU HB3 . 11 LEU HB3 1 1
43 1 1 1 1 11 LEU HA . 11 LEU HA 1 1
43 1 2 1 1 11 LEU HG . 11 LEU HG 1 1
44 1 1 1 1 11 LEU HA . 11 LEU HA 1 1
44 1 2 1 1 12 CYS H . 12 CYSS HN 1 1
45 1 1 1 1 11 LEU HB3 . 11 LEU HB3 1 1
45 1 2 1 1 12 CYS H . 12 CYSS HN 1 1
46 1 1 1 1 12 CYS H . 12 CYSS HN 1 1
46 1 2 1 1 12 CYS HB3 . 12 CYSS HB3 1 1
47 1 1 1 1 12 CYS H . 12 CYSS HN 1 1
47 1 2 1 1 13 TYR H . 13 TYR HN 1 1
48 1 1 1 1 12 CYS HA . 12 CYSS HA 1 1
48 1 2 1 1 12 CYS HB3 . 12 CYSS HB3 1 1
49 1 1 1 1 12 CYS HA . 12 CYSS HA 1 1
49 1 2 1 1 13 TYR H . 13 TYR HN 1 1
50 1 1 1 1 12 CYS HA . 12 CYSS HA 1 1
50 1 2 1 1 14 CYS H . 14 CYSS HN 1 1
51 1 1 1 1 13 TYR H . 13 TYR HN 1 1
51 1 2 1 1 13 TYR HB3 . 13 TYR HB3 1 1
52 1 1 1 1 13 TYR H . 13 TYR HN 1 1
52 1 2 1 1 14 CYS H . 14 CYSS HN 1 1
53 1 1 1 1 13 TYR HA . 13 TYR HA 1 1
53 1 2 1 1 14 CYS H . 14 CYSS HN 1 1
54 1 1 1 1 13 TYR HB3 . 13 TYR HB3 1 1
54 1 2 1 1 14 CYS H . 14 CYSS HN 1 1
55 1 1 1 1 14 CYS H . 14 CYSS HN 1 1
55 1 2 1 1 14 CYS HB3 . 14 CYSS HB3 1 1
56 1 1 1 1 14 CYS H . 14 CYSS HN 1 1
56 1 2 1 1 15 CYS H . 15 CYSS HN 1 1
57 1 1 1 1 14 CYS HA . 14 CYSS HA 1 1
57 1 2 1 1 15 CYS H . 15 CYSS HN 1 1
58 1 1 1 1 14 CYS HB3 . 14 CYSS HB3 1 1
58 1 2 1 1 15 CYS H . 15 CYSS HN 1 1
59 1 1 1 1 15 CYS H . 15 CYSS HN 1 1
59 1 2 1 1 15 CYS HB3 . 15 CYSS HB3 1 1
60 1 1 1 1 15 CYS HA . 15 CYSS HA 1 1
60 1 2 1 1 16 ASP H . 16 ASP HN 1 1
61 1 1 1 1 16 ASP H . 16 ASP HN 1 1
61 1 2 1 1 16 ASP HB3 . 16 ASP HB3 1 1
62 1 1 1 1 16 ASP HA . 16 ASP HA 1 1
62 1 2 1 1 16 ASP HB3 . 16 ASP HB3 1 1
63 1 1 1 1 2 CYS HB3 . 2 CYSS HB3 1 1
63 1 2 1 1 14 CYS HB3 . 14 CYSS HB3 1 1
64 1 1 1 1 2 CYS HB3 . 2 CYSS HB3 1 1
64 1 2 1 1 15 CYS HA . 15 CYSS HA 1 1
65 1 1 1 1 3 CYS HA . 3 CYSS HA 1 1
65 1 2 1 1 4 PRO HD3 . 4 PRO HD3 1 1
66 1 1 1 1 3 CYS HA . 3 CYSS HA 1 1
66 1 2 1 1 15 CYS HA . 15 CYSS HA 1 1
67 1 1 1 1 4 PRO HA . 4 PRO HA 1 1
67 1 2 1 1 4 PRO HD3 . 4 PRO HD3 1 1
68 1 1 1 1 5 PHE QE . 5 PHE QE 1 1
68 1 2 1 1 13 TYR HA . 13 TYR HA 1 1
69 1 1 1 1 14 CYS HB3 . 14 CYSS HB3 1 1
69 1 2 1 1 15 CYS HA . 15 CYSS HA 1 1
stop_
loop_
_Dist_constraint_value.Constraint_ID
_Dist_constraint_value.Tree_node_ID
_Dist_constraint_value.Source_experiment_ID
_Dist_constraint_value.Spectral_peak_ID
_Dist_constraint_value.Intensity_val
_Dist_constraint_value.Intensity_lower_val_err
_Dist_constraint_value.Intensity_upper_val_err
_Dist_constraint_value.Distance_val
_Dist_constraint_value.Distance_lower_bound_val
_Dist_constraint_value.Distance_upper_bound_val
_Dist_constraint_value.Entry_ID
_Dist_constraint_value.Distance_constraint_list_ID
1 1 . . . . . . . 2.77 1 1
2 1 . . . . . . . 3.52 1 1
3 1 . . . . . . . 7.62 1 1
4 1 . . . . . . . 2.71 1 1
5 1 . . . . . . . 2.9 1 1
6 1 . . . . . . . 2.77 1 1
7 1 . . . . . . . 4.8 1 1
8 1 . . . . . . . 3.05 1 1
9 1 . . . . . . . 5.5 1 1
10 1 . . . . . . . 2.99 1 1
11 1 . . . . . . . 4.8 1 1
12 1 . . . . . . . 3.24 1 1
13 1 . . . . . . . 3.42 1 1
14 1 . . . . . . . 4.14 1 1
15 1 . . . . . . . 2.77 1 1
16 1 . . . . . . . 3.86 1 1
17 1 . . . . . . . 2.4 1 1
18 1 . . . . . . . 3.42 1 1
19 1 . . . . . . . 4.48 1 1
20 1 . . . . . . . 5.0 1 1
21 1 . . . . . . . 3.8 1 1
22 1 . . . . . . . 4.52 1 1
23 1 . . . . . . . 3.8 1 1
24 1 . . . . . . . 3.86 1 1
25 1 . . . . . . . 7.62 1 1
26 1 . . . . . . . 2.87 1 1
27 1 . . . . . . . 3.67 1 1
28 1 . . . . . . . 3.67 1 1
29 1 . . . . . . . 2.93 1 1
30 1 . . . . . . . 3.55 1 1
31 1 . . . . . . . 4.14 1 1
32 1 . . . . . . . 4.8 1 1
33 1 . . . . . . . 3.73 1 1
34 1 . . . . . . . 4.1 1 1
35 1 . . . . . . . 3.27 1 1
36 1 . . . . . . . 3.7 1 1
37 1 . . . . . . . 3.8 1 1
38 1 . . . . . . . 3.0 1 1
39 1 . . . . . . . 2.9 1 1
40 1 . . . . . . . 4.32 1 1
41 1 . . . . . . . 3.39 1 1
42 1 . . . . . . . 3.02 1 1
43 1 . . . . . . . 2.62 1 1
44 1 . . . . . . . 3.8 1 1
45 1 . . . . . . . 5.31 1 1
46 1 . . . . . . . 2.8 1 1
47 1 . . . . . . . 5.22 1 1
48 1 . . . . . . . 2.62 1 1
49 1 . . . . . . . 2.68 1 1
50 1 . . . . . . . 4.01 1 1
51 1 . . . . . . . 3.14 1 1
52 1 . . . . . . . 3.05 1 1
53 1 . . . . . . . 3.92 1 1
54 1 . . . . . . . 3.42 1 1
55 1 . . . . . . . 3.27 1 1
56 1 . . . . . . . 4.0 1 1
57 1 . . . . . . . 3.9 1 1
58 1 . . . . . . . 3.4 1 1
59 1 . . . . . . . 3.3 1 1
60 1 . . . . . . . 2.8 1 1
61 1 . . . . . . . 2.74 1 1
62 1 . . . . . . . 2.96 1 1
63 1 . . . . . . . 5.25 1 1
64 1 . . . . . . . 3.7 1 1
65 1 . . . . . . . 2.9 1 1
66 1 . . . . . . . 4.88 1 1
67 1 . . . . . . . 3.92 1 1
68 1 . . . . . . . 7.62 1 1
69 1 . . . . . . . 3.02 1 1
stop_
save_
save_DYANA/DIANA_distance_constraints_3_1
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID 1
_Distance_constraint_list.ID 2
_Distance_constraint_list.Constraint_type "hydrogen bond"
_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 2
2 1 . . . 1 2
3 1 . . . 1 2
4 1 . . . 1 2
5 1 . . . 1 2
6 1 . . . 1 2
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 4 PRO O . 4 PRO O 1 2
1 1 2 1 1 8 CYS H . 8 CYSS HN 1 2
2 1 1 1 1 4 PRO O . 4 PRO O 1 2
2 1 2 1 1 8 CYS N . 8 CYSS N 1 2
3 1 1 1 1 9 HIS O . 9 HIS O 1 2
3 1 2 1 1 12 CYS H . 12 CYSS HN 1 2
4 1 1 1 1 9 HIS O . 9 HIS O 1 2
4 1 2 1 1 12 CYS N . 12 CYSS N 1 2
5 1 1 1 1 5 PHE O . 5 PHE O 1 2
5 1 2 1 1 7 GLY H . 7 GLY HN 1 2
6 1 1 1 1 5 PHE O . 5 PHE O 1 2
6 1 2 1 1 7 GLY N . 7 GLY N 1 2
stop_
loop_
_Dist_constraint_value.Constraint_ID
_Dist_constraint_value.Tree_node_ID
_Dist_constraint_value.Source_experiment_ID
_Dist_constraint_value.Spectral_peak_ID
_Dist_constraint_value.Intensity_val
_Dist_constraint_value.Intensity_lower_val_err
_Dist_constraint_value.Intensity_upper_val_err
_Dist_constraint_value.Distance_val
_Dist_constraint_value.Distance_lower_bound_val
_Dist_constraint_value.Distance_upper_bound_val
_Dist_constraint_value.Entry_ID
_Dist_constraint_value.Distance_constraint_list_ID
1 1 . . . . . . . 2.2 1 2
2 1 . . . . . . . 3.2 1 2
3 1 . . . . . . . 2.2 1 2
4 1 . . . . . . . 3.2 1 2
5 1 . . . . . . . 2.2 1 2
6 1 . . . . . . . 3.2 1 2
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 VAL C C 4.888 1.930 5.580 1.00 . A A . 1 VAL C 1 1
1 2 1 1 1 VAL CA C 5.579 2.625 6.755 1.00 . A A . 1 VAL CA 1 1
1 3 1 1 1 VAL CB C 4.586 3.387 7.653 1.00 . A A . 1 VAL CB 1 1
1 4 1 1 1 VAL CG1 C 5.297 3.943 8.893 1.00 . A A . 1 VAL CG1 1 1
1 5 1 1 1 VAL CG2 C 3.881 4.531 6.909 1.00 . A A . 1 VAL CG2 1 1
1 6 1 1 1 VAL H1 H 6.583 3.603 5.218 1.00 . A A . 1 VAL H1 1 1
1 7 1 1 1 VAL HA H 6.082 1.862 7.350 1.00 . A A . 1 VAL HA 1 1
1 8 1 1 1 VAL HB H 3.823 2.688 7.997 1.00 . A A . 1 VAL HB 1 1
1 9 1 1 1 VAL HG11 H 6.047 4.680 8.605 1.00 . A A . 1 VAL HG11 1 1
1 10 1 1 1 VAL HG12 H 4.569 4.418 9.552 1.00 . A A . 1 VAL HG12 1 1
1 11 1 1 1 VAL HG13 H 5.783 3.131 9.435 1.00 . A A . 1 VAL HG13 1 1
1 12 1 1 1 VAL HG21 H 3.343 4.146 6.042 1.00 . A A . 1 VAL HG21 1 1
1 13 1 1 1 VAL HG22 H 3.162 5.010 7.575 1.00 . A A . 1 VAL HG22 1 1
1 14 1 1 1 VAL HG23 H 4.603 5.276 6.578 1.00 . A A . 1 VAL HG23 1 1
1 15 1 1 1 VAL N N 6.589 3.525 6.229 1.00 . A A . 1 VAL N 1 1
1 16 1 1 1 VAL O O 5.113 2.299 4.427 1.00 . A A . 1 VAL O 1 1
1 17 1 1 2 CYS C C 2.112 1.114 4.416 1.00 . A A . 2 CYS C 1 1
1 18 1 1 2 CYS CA C 3.289 0.238 4.836 1.00 . A A . 2 CYS CA 1 1
1 19 1 1 2 CYS CB C 2.774 -1.102 5.363 1.00 . A A . 2 CYS CB 1 1
1 20 1 1 2 CYS H H 3.887 0.689 6.830 1.00 . A A . 2 CYS H 1 1
1 21 1 1 2 CYS HA H 3.937 0.061 3.978 1.00 . A A . 2 CYS HA 1 1
1 22 1 1 2 CYS HB3 H 1.820 -0.950 5.869 1.00 . A A . 2 CYS HB3 1 1
1 23 1 1 2 CYS N N 4.066 0.917 5.865 1.00 . A A . 2 CYS N 1 1
1 24 1 1 2 CYS O O 1.749 2.043 5.137 1.00 . A A . 2 CYS O 1 1
1 25 1 1 2 CYS SG S 2.551 -2.374 4.108 1.00 . A A . 2 CYS SG 1 1
1 26 1 1 3 CYS C C -0.905 0.692 3.456 1.00 . A A . 3 CYS C 1 1
1 27 1 1 3 CYS CA C 0.259 1.493 2.887 1.00 . A A . 3 CYS CA 1 1
1 28 1 1 3 CYS CB C 0.149 1.574 1.367 1.00 . A A . 3 CYS CB 1 1
1 29 1 1 3 CYS H H 1.724 -0.035 2.783 1.00 . A A . 3 CYS H 1 1
1 30 1 1 3 CYS HA H 0.272 2.520 3.245 1.00 . A A . 3 CYS HA 1 1
1 31 1 1 3 CYS HB3 H -0.822 2.007 1.155 1.00 . A A . 3 CYS HB3 1 1
1 32 1 1 3 CYS N N 1.479 0.806 3.284 1.00 . A A . 3 CYS N 1 1
1 33 1 1 3 CYS O O -1.004 -0.476 3.089 1.00 . A A . 3 CYS O 1 1
1 34 1 1 3 CYS SG S 1.373 2.645 0.587 1.00 . A A . 3 CYS SG 1 1
1 35 1 1 4 PRO C C -3.871 0.064 3.992 1.00 . A A . 4 PRO C 1 1
1 36 1 1 4 PRO CA C -2.822 0.527 5.005 1.00 . A A . 4 PRO CA 1 1
1 37 1 1 4 PRO CB C -3.429 1.512 6.008 1.00 . A A . 4 PRO CB 1 1
1 38 1 1 4 PRO CD C -1.766 2.660 4.730 1.00 . A A . 4 PRO CD 1 1
1 39 1 1 4 PRO CG C -3.121 2.880 5.400 1.00 . A A . 4 PRO CG 1 1
1 40 1 1 4 PRO HA H -2.418 -0.319 5.555 1.00 . A A . 4 PRO HA 1 1
1 41 1 1 4 PRO HB3 H -2.910 1.418 6.962 1.00 . A A . 4 PRO HB3 1 1
1 42 1 1 4 PRO HD3 H -0.961 2.847 5.443 1.00 . A A . 4 PRO HD3 1 1
1 43 1 1 4 PRO HG3 H -3.090 3.672 6.150 1.00 . A A . 4 PRO HG3 1 1
1 44 1 1 4 PRO N N -1.747 1.258 4.342 1.00 . A A . 4 PRO N 1 1
1 45 1 1 4 PRO O O -3.883 0.569 2.872 1.00 . A A . 4 PRO O 1 1
1 46 1 1 5 PHE C C -6.539 -0.008 2.858 1.00 . A A . 5 PHE C 1 1
1 47 1 1 5 PHE CA C -5.940 -1.226 3.569 1.00 . A A . 5 PHE CA 1 1
1 48 1 1 5 PHE CB C -7.042 -1.875 4.428 1.00 . A A . 5 PHE CB 1 1
1 49 1 1 5 PHE CD1 C -5.723 -4.056 4.664 1.00 . A A . 5 PHE CD1 1 1
1 50 1 1 5 PHE CD2 C -7.679 -3.682 6.059 1.00 . A A . 5 PHE CD2 1 1
1 51 1 1 5 PHE CE1 C -5.523 -5.301 5.286 1.00 . A A . 5 PHE CE1 1 1
1 52 1 1 5 PHE CE2 C -7.494 -4.938 6.663 1.00 . A A . 5 PHE CE2 1 1
1 53 1 1 5 PHE CG C -6.782 -3.224 5.074 1.00 . A A . 5 PHE CG 1 1
1 54 1 1 5 PHE CZ C -6.407 -5.744 6.284 1.00 . A A . 5 PHE CZ 1 1
1 55 1 1 5 PHE H H -4.581 -1.373 5.242 1.00 . A A . 5 PHE H 1 1
1 56 1 1 5 PHE HA H -5.616 -1.914 2.789 1.00 . A A . 5 PHE HA 1 1
1 57 1 1 5 PHE HB3 H -7.916 -2.007 3.787 1.00 . A A . 5 PHE HB3 1 1
1 58 1 1 5 PHE HD1 H -4.994 -3.717 3.946 1.00 . A A . 5 PHE HD1 1 1
1 59 1 1 5 PHE HD2 H -8.509 -3.064 6.370 1.00 . A A . 5 PHE HD2 1 1
1 60 1 1 5 PHE HE1 H -4.638 -5.877 5.055 1.00 . A A . 5 PHE HE1 1 1
1 61 1 1 5 PHE HE2 H -8.166 -5.270 7.441 1.00 . A A . 5 PHE HE2 1 1
1 62 1 1 5 PHE HZ H -6.222 -6.681 6.788 1.00 . A A . 5 PHE HZ 1 1
1 63 1 1 5 PHE N N -4.779 -0.845 4.384 1.00 . A A . 5 PHE N 1 1
1 64 1 1 5 PHE O O -6.655 0.014 1.634 1.00 . A A . 5 PHE O 1 1
1 65 1 1 6 GLY C C -6.215 3.136 2.576 1.00 . A A . 6 GLY C 1 1
1 66 1 1 6 GLY CA C -7.379 2.286 3.082 1.00 . A A . 6 GLY CA 1 1
1 67 1 1 6 GLY H H -6.716 0.969 4.616 1.00 . A A . 6 GLY H 1 1
1 68 1 1 6 GLY HA2 H -8.080 2.106 2.265 1.00 . A A . 6 GLY HA2 1 1
1 69 1 1 6 GLY HA3 H -7.901 2.827 3.871 1.00 . A A . 6 GLY HA3 1 1
1 70 1 1 6 GLY N N -6.893 1.027 3.625 1.00 . A A . 6 GLY N 1 1
1 71 1 1 6 GLY O O -6.000 4.242 3.066 1.00 . A A . 6 GLY O 1 1
1 72 1 1 7 GLY C C -3.610 2.529 -0.038 1.00 . A A . 7 GLY C 1 1
1 73 1 1 7 GLY CA C -4.263 3.292 1.111 1.00 . A A . 7 GLY CA 1 1
1 74 1 1 7 GLY H H -5.641 1.669 1.313 1.00 . A A . 7 GLY H 1 1
1 75 1 1 7 GLY HA2 H -4.531 4.292 0.766 1.00 . A A . 7 GLY HA2 1 1
1 76 1 1 7 GLY HA3 H -3.539 3.385 1.921 1.00 . A A . 7 GLY HA3 1 1
1 77 1 1 7 GLY N N -5.452 2.621 1.610 1.00 . A A . 7 GLY N 1 1
1 78 1 1 7 GLY O O -3.288 3.123 -1.067 1.00 . A A . 7 GLY O 1 1
1 79 1 1 8 CYS C C -3.305 0.486 -2.224 1.00 . A A . 8 CYS C 1 1
1 80 1 1 8 CYS CA C -2.662 0.415 -0.838 1.00 . A A . 8 CYS CA 1 1
1 81 1 1 8 CYS CB C -2.545 -1.044 -0.390 1.00 . A A . 8 CYS CB 1 1
1 82 1 1 8 CYS H H -3.675 0.787 0.999 1.00 . A A . 8 CYS H 1 1
1 83 1 1 8 CYS HA H -1.648 0.811 -0.910 1.00 . A A . 8 CYS HA 1 1
1 84 1 1 8 CYS HB3 H -3.526 -1.441 -0.127 1.00 . A A . 8 CYS HB3 1 1
1 85 1 1 8 CYS N N -3.381 1.225 0.136 1.00 . A A . 8 CYS N 1 1
1 86 1 1 8 CYS O O -4.508 0.288 -2.370 1.00 . A A . 8 CYS O 1 1
1 87 1 1 8 CYS SG S -1.865 -2.065 -1.723 1.00 . A A . 8 CYS SG 1 1
1 88 1 1 9 HIS C C -1.511 -0.065 -5.219 1.00 . A A . 9 HIS C 1 1
1 89 1 1 9 HIS CA C -2.765 0.591 -4.642 1.00 . A A . 9 HIS CA 1 1
1 90 1 1 9 HIS CB C -3.016 1.964 -5.275 1.00 . A A . 9 HIS CB 1 1
1 91 1 1 9 HIS CD2 C -5.450 2.740 -5.552 1.00 . A A . 9 HIS CD2 1 1
1 92 1 1 9 HIS CE1 C -5.810 3.592 -3.564 1.00 . A A . 9 HIS CE1 1 1
1 93 1 1 9 HIS CG C -4.299 2.613 -4.819 1.00 . A A . 9 HIS CG 1 1
1 94 1 1 9 HIS H H -1.488 0.851 -3.060 1.00 . A A . 9 HIS H 1 1
1 95 1 1 9 HIS HA H -3.623 -0.066 -4.796 1.00 . A A . 9 HIS HA 1 1
1 96 1 1 9 HIS HB3 H -3.055 1.840 -6.354 1.00 . A A . 9 HIS HB3 1 1
1 97 1 1 9 HIS HD1 H -3.901 3.178 -2.790 1.00 . A A . 9 HIS HD1 1 1
1 98 1 1 9 HIS HD2 H -5.599 2.401 -6.567 1.00 . A A . 9 HIS HD2 1 1
1 99 1 1 9 HIS HE1 H -6.291 4.053 -2.713 1.00 . A A . 9 HIS HE1 1 1
1 100 1 1 9 HIS N N -2.479 0.760 -3.234 1.00 . A A . 9 HIS N 1 1
1 101 1 1 9 HIS ND1 N -4.540 3.156 -3.577 1.00 . A A . 9 HIS ND1 1 1
1 102 1 1 9 HIS NE2 N -6.404 3.369 -4.748 1.00 . A A . 9 HIS NE2 1 1
1 103 1 1 9 HIS O O -0.516 -0.201 -4.505 1.00 . A A . 9 HIS O 1 1
1 104 1 1 10 GLU C C 0.907 -0.387 -6.994 1.00 . A A . 10 GLU C 1 1
1 105 1 1 10 GLU CA C -0.433 -1.102 -7.188 1.00 . A A . 10 GLU CA 1 1
1 106 1 1 10 GLU CB C -0.749 -1.198 -8.688 1.00 . A A . 10 GLU CB 1 1
1 107 1 1 10 GLU CD C -2.332 -1.964 -10.477 1.00 . A A . 10 GLU CD 1 1
1 108 1 1 10 GLU CG C -2.148 -1.751 -8.982 1.00 . A A . 10 GLU CG 1 1
1 109 1 1 10 GLU H H -2.382 -0.281 -7.026 1.00 . A A . 10 GLU H 1 1
1 110 1 1 10 GLU HA H -0.336 -2.102 -6.765 1.00 . A A . 10 GLU HA 1 1
1 111 1 1 10 GLU HB3 H -0.010 -1.851 -9.156 1.00 . A A . 10 GLU HB3 1 1
1 112 1 1 10 GLU HG3 H -2.918 -1.049 -8.669 1.00 . A A . 10 GLU HG3 1 1
1 113 1 1 10 GLU N N -1.534 -0.428 -6.503 1.00 . A A . 10 GLU N 1 1
1 114 1 1 10 GLU O O 1.962 -1.014 -6.951 1.00 . A A . 10 GLU O 1 1
1 115 1 1 10 GLU OE1 O -2.324 -0.937 -11.189 1.00 . A A . 10 GLU OE1 1 1
1 116 1 1 10 GLU OE2 O -2.462 -3.140 -10.876 1.00 . A A . 10 GLU OE2 1 1
1 117 1 1 11 LEU C C 2.831 1.427 -5.479 1.00 . A A . 11 LEU C 1 1
1 118 1 1 11 LEU CA C 1.991 1.811 -6.704 1.00 . A A . 11 LEU CA 1 1
1 119 1 1 11 LEU CB C 1.442 3.233 -6.550 1.00 . A A . 11 LEU CB 1 1
1 120 1 1 11 LEU CD1 C -0.124 4.897 -7.594 1.00 . A A . 11 LEU CD1 1 1
1 121 1 1 11 LEU CD2 C 2.035 4.362 -8.740 1.00 . A A . 11 LEU CD2 1 1
1 122 1 1 11 LEU CG C 0.903 3.794 -7.875 1.00 . A A . 11 LEU CG 1 1
1 123 1 1 11 LEU H H -0.054 1.382 -6.899 1.00 . A A . 11 LEU H 1 1
1 124 1 1 11 LEU HA H 2.616 1.762 -7.595 1.00 . A A . 11 LEU HA 1 1
1 125 1 1 11 LEU HB3 H 2.228 3.878 -6.182 1.00 . A A . 11 LEU HB3 1 1
1 126 1 1 11 LEU HD11 H -0.963 4.489 -7.028 1.00 . A A . 11 LEU HD11 1 1
1 127 1 1 11 LEU HD12 H 0.338 5.701 -7.021 1.00 . A A . 11 LEU HD12 1 1
1 128 1 1 11 LEU HD13 H -0.501 5.299 -8.534 1.00 . A A . 11 LEU HD13 1 1
1 129 1 1 11 LEU HD21 H 2.763 3.585 -8.974 1.00 . A A . 11 LEU HD21 1 1
1 130 1 1 11 LEU HD22 H 1.624 4.745 -9.674 1.00 . A A . 11 LEU HD22 1 1
1 131 1 1 11 LEU HD23 H 2.537 5.175 -8.215 1.00 . A A . 11 LEU HD23 1 1
1 132 1 1 11 LEU HG H 0.413 2.996 -8.432 1.00 . A A . 11 LEU HG 1 1
1 133 1 1 11 LEU N N 0.851 0.940 -6.887 1.00 . A A . 11 LEU N 1 1
1 134 1 1 11 LEU O O 4.038 1.653 -5.466 1.00 . A A . 11 LEU O 1 1
1 135 1 1 12 CYS C C 3.234 -0.678 -2.870 1.00 . A A . 12 CYS C 1 1
1 136 1 1 12 CYS CA C 2.803 0.762 -3.115 1.00 . A A . 12 CYS CA 1 1
1 137 1 1 12 CYS CB C 1.845 1.246 -2.032 1.00 . A A . 12 CYS CB 1 1
1 138 1 1 12 CYS H H 1.228 0.612 -4.538 1.00 . A A . 12 CYS H 1 1
1 139 1 1 12 CYS HA H 3.682 1.406 -3.042 1.00 . A A . 12 CYS HA 1 1
1 140 1 1 12 CYS HB3 H 0.955 0.618 -1.981 1.00 . A A . 12 CYS HB3 1 1
1 141 1 1 12 CYS N N 2.189 0.914 -4.425 1.00 . A A . 12 CYS N 1 1
1 142 1 1 12 CYS O O 2.404 -1.540 -2.598 1.00 . A A . 12 CYS O 1 1
1 143 1 1 12 CYS SG S 2.623 1.315 -0.404 1.00 . A A . 12 CYS SG 1 1
1 144 1 1 13 TYR C C 4.714 -2.983 -1.571 1.00 . A A . 13 TYR C 1 1
1 145 1 1 13 TYR CA C 5.162 -2.226 -2.825 1.00 . A A . 13 TYR CA 1 1
1 146 1 1 13 TYR CB C 6.675 -1.982 -2.822 1.00 . A A . 13 TYR CB 1 1
1 147 1 1 13 TYR CD1 C 7.186 -1.128 -5.156 1.00 . A A . 13 TYR CD1 1 1
1 148 1 1 13 TYR CD2 C 8.151 -3.248 -4.445 1.00 . A A . 13 TYR CD2 1 1
1 149 1 1 13 TYR CE1 C 7.838 -1.248 -6.395 1.00 . A A . 13 TYR CE1 1 1
1 150 1 1 13 TYR CE2 C 8.806 -3.363 -5.683 1.00 . A A . 13 TYR CE2 1 1
1 151 1 1 13 TYR CG C 7.347 -2.124 -4.174 1.00 . A A . 13 TYR CG 1 1
1 152 1 1 13 TYR CZ C 8.650 -2.365 -6.658 1.00 . A A . 13 TYR CZ 1 1
1 153 1 1 13 TYR H H 5.194 -0.188 -3.142 1.00 . A A . 13 TYR H 1 1
1 154 1 1 13 TYR HA H 4.894 -2.832 -3.693 1.00 . A A . 13 TYR HA 1 1
1 155 1 1 13 TYR HB3 H 7.113 -2.685 -2.133 1.00 . A A . 13 TYR HB3 1 1
1 156 1 1 13 TYR HD1 H 6.564 -0.265 -4.963 1.00 . A A . 13 TYR HD1 1 1
1 157 1 1 13 TYR HD2 H 8.276 -4.022 -3.702 1.00 . A A . 13 TYR HD2 1 1
1 158 1 1 13 TYR HE1 H 7.708 -0.477 -7.140 1.00 . A A . 13 TYR HE1 1 1
1 159 1 1 13 TYR HE2 H 9.429 -4.221 -5.886 1.00 . A A . 13 TYR HE2 1 1
1 160 1 1 13 TYR HH H 9.115 -1.755 -8.449 1.00 . A A . 13 TYR HH 1 1
1 161 1 1 13 TYR N N 4.543 -0.928 -2.946 1.00 . A A . 13 TYR N 1 1
1 162 1 1 13 TYR O O 4.414 -4.170 -1.646 1.00 . A A . 13 TYR O 1 1
1 163 1 1 13 TYR OH O 9.298 -2.482 -7.851 1.00 . A A . 13 TYR OH 1 1
1 164 1 1 14 CYS C C 3.105 -3.573 0.979 1.00 . A A . 14 CYS C 1 1
1 165 1 1 14 CYS CA C 4.517 -2.996 0.866 1.00 . A A . 14 CYS CA 1 1
1 166 1 1 14 CYS CB C 4.837 -2.067 2.038 1.00 . A A . 14 CYS CB 1 1
1 167 1 1 14 CYS H H 4.981 -1.342 -0.419 1.00 . A A . 14 CYS H 1 1
1 168 1 1 14 CYS HA H 5.214 -3.834 0.924 1.00 . A A . 14 CYS HA 1 1
1 169 1 1 14 CYS HB3 H 4.263 -1.144 1.976 1.00 . A A . 14 CYS HB3 1 1
1 170 1 1 14 CYS N N 4.730 -2.318 -0.409 1.00 . A A . 14 CYS N 1 1
1 171 1 1 14 CYS O O 2.942 -4.770 1.186 1.00 . A A . 14 CYS O 1 1
1 172 1 1 14 CYS SG S 4.522 -2.860 3.631 1.00 . A A . 14 CYS SG 1 1
1 173 1 1 15 CYS C C 0.147 -3.881 1.912 1.00 . A A . 15 CYS C 1 1
1 174 1 1 15 CYS CA C 0.685 -3.030 0.753 1.00 . A A . 15 CYS CA 1 1
1 175 1 1 15 CYS CB C 0.393 -3.720 -0.576 1.00 . A A . 15 CYS CB 1 1
1 176 1 1 15 CYS H H 2.355 -1.745 0.656 1.00 . A A . 15 CYS H 1 1
1 177 1 1 15 CYS HA H 0.161 -2.074 0.758 1.00 . A A . 15 CYS HA 1 1
1 178 1 1 15 CYS HB3 H 0.856 -4.704 -0.560 1.00 . A A . 15 CYS HB3 1 1
1 179 1 1 15 CYS N N 2.103 -2.700 0.841 1.00 . A A . 15 CYS N 1 1
1 180 1 1 15 CYS O O 0.197 -5.109 1.886 1.00 . A A . 15 CYS O 1 1
1 181 1 1 15 CYS SG S -1.375 -3.906 -0.889 1.00 . A A . 15 CYS SG 1 1
1 182 1 1 16 ASP C C -2.137 -4.886 3.544 1.00 . A A . 16 ASP C 1 1
1 183 1 1 16 ASP CA C -1.108 -3.867 4.040 1.00 . A A . 16 ASP CA 1 1
1 184 1 1 16 ASP CB C -1.790 -2.764 4.848 1.00 . A A . 16 ASP CB 1 1
1 185 1 1 16 ASP CG C -2.749 -3.260 5.913 1.00 . A A . 16 ASP CG 1 1
1 186 1 1 16 ASP H H -0.489 -2.213 2.876 1.00 . A A . 16 ASP H 1 1
1 187 1 1 16 ASP HA H -0.384 -4.385 4.669 1.00 . A A . 16 ASP HA 1 1
1 188 1 1 16 ASP HB3 H -2.393 -2.192 4.148 1.00 . A A . 16 ASP HB3 1 1
1 189 1 1 16 ASP N N -0.419 -3.223 2.926 1.00 . A A . 16 ASP N 1 1
1 190 1 1 16 ASP O O -2.942 -4.582 2.662 1.00 . A A . 16 ASP O 1 1
1 191 1 1 16 ASP OD1 O -2.602 -4.435 6.309 1.00 . A A . 16 ASP OD1 1 1
1 192 1 1 16 ASP OD2 O -3.620 -2.439 6.283 1.00 . A A . 16 ASP OD2 1 1
2 193 1 1 1 VAL C C 5.339 2.536 5.026 1.00 . A A . 1 VAL C 1 1
2 194 1 1 1 VAL CA C 6.137 3.235 6.130 1.00 . A A . 1 VAL CA 1 1
2 195 1 1 1 VAL CB C 5.229 3.849 7.213 1.00 . A A . 1 VAL CB 1 1
2 196 1 1 1 VAL CG1 C 6.064 4.376 8.387 1.00 . A A . 1 VAL CG1 1 1
2 197 1 1 1 VAL CG2 C 4.342 4.978 6.665 1.00 . A A . 1 VAL CG2 1 1
2 198 1 1 1 VAL H1 H 6.813 4.380 4.530 1.00 . A A . 1 VAL H1 1 1
2 199 1 1 1 VAL HA H 6.790 2.494 6.594 1.00 . A A . 1 VAL HA 1 1
2 200 1 1 1 VAL HB H 4.575 3.067 7.603 1.00 . A A . 1 VAL HB 1 1
2 201 1 1 1 VAL HG11 H 6.715 5.185 8.058 1.00 . A A . 1 VAL HG11 1 1
2 202 1 1 1 VAL HG12 H 5.404 4.749 9.170 1.00 . A A . 1 VAL HG12 1 1
2 203 1 1 1 VAL HG13 H 6.675 3.571 8.796 1.00 . A A . 1 VAL HG13 1 1
2 204 1 1 1 VAL HG21 H 4.955 5.809 6.315 1.00 . A A . 1 VAL HG21 1 1
2 205 1 1 1 VAL HG22 H 3.729 4.614 5.842 1.00 . A A . 1 VAL HG22 1 1
2 206 1 1 1 VAL HG23 H 3.683 5.337 7.456 1.00 . A A . 1 VAL HG23 1 1
2 207 1 1 1 VAL N N 6.974 4.254 5.524 1.00 . A A . 1 VAL N 1 1
2 208 1 1 1 VAL O O 5.363 2.970 3.875 1.00 . A A . 1 VAL O 1 1
2 209 1 1 2 CYS C C 2.509 1.599 4.219 1.00 . A A . 2 CYS C 1 1
2 210 1 1 2 CYS CA C 3.758 0.756 4.450 1.00 . A A . 2 CYS CA 1 1
2 211 1 1 2 CYS CB C 3.342 -0.587 5.053 1.00 . A A . 2 CYS CB 1 1
2 212 1 1 2 CYS H H 4.640 1.169 6.342 1.00 . A A . 2 CYS H 1 1
2 213 1 1 2 CYS HA H 4.284 0.599 3.510 1.00 . A A . 2 CYS HA 1 1
2 214 1 1 2 CYS HB3 H 2.443 -0.457 5.655 1.00 . A A . 2 CYS HB3 1 1
2 215 1 1 2 CYS N N 4.648 1.449 5.374 1.00 . A A . 2 CYS N 1 1
2 216 1 1 2 CYS O O 2.216 2.485 5.021 1.00 . A A . 2 CYS O 1 1
2 217 1 1 2 CYS SG S 3.044 -1.914 3.878 1.00 . A A . 2 CYS SG 1 1
2 218 1 1 3 CYS C C -0.514 0.818 3.928 1.00 . A A . 3 CYS C 1 1
2 219 1 1 3 CYS CA C 0.356 1.797 3.153 1.00 . A A . 3 CYS CA 1 1
2 220 1 1 3 CYS CB C -0.187 1.929 1.736 1.00 . A A . 3 CYS CB 1 1
2 221 1 1 3 CYS H H 1.932 0.474 2.623 1.00 . A A . 3 CYS H 1 1
2 222 1 1 3 CYS HA H 0.317 2.795 3.582 1.00 . A A . 3 CYS HA 1 1
2 223 1 1 3 CYS HB3 H -1.250 2.111 1.847 1.00 . A A . 3 CYS HB3 1 1
2 224 1 1 3 CYS N N 1.719 1.285 3.189 1.00 . A A . 3 CYS N 1 1
2 225 1 1 3 CYS O O -0.339 -0.383 3.719 1.00 . A A . 3 CYS O 1 1
2 226 1 1 3 CYS SG S 0.463 3.329 0.814 1.00 . A A . 3 CYS SG 1 1
2 227 1 1 4 PRO C C -3.335 -0.166 4.368 1.00 . A A . 4 PRO C 1 1
2 228 1 1 4 PRO CA C -2.413 0.430 5.432 1.00 . A A . 4 PRO CA 1 1
2 229 1 1 4 PRO CB C -3.201 1.341 6.376 1.00 . A A . 4 PRO CB 1 1
2 230 1 1 4 PRO CD C -1.733 2.691 5.049 1.00 . A A . 4 PRO CD 1 1
2 231 1 1 4 PRO CG C -3.111 2.711 5.708 1.00 . A A . 4 PRO CG 1 1
2 232 1 1 4 PRO HA H -1.922 -0.355 6.007 1.00 . A A . 4 PRO HA 1 1
2 233 1 1 4 PRO HB3 H -2.702 1.375 7.345 1.00 . A A . 4 PRO HB3 1 1
2 234 1 1 4 PRO HD3 H -0.984 3.090 5.736 1.00 . A A . 4 PRO HD3 1 1
2 235 1 1 4 PRO HG3 H -3.219 3.529 6.421 1.00 . A A . 4 PRO HG3 1 1
2 236 1 1 4 PRO N N -1.437 1.291 4.783 1.00 . A A . 4 PRO N 1 1
2 237 1 1 4 PRO O O -3.507 0.428 3.307 1.00 . A A . 4 PRO O 1 1
2 238 1 1 5 PHE C C -5.959 -0.970 3.281 1.00 . A A . 5 PHE C 1 1
2 239 1 1 5 PHE CA C -4.902 -1.963 3.768 1.00 . A A . 5 PHE CA 1 1
2 240 1 1 5 PHE CB C -5.516 -3.148 4.518 1.00 . A A . 5 PHE CB 1 1
2 241 1 1 5 PHE CD1 C -6.169 -4.666 2.624 1.00 . A A . 5 PHE CD1 1 1
2 242 1 1 5 PHE CD2 C -7.929 -3.710 4.008 1.00 . A A . 5 PHE CD2 1 1
2 243 1 1 5 PHE CE1 C -7.136 -5.301 1.827 1.00 . A A . 5 PHE CE1 1 1
2 244 1 1 5 PHE CE2 C -8.899 -4.345 3.213 1.00 . A A . 5 PHE CE2 1 1
2 245 1 1 5 PHE CG C -6.565 -3.884 3.721 1.00 . A A . 5 PHE CG 1 1
2 246 1 1 5 PHE CZ C -8.503 -5.144 2.124 1.00 . A A . 5 PHE CZ 1 1
2 247 1 1 5 PHE H H -3.700 -1.833 5.496 1.00 . A A . 5 PHE H 1 1
2 248 1 1 5 PHE HA H -4.362 -2.325 2.893 1.00 . A A . 5 PHE HA 1 1
2 249 1 1 5 PHE HB3 H -5.944 -2.802 5.458 1.00 . A A . 5 PHE HB3 1 1
2 250 1 1 5 PHE HD1 H -5.115 -4.746 2.392 1.00 . A A . 5 PHE HD1 1 1
2 251 1 1 5 PHE HD2 H -8.226 -3.073 4.828 1.00 . A A . 5 PHE HD2 1 1
2 252 1 1 5 PHE HE1 H -6.830 -5.895 0.979 1.00 . A A . 5 PHE HE1 1 1
2 253 1 1 5 PHE HE2 H -9.949 -4.211 3.432 1.00 . A A . 5 PHE HE2 1 1
2 254 1 1 5 PHE HZ H -9.248 -5.625 1.508 1.00 . A A . 5 PHE HZ 1 1
2 255 1 1 5 PHE N N -3.958 -1.311 4.655 1.00 . A A . 5 PHE N 1 1
2 256 1 1 5 PHE O O -6.201 -0.845 2.082 1.00 . A A . 5 PHE O 1 1
2 257 1 1 6 GLY C C -6.581 2.116 3.405 1.00 . A A . 6 GLY C 1 1
2 258 1 1 6 GLY CA C -7.404 0.919 3.886 1.00 . A A . 6 GLY CA 1 1
2 259 1 1 6 GLY H H -6.250 -0.327 5.170 1.00 . A A . 6 GLY H 1 1
2 260 1 1 6 GLY HA2 H -8.121 0.634 3.116 1.00 . A A . 6 GLY HA2 1 1
2 261 1 1 6 GLY HA3 H -7.957 1.202 4.783 1.00 . A A . 6 GLY HA3 1 1
2 262 1 1 6 GLY N N -6.536 -0.203 4.210 1.00 . A A . 6 GLY N 1 1
2 263 1 1 6 GLY O O -6.562 3.156 4.058 1.00 . A A . 6 GLY O 1 1
2 264 1 1 7 GLY C C -4.256 2.495 0.503 1.00 . A A . 7 GLY C 1 1
2 265 1 1 7 GLY CA C -5.049 3.009 1.702 1.00 . A A . 7 GLY CA 1 1
2 266 1 1 7 GLY H H -5.916 1.061 1.824 1.00 . A A . 7 GLY H 1 1
2 267 1 1 7 GLY HA2 H -5.669 3.851 1.391 1.00 . A A . 7 GLY HA2 1 1
2 268 1 1 7 GLY HA3 H -4.342 3.353 2.459 1.00 . A A . 7 GLY HA3 1 1
2 269 1 1 7 GLY N N -5.898 1.971 2.268 1.00 . A A . 7 GLY N 1 1
2 270 1 1 7 GLY O O -4.122 3.194 -0.502 1.00 . A A . 7 GLY O 1 1
2 271 1 1 8 CYS C C -3.553 0.721 -1.789 1.00 . A A . 8 CYS C 1 1
2 272 1 1 8 CYS CA C -2.887 0.663 -0.415 1.00 . A A . 8 CYS CA 1 1
2 273 1 1 8 CYS CB C -2.561 -0.791 -0.059 1.00 . A A . 8 CYS CB 1 1
2 274 1 1 8 CYS H H -3.862 0.763 1.469 1.00 . A A . 8 CYS H 1 1
2 275 1 1 8 CYS HA H -1.947 1.214 -0.465 1.00 . A A . 8 CYS HA 1 1
2 276 1 1 8 CYS HB3 H -3.473 -1.317 0.227 1.00 . A A . 8 CYS HB3 1 1
2 277 1 1 8 CYS N N -3.714 1.278 0.612 1.00 . A A . 8 CYS N 1 1
2 278 1 1 8 CYS O O -4.729 0.393 -1.933 1.00 . A A . 8 CYS O 1 1
2 279 1 1 8 CYS SG S -1.852 -1.668 -1.476 1.00 . A A . 8 CYS SG 1 1
2 280 1 1 9 HIS C C -1.773 0.254 -4.723 1.00 . A A . 9 HIS C 1 1
2 281 1 1 9 HIS CA C -3.056 0.895 -4.198 1.00 . A A . 9 HIS CA 1 1
2 282 1 1 9 HIS CB C -3.353 2.224 -4.897 1.00 . A A . 9 HIS CB 1 1
2 283 1 1 9 HIS CD2 C -5.720 3.149 -5.267 1.00 . A A . 9 HIS CD2 1 1
2 284 1 1 9 HIS CE1 C -6.226 3.767 -3.226 1.00 . A A . 9 HIS CE1 1 1
2 285 1 1 9 HIS CG C -4.648 2.869 -4.460 1.00 . A A . 9 HIS CG 1 1
2 286 1 1 9 HIS H H -1.800 1.313 -2.643 1.00 . A A . 9 HIS H 1 1
2 287 1 1 9 HIS HA H -3.888 0.202 -4.332 1.00 . A A . 9 HIS HA 1 1
2 288 1 1 9 HIS HB3 H -3.404 2.040 -5.969 1.00 . A A . 9 HIS HB3 1 1
2 289 1 1 9 HIS HD1 H -4.422 3.170 -2.341 1.00 . A A . 9 HIS HD1 1 1
2 290 1 1 9 HIS HD2 H -5.787 2.956 -6.328 1.00 . A A . 9 HIS HD2 1 1
2 291 1 1 9 HIS HE1 H -6.763 4.147 -2.368 1.00 . A A . 9 HIS HE1 1 1
2 292 1 1 9 HIS N N -2.783 1.132 -2.799 1.00 . A A . 9 HIS N 1 1
2 293 1 1 9 HIS ND1 N -4.981 3.267 -3.182 1.00 . A A . 9 HIS ND1 1 1
2 294 1 1 9 HIS NE2 N -6.717 3.724 -4.475 1.00 . A A . 9 HIS NE2 1 1
2 295 1 1 9 HIS O O -0.773 0.223 -4.005 1.00 . A A . 9 HIS O 1 1
2 296 1 1 10 GLU C C 0.669 -0.272 -6.427 1.00 . A A . 10 GLU C 1 1
2 297 1 1 10 GLU CA C -0.681 -0.988 -6.548 1.00 . A A . 10 GLU CA 1 1
2 298 1 1 10 GLU CB C -1.043 -1.294 -8.009 1.00 . A A . 10 GLU CB 1 1
2 299 1 1 10 GLU CD C -0.454 -2.467 -10.151 1.00 . A A . 10 GLU CD 1 1
2 300 1 1 10 GLU CG C -0.021 -2.186 -8.718 1.00 . A A . 10 GLU CG 1 1
2 301 1 1 10 GLU H H -2.632 -0.141 -6.502 1.00 . A A . 10 GLU H 1 1
2 302 1 1 10 GLU HA H -0.584 -1.910 -5.977 1.00 . A A . 10 GLU HA 1 1
2 303 1 1 10 GLU HB3 H -1.124 -0.360 -8.568 1.00 . A A . 10 GLU HB3 1 1
2 304 1 1 10 GLU HG3 H 0.081 -3.130 -8.181 1.00 . A A . 10 GLU HG3 1 1
2 305 1 1 10 GLU N N -1.783 -0.230 -5.963 1.00 . A A . 10 GLU N 1 1
2 306 1 1 10 GLU O O 1.709 -0.905 -6.257 1.00 . A A . 10 GLU O 1 1
2 307 1 1 10 GLU OE1 O -0.613 -1.472 -10.890 1.00 . A A . 10 GLU OE1 1 1
2 308 1 1 10 GLU OE2 O -0.633 -3.661 -10.470 1.00 . A A . 10 GLU OE2 1 1
2 309 1 1 11 LEU C C 2.592 1.672 -5.109 1.00 . A A . 11 LEU C 1 1
2 310 1 1 11 LEU CA C 1.843 1.879 -6.429 1.00 . A A . 11 LEU CA 1 1
2 311 1 1 11 LEU CB C 1.394 3.336 -6.576 1.00 . A A . 11 LEU CB 1 1
2 312 1 1 11 LEU CD1 C 0.020 4.870 -8.012 1.00 . A A . 11 LEU CD1 1 1
2 313 1 1 11 LEU CD2 C 2.166 3.954 -8.910 1.00 . A A . 11 LEU CD2 1 1
2 314 1 1 11 LEU CG C 0.958 3.658 -8.013 1.00 . A A . 11 LEU CG 1 1
2 315 1 1 11 LEU H H -0.230 1.541 -6.507 1.00 . A A . 11 LEU H 1 1
2 316 1 1 11 LEU HA H 2.498 1.617 -7.259 1.00 . A A . 11 LEU HA 1 1
2 317 1 1 11 LEU HB3 H 2.209 3.987 -6.290 1.00 . A A . 11 LEU HB3 1 1
2 318 1 1 11 LEU HD11 H -0.287 5.101 -9.032 1.00 . A A . 11 LEU HD11 1 1
2 319 1 1 11 LEU HD12 H -0.871 4.650 -7.421 1.00 . A A . 11 LEU HD12 1 1
2 320 1 1 11 LEU HD13 H 0.527 5.736 -7.586 1.00 . A A . 11 LEU HD13 1 1
2 321 1 1 11 LEU HD21 H 2.831 3.092 -8.955 1.00 . A A . 11 LEU HD21 1 1
2 322 1 1 11 LEU HD22 H 1.824 4.178 -9.922 1.00 . A A . 11 LEU HD22 1 1
2 323 1 1 11 LEU HD23 H 2.719 4.811 -8.526 1.00 . A A . 11 LEU HD23 1 1
2 324 1 1 11 LEU HG H 0.425 2.803 -8.427 1.00 . A A . 11 LEU HG 1 1
2 325 1 1 11 LEU N N 0.653 1.059 -6.489 1.00 . A A . 11 LEU N 1 1
2 326 1 1 11 LEU O O 3.819 1.746 -5.055 1.00 . A A . 11 LEU O 1 1
2 327 1 1 12 CYS C C 2.912 0.089 -2.305 1.00 . A A . 12 CYS C 1 1
2 328 1 1 12 CYS CA C 2.406 1.476 -2.678 1.00 . A A . 12 CYS CA 1 1
2 329 1 1 12 CYS CB C 1.374 2.013 -1.695 1.00 . A A . 12 CYS CB 1 1
2 330 1 1 12 CYS H H 0.881 1.180 -4.148 1.00 . A A . 12 CYS H 1 1
2 331 1 1 12 CYS HA H 3.248 2.170 -2.648 1.00 . A A . 12 CYS HA 1 1
2 332 1 1 12 CYS HB3 H 0.587 1.280 -1.518 1.00 . A A . 12 CYS HB3 1 1
2 333 1 1 12 CYS N N 1.851 1.449 -4.022 1.00 . A A . 12 CYS N 1 1
2 334 1 1 12 CYS O O 2.366 -0.569 -1.422 1.00 . A A . 12 CYS O 1 1
2 335 1 1 12 CYS SG S 2.110 2.499 -0.122 1.00 . A A . 12 CYS SG 1 1
2 336 1 1 13 TYR C C 4.369 -2.522 -1.912 1.00 . A A . 13 TYR C 1 1
2 337 1 1 13 TYR CA C 4.528 -1.659 -3.158 1.00 . A A . 13 TYR CA 1 1
2 338 1 1 13 TYR CB C 6.016 -1.509 -3.500 1.00 . A A . 13 TYR CB 1 1
2 339 1 1 13 TYR CD1 C 7.192 -3.753 -3.380 1.00 . A A . 13 TYR CD1 1 1
2 340 1 1 13 TYR CD2 C 6.696 -2.803 -5.566 1.00 . A A . 13 TYR CD2 1 1
2 341 1 1 13 TYR CE1 C 7.821 -4.846 -4.000 1.00 . A A . 13 TYR CE1 1 1
2 342 1 1 13 TYR CE2 C 7.330 -3.894 -6.185 1.00 . A A . 13 TYR CE2 1 1
2 343 1 1 13 TYR CG C 6.638 -2.722 -4.162 1.00 . A A . 13 TYR CG 1 1
2 344 1 1 13 TYR CZ C 7.892 -4.915 -5.401 1.00 . A A . 13 TYR CZ 1 1
2 345 1 1 13 TYR H H 4.327 0.372 -3.661 1.00 . A A . 13 TYR H 1 1
2 346 1 1 13 TYR HA H 4.017 -2.142 -3.992 1.00 . A A . 13 TYR HA 1 1
2 347 1 1 13 TYR HB3 H 6.581 -1.269 -2.600 1.00 . A A . 13 TYR HB3 1 1
2 348 1 1 13 TYR HD1 H 7.145 -3.705 -2.302 1.00 . A A . 13 TYR HD1 1 1
2 349 1 1 13 TYR HD2 H 6.267 -2.018 -6.174 1.00 . A A . 13 TYR HD2 1 1
2 350 1 1 13 TYR HE1 H 8.251 -5.635 -3.400 1.00 . A A . 13 TYR HE1 1 1
2 351 1 1 13 TYR HE2 H 7.380 -3.937 -7.263 1.00 . A A . 13 TYR HE2 1 1
2 352 1 1 13 TYR HH H 8.513 -5.918 -6.952 1.00 . A A . 13 TYR HH 1 1
2 353 1 1 13 TYR N N 3.967 -0.318 -3.017 1.00 . A A . 13 TYR N 1 1
2 354 1 1 13 TYR O O 3.984 -3.685 -1.986 1.00 . A A . 13 TYR O 1 1
2 355 1 1 13 TYR OH O 8.526 -5.966 -5.995 1.00 . A A . 13 TYR OH 1 1
2 356 1 1 14 CYS C C 3.325 -3.193 0.835 1.00 . A A . 14 CYS C 1 1
2 357 1 1 14 CYS CA C 4.699 -2.595 0.524 1.00 . A A . 14 CYS CA 1 1
2 358 1 1 14 CYS CB C 5.132 -1.625 1.622 1.00 . A A . 14 CYS CB 1 1
2 359 1 1 14 CYS H H 4.958 -0.949 -0.868 1.00 . A A . 14 CYS H 1 1
2 360 1 1 14 CYS HA H 5.418 -3.415 0.501 1.00 . A A . 14 CYS HA 1 1
2 361 1 1 14 CYS HB3 H 4.540 -0.712 1.589 1.00 . A A . 14 CYS HB3 1 1
2 362 1 1 14 CYS N N 4.724 -1.929 -0.774 1.00 . A A . 14 CYS N 1 1
2 363 1 1 14 CYS O O 3.222 -4.372 1.155 1.00 . A A . 14 CYS O 1 1
2 364 1 1 14 CYS SG S 4.986 -2.361 3.265 1.00 . A A . 14 CYS SG 1 1
2 365 1 1 15 CYS C C 0.459 -3.678 1.895 1.00 . A A . 15 CYS C 1 1
2 366 1 1 15 CYS CA C 0.878 -2.724 0.763 1.00 . A A . 15 CYS CA 1 1
2 367 1 1 15 CYS CB C 0.499 -3.342 -0.584 1.00 . A A . 15 CYS CB 1 1
2 368 1 1 15 CYS H H 2.505 -1.426 0.400 1.00 . A A . 15 CYS H 1 1
2 369 1 1 15 CYS HA H 0.328 -1.790 0.882 1.00 . A A . 15 CYS HA 1 1
2 370 1 1 15 CYS HB3 H 0.965 -4.324 -0.672 1.00 . A A . 15 CYS HB3 1 1
2 371 1 1 15 CYS N N 2.290 -2.356 0.739 1.00 . A A . 15 CYS N 1 1
2 372 1 1 15 CYS O O 0.449 -4.896 1.719 1.00 . A A . 15 CYS O 1 1
2 373 1 1 15 CYS SG S -1.280 -3.546 -0.796 1.00 . A A . 15 CYS SG 1 1
2 374 1 1 16 ASP C C -1.751 -4.755 3.551 1.00 . A A . 16 ASP C 1 1
2 375 1 1 16 ASP CA C -0.567 -3.951 4.101 1.00 . A A . 16 ASP CA 1 1
2 376 1 1 16 ASP CB C -1.020 -3.035 5.243 1.00 . A A . 16 ASP CB 1 1
2 377 1 1 16 ASP CG C -2.049 -3.683 6.156 1.00 . A A . 16 ASP CG 1 1
2 378 1 1 16 ASP H H 0.018 -2.132 3.158 1.00 . A A . 16 ASP H 1 1
2 379 1 1 16 ASP HA H 0.165 -4.661 4.488 1.00 . A A . 16 ASP HA 1 1
2 380 1 1 16 ASP HB3 H -1.510 -2.187 4.787 1.00 . A A . 16 ASP HB3 1 1
2 381 1 1 16 ASP N N 0.044 -3.140 3.047 1.00 . A A . 16 ASP N 1 1
2 382 1 1 16 ASP O O -2.583 -4.222 2.813 1.00 . A A . 16 ASP O 1 1
2 383 1 1 16 ASP OD1 O -1.926 -4.906 6.376 1.00 . A A . 16 ASP OD1 1 1
2 384 1 1 16 ASP OD2 O -2.969 -2.942 6.570 1.00 . A A . 16 ASP OD2 1 1
3 385 1 1 1 VAL C C 4.788 1.809 5.566 1.00 . A A . 1 VAL C 1 1
3 386 1 1 1 VAL CA C 5.459 2.543 6.730 1.00 . A A . 1 VAL CA 1 1
3 387 1 1 1 VAL CB C 4.448 3.322 7.592 1.00 . A A . 1 VAL CB 1 1
3 388 1 1 1 VAL CG1 C 5.141 3.925 8.820 1.00 . A A . 1 VAL CG1 1 1
3 389 1 1 1 VAL CG2 C 3.737 4.431 6.805 1.00 . A A . 1 VAL CG2 1 1
3 390 1 1 1 VAL H1 H 6.466 3.493 5.177 1.00 . A A . 1 VAL H1 1 1
3 391 1 1 1 VAL HA H 5.963 1.802 7.352 1.00 . A A . 1 VAL HA 1 1
3 392 1 1 1 VAL HB H 3.691 2.623 7.951 1.00 . A A . 1 VAL HB 1 1
3 393 1 1 1 VAL HG11 H 5.634 3.138 9.392 1.00 . A A . 1 VAL HG11 1 1
3 394 1 1 1 VAL HG12 H 5.883 4.664 8.515 1.00 . A A . 1 VAL HG12 1 1
3 395 1 1 1 VAL HG13 H 4.401 4.410 9.457 1.00 . A A . 1 VAL HG13 1 1
3 396 1 1 1 VAL HG21 H 3.209 4.011 5.948 1.00 . A A . 1 VAL HG21 1 1
3 397 1 1 1 VAL HG22 H 3.010 4.925 7.450 1.00 . A A . 1 VAL HG22 1 1
3 398 1 1 1 VAL HG23 H 4.455 5.172 6.453 1.00 . A A . 1 VAL HG23 1 1
3 399 1 1 1 VAL N N 6.468 3.437 6.190 1.00 . A A . 1 VAL N 1 1
3 400 1 1 1 VAL O O 5.007 2.165 4.407 1.00 . A A . 1 VAL O 1 1
3 401 1 1 2 CYS C C 2.014 0.906 4.443 1.00 . A A . 2 CYS C 1 1
3 402 1 1 2 CYS CA C 3.227 0.074 4.847 1.00 . A A . 2 CYS CA 1 1
3 403 1 1 2 CYS CB C 2.777 -1.290 5.372 1.00 . A A . 2 CYS CB 1 1
3 404 1 1 2 CYS H H 3.812 0.565 6.835 1.00 . A A . 2 CYS H 1 1
3 405 1 1 2 CYS HA H 3.870 -0.073 3.979 1.00 . A A . 2 CYS HA 1 1
3 406 1 1 2 CYS HB3 H 1.841 -1.177 5.919 1.00 . A A . 2 CYS HB3 1 1
3 407 1 1 2 CYS N N 3.990 0.782 5.867 1.00 . A A . 2 CYS N 1 1
3 408 1 1 2 CYS O O 1.634 1.833 5.156 1.00 . A A . 2 CYS O 1 1
3 409 1 1 2 CYS SG S 2.546 -2.549 4.103 1.00 . A A . 2 CYS SG 1 1
3 410 1 1 3 CYS C C -1.023 0.508 3.519 1.00 . A A . 3 CYS C 1 1
3 411 1 1 3 CYS CA C 0.158 1.250 2.905 1.00 . A A . 3 CYS CA 1 1
3 412 1 1 3 CYS CB C 0.041 1.269 1.384 1.00 . A A . 3 CYS CB 1 1
3 413 1 1 3 CYS H H 1.642 -0.270 2.829 1.00 . A A . 3 CYS H 1 1
3 414 1 1 3 CYS HA H 0.194 2.291 3.213 1.00 . A A . 3 CYS HA 1 1
3 415 1 1 3 CYS HB3 H -0.939 1.677 1.156 1.00 . A A . 3 CYS HB3 1 1
3 416 1 1 3 CYS N N 1.375 0.568 3.321 1.00 . A A . 3 CYS N 1 1
3 417 1 1 3 CYS O O -1.146 -0.684 3.248 1.00 . A A . 3 CYS O 1 1
3 418 1 1 3 CYS SG S 1.242 2.337 0.569 1.00 . A A . 3 CYS SG 1 1
3 419 1 1 4 PRO C C -4.011 0.038 3.898 1.00 . A A . 4 PRO C 1 1
3 420 1 1 4 PRO CA C -3.012 0.496 4.961 1.00 . A A . 4 PRO CA 1 1
3 421 1 1 4 PRO CB C -3.639 1.546 5.882 1.00 . A A . 4 PRO CB 1 1
3 422 1 1 4 PRO CD C -1.867 2.576 4.644 1.00 . A A . 4 PRO CD 1 1
3 423 1 1 4 PRO CG C -3.243 2.874 5.240 1.00 . A A . 4 PRO CG 1 1
3 424 1 1 4 PRO HA H -2.682 -0.360 5.551 1.00 . A A . 4 PRO HA 1 1
3 425 1 1 4 PRO HB3 H -3.187 1.473 6.872 1.00 . A A . 4 PRO HB3 1 1
3 426 1 1 4 PRO HD3 H -1.087 2.781 5.380 1.00 . A A . 4 PRO HD3 1 1
3 427 1 1 4 PRO HG3 H -3.215 3.693 5.959 1.00 . A A . 4 PRO HG3 1 1
3 428 1 1 4 PRO N N -1.874 1.155 4.335 1.00 . A A . 4 PRO N 1 1
3 429 1 1 4 PRO O O -3.921 0.457 2.748 1.00 . A A . 4 PRO O 1 1
3 430 1 1 5 PHE C C -6.649 -0.105 2.599 1.00 . A A . 5 PHE C 1 1
3 431 1 1 5 PHE CA C -6.030 -1.267 3.378 1.00 . A A . 5 PHE CA 1 1
3 432 1 1 5 PHE CB C -7.105 -2.046 4.154 1.00 . A A . 5 PHE CB 1 1
3 433 1 1 5 PHE CD1 C -5.702 -4.000 4.926 1.00 . A A . 5 PHE CD1 1 1
3 434 1 1 5 PHE CD2 C -6.718 -2.557 6.605 1.00 . A A . 5 PHE CD2 1 1
3 435 1 1 5 PHE CE1 C -5.002 -4.679 5.938 1.00 . A A . 5 PHE CE1 1 1
3 436 1 1 5 PHE CE2 C -5.997 -3.222 7.612 1.00 . A A . 5 PHE CE2 1 1
3 437 1 1 5 PHE CG C -6.555 -2.931 5.256 1.00 . A A . 5 PHE CG 1 1
3 438 1 1 5 PHE CZ C -5.127 -4.271 7.276 1.00 . A A . 5 PHE CZ 1 1
3 439 1 1 5 PHE H H -4.976 -1.150 5.228 1.00 . A A . 5 PHE H 1 1
3 440 1 1 5 PHE HA H -5.553 -1.943 2.666 1.00 . A A . 5 PHE HA 1 1
3 441 1 1 5 PHE HB3 H -7.660 -2.665 3.447 1.00 . A A . 5 PHE HB3 1 1
3 442 1 1 5 PHE HD1 H -5.508 -4.250 3.892 1.00 . A A . 5 PHE HD1 1 1
3 443 1 1 5 PHE HD2 H -7.347 -1.722 6.874 1.00 . A A . 5 PHE HD2 1 1
3 444 1 1 5 PHE HE1 H -4.286 -5.447 5.683 1.00 . A A . 5 PHE HE1 1 1
3 445 1 1 5 PHE HE2 H -6.062 -2.888 8.638 1.00 . A A . 5 PHE HE2 1 1
3 446 1 1 5 PHE HZ H -4.477 -4.703 8.025 1.00 . A A . 5 PHE HZ 1 1
3 447 1 1 5 PHE N N -4.993 -0.781 4.286 1.00 . A A . 5 PHE N 1 1
3 448 1 1 5 PHE O O -6.677 -0.110 1.371 1.00 . A A . 5 PHE O 1 1
3 449 1 1 6 GLY C C -6.355 3.033 2.319 1.00 . A A . 6 GLY C 1 1
3 450 1 1 6 GLY CA C -7.551 2.175 2.729 1.00 . A A . 6 GLY CA 1 1
3 451 1 1 6 GLY H H -6.981 0.892 4.323 1.00 . A A . 6 GLY H 1 1
3 452 1 1 6 GLY HA2 H -8.177 1.980 1.859 1.00 . A A . 6 GLY HA2 1 1
3 453 1 1 6 GLY HA3 H -8.143 2.716 3.467 1.00 . A A . 6 GLY HA3 1 1
3 454 1 1 6 GLY N N -7.092 0.928 3.322 1.00 . A A . 6 GLY N 1 1
3 455 1 1 6 GLY O O -6.170 4.130 2.840 1.00 . A A . 6 GLY O 1 1
3 456 1 1 7 GLY C C -3.589 2.404 -0.120 1.00 . A A . 7 GLY C 1 1
3 457 1 1 7 GLY CA C -4.317 3.195 0.965 1.00 . A A . 7 GLY CA 1 1
3 458 1 1 7 GLY H H -5.718 1.584 1.075 1.00 . A A . 7 GLY H 1 1
3 459 1 1 7 GLY HA2 H -4.569 4.183 0.576 1.00 . A A . 7 GLY HA2 1 1
3 460 1 1 7 GLY HA3 H -3.646 3.313 1.816 1.00 . A A . 7 GLY HA3 1 1
3 461 1 1 7 GLY N N -5.532 2.524 1.402 1.00 . A A . 7 GLY N 1 1
3 462 1 1 7 GLY O O -3.089 2.985 -1.080 1.00 . A A . 7 GLY O 1 1
3 463 1 1 8 CYS C C -3.402 0.315 -2.297 1.00 . A A . 8 CYS C 1 1
3 464 1 1 8 CYS CA C -2.791 0.227 -0.899 1.00 . A A . 8 CYS CA 1 1
3 465 1 1 8 CYS CB C -2.758 -1.226 -0.418 1.00 . A A . 8 CYS CB 1 1
3 466 1 1 8 CYS H H -3.912 0.654 0.858 1.00 . A A . 8 CYS H 1 1
3 467 1 1 8 CYS HA H -1.759 0.573 -0.953 1.00 . A A . 8 CYS HA 1 1
3 468 1 1 8 CYS HB3 H -3.757 -1.561 -0.139 1.00 . A A . 8 CYS HB3 1 1
3 469 1 1 8 CYS N N -3.497 1.081 0.041 1.00 . A A . 8 CYS N 1 1
3 470 1 1 8 CYS O O -4.620 0.287 -2.458 1.00 . A A . 8 CYS O 1 1
3 471 1 1 8 CYS SG S -2.144 -2.328 -1.719 1.00 . A A . 8 CYS SG 1 1
3 472 1 1 9 HIS C C -1.612 -0.409 -5.331 1.00 . A A . 9 HIS C 1 1
3 473 1 1 9 HIS CA C -2.836 0.248 -4.707 1.00 . A A . 9 HIS CA 1 1
3 474 1 1 9 HIS CB C -3.108 1.622 -5.337 1.00 . A A . 9 HIS CB 1 1
3 475 1 1 9 HIS CD2 C -5.398 2.555 -4.611 1.00 . A A . 9 HIS CD2 1 1
3 476 1 1 9 HIS CE1 C -6.596 1.902 -6.334 1.00 . A A . 9 HIS CE1 1 1
3 477 1 1 9 HIS CG C -4.576 1.904 -5.490 1.00 . A A . 9 HIS CG 1 1
3 478 1 1 9 HIS H H -1.539 0.336 -3.098 1.00 . A A . 9 HIS H 1 1
3 479 1 1 9 HIS HA H -3.689 -0.418 -4.853 1.00 . A A . 9 HIS HA 1 1
3 480 1 1 9 HIS HB3 H -2.686 1.676 -6.340 1.00 . A A . 9 HIS HB3 1 1
3 481 1 1 9 HIS HD1 H -4.975 0.965 -7.355 1.00 . A A . 9 HIS HD1 1 1
3 482 1 1 9 HIS HD2 H -5.109 2.984 -3.662 1.00 . A A . 9 HIS HD2 1 1
3 483 1 1 9 HIS HE1 H -7.426 1.725 -7.004 1.00 . A A . 9 HIS HE1 1 1
3 484 1 1 9 HIS N N -2.529 0.394 -3.301 1.00 . A A . 9 HIS N 1 1
3 485 1 1 9 HIS ND1 N -5.337 1.494 -6.557 1.00 . A A . 9 HIS ND1 1 1
3 486 1 1 9 HIS NE2 N -6.685 2.559 -5.164 1.00 . A A . 9 HIS NE2 1 1
3 487 1 1 9 HIS O O -0.616 -0.638 -4.644 1.00 . A A . 9 HIS O 1 1
3 488 1 1 10 GLU C C 0.704 -0.413 -7.281 1.00 . A A . 10 GLU C 1 1
3 489 1 1 10 GLU CA C -0.591 -1.219 -7.424 1.00 . A A . 10 GLU CA 1 1
3 490 1 1 10 GLU CB C -1.022 -1.351 -8.896 1.00 . A A . 10 GLU CB 1 1
3 491 1 1 10 GLU CD C -3.257 -0.179 -9.315 1.00 . A A . 10 GLU CD 1 1
3 492 1 1 10 GLU CG C -1.741 -0.119 -9.482 1.00 . A A . 10 GLU CG 1 1
3 493 1 1 10 GLU H H -2.512 -0.326 -7.117 1.00 . A A . 10 GLU H 1 1
3 494 1 1 10 GLU HA H -0.374 -2.212 -7.029 1.00 . A A . 10 GLU HA 1 1
3 495 1 1 10 GLU HB3 H -1.680 -2.214 -9.005 1.00 . A A . 10 GLU HB3 1 1
3 496 1 1 10 GLU HG3 H -1.545 -0.093 -10.554 1.00 . A A . 10 GLU HG3 1 1
3 497 1 1 10 GLU N N -1.674 -0.650 -6.636 1.00 . A A . 10 GLU N 1 1
3 498 1 1 10 GLU O O 1.799 -0.958 -7.394 1.00 . A A . 10 GLU O 1 1
3 499 1 1 10 GLU OE1 O -3.716 0.166 -8.203 1.00 . A A . 10 GLU OE1 1 1
3 500 1 1 10 GLU OE2 O -3.927 -0.581 -10.287 1.00 . A A . 10 GLU OE2 1 1
3 501 1 1 11 LEU C C 2.538 1.367 -5.607 1.00 . A A . 11 LEU C 1 1
3 502 1 1 11 LEU CA C 1.700 1.788 -6.825 1.00 . A A . 11 LEU CA 1 1
3 503 1 1 11 LEU CB C 1.163 3.224 -6.671 1.00 . A A . 11 LEU CB 1 1
3 504 1 1 11 LEU CD1 C 1.273 5.632 -7.337 1.00 . A A . 11 LEU CD1 1 1
3 505 1 1 11 LEU CD2 C 3.413 4.387 -6.998 1.00 . A A . 11 LEU CD2 1 1
3 506 1 1 11 LEU CG C 1.960 4.267 -7.470 1.00 . A A . 11 LEU CG 1 1
3 507 1 1 11 LEU H H -0.363 1.253 -6.942 1.00 . A A . 11 LEU H 1 1
3 508 1 1 11 LEU HA H 2.324 1.729 -7.719 1.00 . A A . 11 LEU HA 1 1
3 509 1 1 11 LEU HB3 H 1.139 3.503 -5.617 1.00 . A A . 11 LEU HB3 1 1
3 510 1 1 11 LEU HD11 H 1.266 5.947 -6.293 1.00 . A A . 11 LEU HD11 1 1
3 511 1 1 11 LEU HD12 H 1.806 6.375 -7.930 1.00 . A A . 11 LEU HD12 1 1
3 512 1 1 11 LEU HD13 H 0.246 5.569 -7.698 1.00 . A A . 11 LEU HD13 1 1
3 513 1 1 11 LEU HD21 H 3.447 4.550 -5.921 1.00 . A A . 11 LEU HD21 1 1
3 514 1 1 11 LEU HD22 H 3.965 3.481 -7.247 1.00 . A A . 11 LEU HD22 1 1
3 515 1 1 11 LEU HD23 H 3.895 5.225 -7.502 1.00 . A A . 11 LEU HD23 1 1
3 516 1 1 11 LEU HG H 1.951 3.981 -8.523 1.00 . A A . 11 LEU HG 1 1
3 517 1 1 11 LEU N N 0.575 0.888 -7.022 1.00 . A A . 11 LEU N 1 1
3 518 1 1 11 LEU O O 3.751 1.566 -5.586 1.00 . A A . 11 LEU O 1 1
3 519 1 1 12 CYS C C 2.987 -0.803 -3.079 1.00 . A A . 12 CYS C 1 1
3 520 1 1 12 CYS CA C 2.515 0.633 -3.265 1.00 . A A . 12 CYS CA 1 1
3 521 1 1 12 CYS CB C 1.567 1.041 -2.145 1.00 . A A . 12 CYS CB 1 1
3 522 1 1 12 CYS H H 0.930 0.533 -4.681 1.00 . A A . 12 CYS H 1 1
3 523 1 1 12 CYS HA H 3.376 1.299 -3.176 1.00 . A A . 12 CYS HA 1 1
3 524 1 1 12 CYS HB3 H 0.692 0.393 -2.107 1.00 . A A . 12 CYS HB3 1 1
3 525 1 1 12 CYS N N 1.890 0.832 -4.566 1.00 . A A . 12 CYS N 1 1
3 526 1 1 12 CYS O O 2.181 -1.715 -2.931 1.00 . A A . 12 CYS O 1 1
3 527 1 1 12 CYS SG S 2.402 1.021 -0.542 1.00 . A A . 12 CYS SG 1 1
3 528 1 1 13 TYR C C 4.539 -3.030 -1.682 1.00 . A A . 13 TYR C 1 1
3 529 1 1 13 TYR CA C 4.967 -2.267 -2.940 1.00 . A A . 13 TYR CA 1 1
3 530 1 1 13 TYR CB C 6.468 -1.962 -2.929 1.00 . A A . 13 TYR CB 1 1
3 531 1 1 13 TYR CD1 C 6.858 -0.752 -5.133 1.00 . A A . 13 TYR CD1 1 1
3 532 1 1 13 TYR CD2 C 8.019 -2.853 -4.723 1.00 . A A . 13 TYR CD2 1 1
3 533 1 1 13 TYR CE1 C 7.499 -0.646 -6.379 1.00 . A A . 13 TYR CE1 1 1
3 534 1 1 13 TYR CE2 C 8.665 -2.739 -5.966 1.00 . A A . 13 TYR CE2 1 1
3 535 1 1 13 TYR CG C 7.118 -1.857 -4.298 1.00 . A A . 13 TYR CG 1 1
3 536 1 1 13 TYR CZ C 8.403 -1.635 -6.794 1.00 . A A . 13 TYR CZ 1 1
3 537 1 1 13 TYR H H 4.943 -0.220 -3.148 1.00 . A A . 13 TYR H 1 1
3 538 1 1 13 TYR HA H 4.728 -2.882 -3.810 1.00 . A A . 13 TYR HA 1 1
3 539 1 1 13 TYR HB3 H 6.941 -2.753 -2.375 1.00 . A A . 13 TYR HB3 1 1
3 540 1 1 13 TYR HD1 H 6.175 0.025 -4.826 1.00 . A A . 13 TYR HD1 1 1
3 541 1 1 13 TYR HD2 H 8.231 -3.703 -4.091 1.00 . A A . 13 TYR HD2 1 1
3 542 1 1 13 TYR HE1 H 7.294 0.201 -7.019 1.00 . A A . 13 TYR HE1 1 1
3 543 1 1 13 TYR HE2 H 9.365 -3.503 -6.273 1.00 . A A . 13 TYR HE2 1 1
3 544 1 1 13 TYR HH H 9.633 -2.239 -8.181 1.00 . A A . 13 TYR HH 1 1
3 545 1 1 13 TYR N N 4.306 -0.992 -3.053 1.00 . A A . 13 TYR N 1 1
3 546 1 1 13 TYR O O 4.279 -4.227 -1.750 1.00 . A A . 13 TYR O 1 1
3 547 1 1 13 TYR OH O 9.038 -1.511 -7.995 1.00 . A A . 13 TYR OH 1 1
3 548 1 1 14 CYS C C 2.948 -3.628 0.908 1.00 . A A . 14 CYS C 1 1
3 549 1 1 14 CYS CA C 4.350 -3.038 0.755 1.00 . A A . 14 CYS CA 1 1
3 550 1 1 14 CYS CB C 4.703 -2.113 1.920 1.00 . A A . 14 CYS CB 1 1
3 551 1 1 14 CYS H H 4.744 -1.374 -0.537 1.00 . A A . 14 CYS H 1 1
3 552 1 1 14 CYS HA H 5.054 -3.870 0.791 1.00 . A A . 14 CYS HA 1 1
3 553 1 1 14 CYS HB3 H 4.099 -1.208 1.905 1.00 . A A . 14 CYS HB3 1 1
3 554 1 1 14 CYS N N 4.524 -2.357 -0.526 1.00 . A A . 14 CYS N 1 1
3 555 1 1 14 CYS O O 2.807 -4.832 1.092 1.00 . A A . 14 CYS O 1 1
3 556 1 1 14 CYS SG S 4.505 -2.943 3.515 1.00 . A A . 14 CYS SG 1 1
3 557 1 1 15 CYS C C 0.047 -4.004 1.959 1.00 . A A . 15 CYS C 1 1
3 558 1 1 15 CYS CA C 0.513 -3.130 0.784 1.00 . A A . 15 CYS CA 1 1
3 559 1 1 15 CYS CB C 0.203 -3.822 -0.539 1.00 . A A . 15 CYS CB 1 1
3 560 1 1 15 CYS H H 2.156 -1.801 0.674 1.00 . A A . 15 CYS H 1 1
3 561 1 1 15 CYS HA H -0.045 -2.195 0.813 1.00 . A A . 15 CYS HA 1 1
3 562 1 1 15 CYS HB3 H 0.709 -4.784 -0.551 1.00 . A A . 15 CYS HB3 1 1
3 563 1 1 15 CYS N N 1.927 -2.768 0.831 1.00 . A A . 15 CYS N 1 1
3 564 1 1 15 CYS O O 0.096 -5.230 1.896 1.00 . A A . 15 CYS O 1 1
3 565 1 1 15 CYS SG S -1.564 -4.095 -0.789 1.00 . A A . 15 CYS SG 1 1
3 566 1 1 16 ASP C C -2.034 -5.057 3.854 1.00 . A A . 16 ASP C 1 1
3 567 1 1 16 ASP CA C -0.910 -4.083 4.217 1.00 . A A . 16 ASP CA 1 1
3 568 1 1 16 ASP CB C -1.386 -3.067 5.262 1.00 . A A . 16 ASP CB 1 1
3 569 1 1 16 ASP CG C -1.809 -3.721 6.571 1.00 . A A . 16 ASP CG 1 1
3 570 1 1 16 ASP H H -0.539 -2.369 3.023 1.00 . A A . 16 ASP H 1 1
3 571 1 1 16 ASP HA H -0.083 -4.657 4.635 1.00 . A A . 16 ASP HA 1 1
3 572 1 1 16 ASP HB3 H -2.249 -2.535 4.864 1.00 . A A . 16 ASP HB3 1 1
3 573 1 1 16 ASP N N -0.431 -3.376 3.035 1.00 . A A . 16 ASP N 1 1
3 574 1 1 16 ASP O O -2.955 -4.707 3.112 1.00 . A A . 16 ASP O 1 1
3 575 1 1 16 ASP OD1 O -1.855 -4.970 6.605 1.00 . A A . 16 ASP OD1 1 1
3 576 1 1 16 ASP OD2 O -2.079 -2.950 7.515 1.00 . A A . 16 ASP OD2 1 1
4 577 1 1 1 VAL C C 5.378 2.551 4.952 1.00 . A A . 1 VAL C 1 1
4 578 1 1 1 VAL CA C 6.175 3.285 6.033 1.00 . A A . 1 VAL CA 1 1
4 579 1 1 1 VAL CB C 5.263 3.970 7.070 1.00 . A A . 1 VAL CB 1 1
4 580 1 1 1 VAL CG1 C 6.092 4.540 8.227 1.00 . A A . 1 VAL CG1 1 1
4 581 1 1 1 VAL CG2 C 4.406 5.083 6.452 1.00 . A A . 1 VAL CG2 1 1
4 582 1 1 1 VAL H1 H 6.892 4.343 4.391 1.00 . A A . 1 VAL H1 1 1
4 583 1 1 1 VAL HA H 6.805 2.554 6.541 1.00 . A A . 1 VAL HA 1 1
4 584 1 1 1 VAL HB H 4.590 3.219 7.488 1.00 . A A . 1 VAL HB 1 1
4 585 1 1 1 VAL HG11 H 5.428 4.962 8.980 1.00 . A A . 1 VAL HG11 1 1
4 586 1 1 1 VAL HG12 H 6.682 3.745 8.686 1.00 . A A . 1 VAL HG12 1 1
4 587 1 1 1 VAL HG13 H 6.763 5.320 7.867 1.00 . A A . 1 VAL HG13 1 1
4 588 1 1 1 VAL HG21 H 5.038 5.883 6.065 1.00 . A A . 1 VAL HG21 1 1
4 589 1 1 1 VAL HG22 H 3.795 4.688 5.641 1.00 . A A . 1 VAL HG22 1 1
4 590 1 1 1 VAL HG23 H 3.745 5.497 7.214 1.00 . A A . 1 VAL HG23 1 1
4 591 1 1 1 VAL N N 7.041 4.257 5.390 1.00 . A A . 1 VAL N 1 1
4 592 1 1 1 VAL O O 5.410 2.941 3.785 1.00 . A A . 1 VAL O 1 1
4 593 1 1 2 CYS C C 2.522 1.597 4.211 1.00 . A A . 2 CYS C 1 1
4 594 1 1 2 CYS CA C 3.781 0.767 4.437 1.00 . A A . 2 CYS CA 1 1
4 595 1 1 2 CYS CB C 3.386 -0.572 5.064 1.00 . A A . 2 CYS CB 1 1
4 596 1 1 2 CYS H H 4.660 1.241 6.316 1.00 . A A . 2 CYS H 1 1
4 597 1 1 2 CYS HA H 4.294 0.600 3.492 1.00 . A A . 2 CYS HA 1 1
4 598 1 1 2 CYS HB3 H 2.491 -0.444 5.674 1.00 . A A . 2 CYS HB3 1 1
4 599 1 1 2 CYS N N 4.677 1.482 5.338 1.00 . A A . 2 CYS N 1 1
4 600 1 1 2 CYS O O 2.239 2.499 5.000 1.00 . A A . 2 CYS O 1 1
4 601 1 1 2 CYS SG S 3.095 -1.918 3.909 1.00 . A A . 2 CYS SG 1 1
4 602 1 1 3 CYS C C -0.513 0.776 3.954 1.00 . A A . 3 CYS C 1 1
4 603 1 1 3 CYS CA C 0.349 1.760 3.177 1.00 . A A . 3 CYS CA 1 1
4 604 1 1 3 CYS CB C -0.206 1.888 1.765 1.00 . A A . 3 CYS CB 1 1
4 605 1 1 3 CYS H H 1.925 0.441 2.642 1.00 . A A . 3 CYS H 1 1
4 606 1 1 3 CYS HA H 0.304 2.757 3.607 1.00 . A A . 3 CYS HA 1 1
4 607 1 1 3 CYS HB3 H -1.269 2.057 1.881 1.00 . A A . 3 CYS HB3 1 1
4 608 1 1 3 CYS N N 1.715 1.258 3.202 1.00 . A A . 3 CYS N 1 1
4 609 1 1 3 CYS O O -0.312 -0.424 3.768 1.00 . A A . 3 CYS O 1 1
4 610 1 1 3 CYS SG S 0.420 3.297 0.839 1.00 . A A . 3 CYS SG 1 1
4 611 1 1 4 PRO C C -3.335 -0.224 4.309 1.00 . A A . 4 PRO C 1 1
4 612 1 1 4 PRO CA C -2.452 0.380 5.401 1.00 . A A . 4 PRO CA 1 1
4 613 1 1 4 PRO CB C -3.278 1.288 6.315 1.00 . A A . 4 PRO CB 1 1
4 614 1 1 4 PRO CD C -1.780 2.646 5.027 1.00 . A A . 4 PRO CD 1 1
4 615 1 1 4 PRO CG C -3.179 2.656 5.643 1.00 . A A . 4 PRO CG 1 1
4 616 1 1 4 PRO HA H -1.975 -0.400 5.995 1.00 . A A . 4 PRO HA 1 1
4 617 1 1 4 PRO HB3 H -2.811 1.332 7.300 1.00 . A A . 4 PRO HB3 1 1
4 618 1 1 4 PRO HD3 H -1.057 3.058 5.733 1.00 . A A . 4 PRO HD3 1 1
4 619 1 1 4 PRO HG3 H -3.317 3.477 6.347 1.00 . A A . 4 PRO HG3 1 1
4 620 1 1 4 PRO N N -1.463 1.246 4.781 1.00 . A A . 4 PRO N 1 1
4 621 1 1 4 PRO O O -3.469 0.363 3.237 1.00 . A A . 4 PRO O 1 1
4 622 1 1 5 PHE C C -5.924 -1.031 3.149 1.00 . A A . 5 PHE C 1 1
4 623 1 1 5 PHE CA C -4.883 -2.022 3.670 1.00 . A A . 5 PHE CA 1 1
4 624 1 1 5 PHE CB C -5.516 -3.205 4.407 1.00 . A A . 5 PHE CB 1 1
4 625 1 1 5 PHE CD1 C -6.163 -4.698 2.493 1.00 . A A . 5 PHE CD1 1 1
4 626 1 1 5 PHE CD2 C -7.928 -3.739 3.869 1.00 . A A . 5 PHE CD2 1 1
4 627 1 1 5 PHE CE1 C -7.129 -5.308 1.675 1.00 . A A . 5 PHE CE1 1 1
4 628 1 1 5 PHE CE2 C -8.897 -4.351 3.054 1.00 . A A . 5 PHE CE2 1 1
4 629 1 1 5 PHE CG C -6.563 -3.927 3.595 1.00 . A A . 5 PHE CG 1 1
4 630 1 1 5 PHE CZ C -8.497 -5.139 1.959 1.00 . A A . 5 PHE CZ 1 1
4 631 1 1 5 PHE H H -3.735 -1.883 5.434 1.00 . A A . 5 PHE H 1 1
4 632 1 1 5 PHE HA H -4.317 -2.388 2.813 1.00 . A A . 5 PHE HA 1 1
4 633 1 1 5 PHE HB3 H -5.954 -2.858 5.344 1.00 . A A . 5 PHE HB3 1 1
4 634 1 1 5 PHE HD1 H -5.107 -4.786 2.271 1.00 . A A . 5 PHE HD1 1 1
4 635 1 1 5 PHE HD2 H -8.227 -3.108 4.693 1.00 . A A . 5 PHE HD2 1 1
4 636 1 1 5 PHE HE1 H -6.821 -5.893 0.821 1.00 . A A . 5 PHE HE1 1 1
4 637 1 1 5 PHE HE2 H -9.947 -4.205 3.261 1.00 . A A . 5 PHE HE2 1 1
4 638 1 1 5 PHE HZ H -9.241 -5.600 1.326 1.00 . A A . 5 PHE HZ 1 1
4 639 1 1 5 PHE N N -3.966 -1.366 4.583 1.00 . A A . 5 PHE N 1 1
4 640 1 1 5 PHE O O -6.135 -0.913 1.942 1.00 . A A . 5 PHE O 1 1
4 641 1 1 6 GLY C C -6.544 2.058 3.232 1.00 . A A . 6 GLY C 1 1
4 642 1 1 6 GLY CA C -7.381 0.866 3.703 1.00 . A A . 6 GLY CA 1 1
4 643 1 1 6 GLY H H -6.264 -0.374 5.024 1.00 . A A . 6 GLY H 1 1
4 644 1 1 6 GLY HA2 H -8.080 0.577 2.916 1.00 . A A . 6 GLY HA2 1 1
4 645 1 1 6 GLY HA3 H -7.955 1.157 4.584 1.00 . A A . 6 GLY HA3 1 1
4 646 1 1 6 GLY N N -6.524 -0.255 4.057 1.00 . A A . 6 GLY N 1 1
4 647 1 1 6 GLY O O -6.539 3.104 3.878 1.00 . A A . 6 GLY O 1 1
4 648 1 1 7 GLY C C -4.143 2.398 0.387 1.00 . A A . 7 GLY C 1 1
4 649 1 1 7 GLY CA C -4.968 2.933 1.557 1.00 . A A . 7 GLY CA 1 1
4 650 1 1 7 GLY H H -5.845 0.988 1.678 1.00 . A A . 7 GLY H 1 1
4 651 1 1 7 GLY HA2 H -5.579 3.770 1.216 1.00 . A A . 7 GLY HA2 1 1
4 652 1 1 7 GLY HA3 H -4.282 3.287 2.328 1.00 . A A . 7 GLY HA3 1 1
4 653 1 1 7 GLY N N -5.834 1.903 2.114 1.00 . A A . 7 GLY N 1 1
4 654 1 1 7 GLY O O -3.968 3.086 -0.619 1.00 . A A . 7 GLY O 1 1
4 655 1 1 8 CYS C C -3.413 0.585 -1.865 1.00 . A A . 8 CYS C 1 1
4 656 1 1 8 CYS CA C -2.785 0.528 -0.472 1.00 . A A . 8 CYS CA 1 1
4 657 1 1 8 CYS CB C -2.506 -0.927 -0.082 1.00 . A A . 8 CYS CB 1 1
4 658 1 1 8 CYS H H -3.799 0.676 1.387 1.00 . A A . 8 CYS H 1 1
4 659 1 1 8 CYS HA H -1.832 1.056 -0.505 1.00 . A A . 8 CYS HA 1 1
4 660 1 1 8 CYS HB3 H -3.432 -1.418 0.219 1.00 . A A . 8 CYS HB3 1 1
4 661 1 1 8 CYS N N -3.623 1.176 0.527 1.00 . A A . 8 CYS N 1 1
4 662 1 1 8 CYS O O -4.597 0.303 -2.029 1.00 . A A . 8 CYS O 1 1
4 663 1 1 8 CYS SG S -1.826 -1.865 -1.472 1.00 . A A . 8 CYS SG 1 1
4 664 1 1 9 HIS C C -1.590 -0.064 -4.712 1.00 . A A . 9 HIS C 1 1
4 665 1 1 9 HIS CA C -2.847 0.686 -4.262 1.00 . A A . 9 HIS CA 1 1
4 666 1 1 9 HIS CB C -3.049 2.017 -4.994 1.00 . A A . 9 HIS CB 1 1
4 667 1 1 9 HIS CD2 C -5.340 3.078 -5.452 1.00 . A A . 9 HIS CD2 1 1
4 668 1 1 9 HIS CE1 C -5.887 3.734 -3.433 1.00 . A A . 9 HIS CE1 1 1
4 669 1 1 9 HIS CG C -4.317 2.741 -4.605 1.00 . A A . 9 HIS CG 1 1
4 670 1 1 9 HIS H H -1.612 1.076 -2.700 1.00 . A A . 9 HIS H 1 1
4 671 1 1 9 HIS HA H -3.717 0.043 -4.408 1.00 . A A . 9 HIS HA 1 1
4 672 1 1 9 HIS HB3 H -3.097 1.817 -6.060 1.00 . A A . 9 HIS HB3 1 1
4 673 1 1 9 HIS HD1 H -4.153 3.041 -2.479 1.00 . A A . 9 HIS HD1 1 1
4 674 1 1 9 HIS HD2 H -5.380 2.880 -6.513 1.00 . A A . 9 HIS HD2 1 1
4 675 1 1 9 HIS HE1 H -6.431 4.150 -2.597 1.00 . A A . 9 HIS HE1 1 1
4 676 1 1 9 HIS N N -2.603 0.944 -2.863 1.00 . A A . 9 HIS N 1 1
4 677 1 1 9 HIS ND1 N -4.673 3.165 -3.342 1.00 . A A . 9 HIS ND1 1 1
4 678 1 1 9 HIS NE2 N -6.332 3.712 -4.699 1.00 . A A . 9 HIS NE2 1 1
4 679 1 1 9 HIS O O -0.629 -0.147 -3.941 1.00 . A A . 9 HIS O 1 1
4 680 1 1 10 GLU C C 0.861 -0.482 -6.410 1.00 . A A . 10 GLU C 1 1
4 681 1 1 10 GLU CA C -0.419 -1.324 -6.455 1.00 . A A . 10 GLU CA 1 1
4 682 1 1 10 GLU CB C -0.721 -1.865 -7.866 1.00 . A A . 10 GLU CB 1 1
4 683 1 1 10 GLU CD C -1.278 0.427 -8.858 1.00 . A A . 10 GLU CD 1 1
4 684 1 1 10 GLU CG C -1.697 -1.030 -8.719 1.00 . A A . 10 GLU CG 1 1
4 685 1 1 10 GLU H H -2.218 -0.227 -6.613 1.00 . A A . 10 GLU H 1 1
4 686 1 1 10 GLU HA H -0.231 -2.167 -5.789 1.00 . A A . 10 GLU HA 1 1
4 687 1 1 10 GLU HB3 H -1.153 -2.860 -7.763 1.00 . A A . 10 GLU HB3 1 1
4 688 1 1 10 GLU HG3 H -2.706 -1.081 -8.313 1.00 . A A . 10 GLU HG3 1 1
4 689 1 1 10 GLU N N -1.565 -0.595 -5.930 1.00 . A A . 10 GLU N 1 1
4 690 1 1 10 GLU O O 1.955 -1.019 -6.247 1.00 . A A . 10 GLU O 1 1
4 691 1 1 10 GLU OE1 O -1.579 1.185 -7.907 1.00 . A A . 10 GLU OE1 1 1
4 692 1 1 10 GLU OE2 O -0.642 0.746 -9.882 1.00 . A A . 10 GLU OE2 1 1
4 693 1 1 11 LEU C C 2.550 1.623 -5.078 1.00 . A A . 11 LEU C 1 1
4 694 1 1 11 LEU CA C 1.814 1.783 -6.410 1.00 . A A . 11 LEU CA 1 1
4 695 1 1 11 LEU CB C 1.216 3.189 -6.532 1.00 . A A . 11 LEU CB 1 1
4 696 1 1 11 LEU CD1 C -0.151 4.684 -8.015 1.00 . A A . 11 LEU CD1 1 1
4 697 1 1 11 LEU CD2 C 2.161 4.041 -8.724 1.00 . A A . 11 LEU CD2 1 1
4 698 1 1 11 LEU CG C 0.901 3.570 -7.986 1.00 . A A . 11 LEU CG 1 1
4 699 1 1 11 LEU H H -0.211 1.220 -6.677 1.00 . A A . 11 LEU H 1 1
4 700 1 1 11 LEU HA H 2.517 1.604 -7.222 1.00 . A A . 11 LEU HA 1 1
4 701 1 1 11 LEU HB3 H 1.911 3.905 -6.118 1.00 . A A . 11 LEU HB3 1 1
4 702 1 1 11 LEU HD11 H -0.369 4.959 -9.047 1.00 . A A . 11 LEU HD11 1 1
4 703 1 1 11 LEU HD12 H -1.071 4.330 -7.547 1.00 . A A . 11 LEU HD12 1 1
4 704 1 1 11 LEU HD13 H 0.213 5.559 -7.477 1.00 . A A . 11 LEU HD13 1 1
4 705 1 1 11 LEU HD21 H 2.580 4.919 -8.232 1.00 . A A . 11 LEU HD21 1 1
4 706 1 1 11 LEU HD22 H 2.911 3.250 -8.743 1.00 . A A . 11 LEU HD22 1 1
4 707 1 1 11 LEU HD23 H 1.905 4.298 -9.752 1.00 . A A . 11 LEU HD23 1 1
4 708 1 1 11 LEU HG H 0.498 2.704 -8.509 1.00 . A A . 11 LEU HG 1 1
4 709 1 1 11 LEU N N 0.721 0.841 -6.506 1.00 . A A . 11 LEU N 1 1
4 710 1 1 11 LEU O O 3.776 1.717 -5.013 1.00 . A A . 11 LEU O 1 1
4 711 1 1 12 CYS C C 2.885 0.060 -2.273 1.00 . A A . 12 CYS C 1 1
4 712 1 1 12 CYS CA C 2.359 1.440 -2.648 1.00 . A A . 12 CYS CA 1 1
4 713 1 1 12 CYS CB C 1.327 1.969 -1.663 1.00 . A A . 12 CYS CB 1 1
4 714 1 1 12 CYS H H 0.838 1.128 -4.117 1.00 . A A . 12 CYS H 1 1
4 715 1 1 12 CYS HA H 3.193 2.145 -2.622 1.00 . A A . 12 CYS HA 1 1
4 716 1 1 12 CYS HB3 H 0.555 1.223 -1.473 1.00 . A A . 12 CYS HB3 1 1
4 717 1 1 12 CYS N N 1.804 1.406 -3.993 1.00 . A A . 12 CYS N 1 1
4 718 1 1 12 CYS O O 2.361 -0.601 -1.380 1.00 . A A . 12 CYS O 1 1
4 719 1 1 12 CYS SG S 2.070 2.483 -0.103 1.00 . A A . 12 CYS SG 1 1
4 720 1 1 13 TYR C C 4.388 -2.529 -1.888 1.00 . A A . 13 TYR C 1 1
4 721 1 1 13 TYR CA C 4.526 -1.663 -3.134 1.00 . A A . 13 TYR CA 1 1
4 722 1 1 13 TYR CB C 6.010 -1.480 -3.477 1.00 . A A . 13 TYR CB 1 1
4 723 1 1 13 TYR CD1 C 6.671 -2.848 -5.500 1.00 . A A . 13 TYR CD1 1 1
4 724 1 1 13 TYR CD2 C 7.322 -3.643 -3.291 1.00 . A A . 13 TYR CD2 1 1
4 725 1 1 13 TYR CE1 C 7.346 -3.930 -6.089 1.00 . A A . 13 TYR CE1 1 1
4 726 1 1 13 TYR CE2 C 7.994 -4.726 -3.882 1.00 . A A . 13 TYR CE2 1 1
4 727 1 1 13 TYR CG C 6.670 -2.693 -4.101 1.00 . A A . 13 TYR CG 1 1
4 728 1 1 13 TYR CZ C 8.011 -4.868 -5.280 1.00 . A A . 13 TYR CZ 1 1
4 729 1 1 13 TYR H H 4.283 0.359 -3.644 1.00 . A A . 13 TYR H 1 1
4 730 1 1 13 TYR HA H 4.024 -2.157 -3.968 1.00 . A A . 13 TYR HA 1 1
4 731 1 1 13 TYR HB3 H 6.564 -1.195 -2.582 1.00 . A A . 13 TYR HB3 1 1
4 732 1 1 13 TYR HD1 H 6.167 -2.126 -6.126 1.00 . A A . 13 TYR HD1 1 1
4 733 1 1 13 TYR HD2 H 7.319 -3.537 -2.217 1.00 . A A . 13 TYR HD2 1 1
4 734 1 1 13 TYR HE1 H 7.353 -4.029 -7.164 1.00 . A A . 13 TYR HE1 1 1
4 735 1 1 13 TYR HE2 H 8.503 -5.450 -3.263 1.00 . A A . 13 TYR HE2 1 1
4 736 1 1 13 TYR HH H 8.639 -5.906 -6.804 1.00 . A A . 13 TYR HH 1 1
4 737 1 1 13 TYR N N 3.940 -0.334 -2.993 1.00 . A A . 13 TYR N 1 1
4 738 1 1 13 TYR O O 4.019 -3.697 -1.959 1.00 . A A . 13 TYR O 1 1
4 739 1 1 13 TYR OH O 8.688 -5.906 -5.846 1.00 . A A . 13 TYR OH 1 1
4 740 1 1 14 CYS C C 3.384 -3.216 0.868 1.00 . A A . 14 CYS C 1 1
4 741 1 1 14 CYS CA C 4.744 -2.593 0.545 1.00 . A A . 14 CYS CA 1 1
4 742 1 1 14 CYS CB C 5.167 -1.614 1.638 1.00 . A A . 14 CYS CB 1 1
4 743 1 1 14 CYS H H 4.964 -0.946 -0.854 1.00 . A A . 14 CYS H 1 1
4 744 1 1 14 CYS HA H 5.478 -3.401 0.517 1.00 . A A . 14 CYS HA 1 1
4 745 1 1 14 CYS HB3 H 4.560 -0.711 1.602 1.00 . A A . 14 CYS HB3 1 1
4 746 1 1 14 CYS N N 4.746 -1.930 -0.755 1.00 . A A . 14 CYS N 1 1
4 747 1 1 14 CYS O O 3.304 -4.396 1.193 1.00 . A A . 14 CYS O 1 1
4 748 1 1 14 CYS SG S 5.038 -2.345 3.285 1.00 . A A . 14 CYS SG 1 1
4 749 1 1 15 CYS C C 0.526 -3.734 1.957 1.00 . A A . 15 CYS C 1 1
4 750 1 1 15 CYS CA C 0.929 -2.792 0.810 1.00 . A A . 15 CYS CA 1 1
4 751 1 1 15 CYS CB C 0.562 -3.442 -0.525 1.00 . A A . 15 CYS CB 1 1
4 752 1 1 15 CYS H H 2.531 -1.466 0.429 1.00 . A A . 15 CYS H 1 1
4 753 1 1 15 CYS HA H 0.364 -1.865 0.912 1.00 . A A . 15 CYS HA 1 1
4 754 1 1 15 CYS HB3 H 1.053 -4.413 -0.599 1.00 . A A . 15 CYS HB3 1 1
4 755 1 1 15 CYS N N 2.334 -2.397 0.777 1.00 . A A . 15 CYS N 1 1
4 756 1 1 15 CYS O O 0.550 -4.954 1.807 1.00 . A A . 15 CYS O 1 1
4 757 1 1 15 CYS SG S -1.213 -3.699 -0.721 1.00 . A A . 15 CYS SG 1 1
4 758 1 1 16 ASP C C -1.709 -4.817 3.569 1.00 . A A . 16 ASP C 1 1
4 759 1 1 16 ASP CA C -0.550 -3.991 4.140 1.00 . A A . 16 ASP CA 1 1
4 760 1 1 16 ASP CB C -1.042 -3.070 5.259 1.00 . A A . 16 ASP CB 1 1
4 761 1 1 16 ASP CG C -2.088 -3.720 6.152 1.00 . A A . 16 ASP CG 1 1
4 762 1 1 16 ASP H H 0.032 -2.176 3.189 1.00 . A A . 16 ASP H 1 1
4 763 1 1 16 ASP HA H 0.182 -4.687 4.554 1.00 . A A . 16 ASP HA 1 1
4 764 1 1 16 ASP HB3 H -1.530 -2.232 4.781 1.00 . A A . 16 ASP HB3 1 1
4 765 1 1 16 ASP N N 0.078 -3.185 3.092 1.00 . A A . 16 ASP N 1 1
4 766 1 1 16 ASP O O -2.538 -4.301 2.817 1.00 . A A . 16 ASP O 1 1
4 767 1 1 16 ASP OD1 O -1.955 -4.938 6.390 1.00 . A A . 16 ASP OD1 1 1
4 768 1 1 16 ASP OD2 O -3.031 -2.987 6.530 1.00 . A A . 16 ASP OD2 1 1
5 769 1 1 1 VAL C C 4.984 2.357 4.906 1.00 . A A . 1 VAL C 1 1
5 770 1 1 1 VAL CA C 5.767 3.018 6.042 1.00 . A A . 1 VAL CA 1 1
5 771 1 1 1 VAL CB C 4.842 3.677 7.085 1.00 . A A . 1 VAL CB 1 1
5 772 1 1 1 VAL CG1 C 5.651 4.165 8.293 1.00 . A A . 1 VAL CG1 1 1
5 773 1 1 1 VAL CG2 C 4.035 4.845 6.499 1.00 . A A . 1 VAL CG2 1 1
5 774 1 1 1 VAL H1 H 6.563 4.128 4.473 1.00 . A A . 1 VAL H1 1 1
5 775 1 1 1 VAL HA H 6.363 2.248 6.533 1.00 . A A . 1 VAL HA 1 1
5 776 1 1 1 VAL HB H 4.137 2.927 7.445 1.00 . A A . 1 VAL HB 1 1
5 777 1 1 1 VAL HG11 H 6.353 4.941 7.993 1.00 . A A . 1 VAL HG11 1 1
5 778 1 1 1 VAL HG12 H 4.975 4.570 9.047 1.00 . A A . 1 VAL HG12 1 1
5 779 1 1 1 VAL HG13 H 6.202 3.332 8.730 1.00 . A A . 1 VAL HG13 1 1
5 780 1 1 1 VAL HG21 H 3.360 5.237 7.259 1.00 . A A . 1 VAL HG21 1 1
5 781 1 1 1 VAL HG22 H 4.700 5.645 6.175 1.00 . A A . 1 VAL HG22 1 1
5 782 1 1 1 VAL HG23 H 3.442 4.509 5.650 1.00 . A A . 1 VAL HG23 1 1
5 783 1 1 1 VAL N N 6.676 3.996 5.472 1.00 . A A . 1 VAL N 1 1
5 784 1 1 1 VAL O O 5.070 2.792 3.757 1.00 . A A . 1 VAL O 1 1
5 785 1 1 2 CYS C C 2.133 1.545 4.018 1.00 . A A . 2 CYS C 1 1
5 786 1 1 2 CYS CA C 3.343 0.652 4.268 1.00 . A A . 2 CYS CA 1 1
5 787 1 1 2 CYS CB C 2.867 -0.683 4.842 1.00 . A A . 2 CYS CB 1 1
5 788 1 1 2 CYS H H 4.174 1.023 6.190 1.00 . A A . 2 CYS H 1 1
5 789 1 1 2 CYS HA H 3.886 0.489 3.338 1.00 . A A . 2 CYS HA 1 1
5 790 1 1 2 CYS HB3 H 1.941 -0.540 5.399 1.00 . A A . 2 CYS HB3 1 1
5 791 1 1 2 CYS N N 4.232 1.301 5.224 1.00 . A A . 2 CYS N 1 1
5 792 1 1 2 CYS O O 1.853 2.429 4.827 1.00 . A A . 2 CYS O 1 1
5 793 1 1 2 CYS SG S 2.615 -2.005 3.652 1.00 . A A . 2 CYS SG 1 1
5 794 1 1 3 CYS C C -0.921 0.918 3.582 1.00 . A A . 3 CYS C 1 1
5 795 1 1 3 CYS CA C 0.032 1.872 2.878 1.00 . A A . 3 CYS CA 1 1
5 796 1 1 3 CYS CB C -0.431 2.064 1.440 1.00 . A A . 3 CYS CB 1 1
5 797 1 1 3 CYS H H 1.555 0.470 2.384 1.00 . A A . 3 CYS H 1 1
5 798 1 1 3 CYS HA H 0.025 2.861 3.331 1.00 . A A . 3 CYS HA 1 1
5 799 1 1 3 CYS HB3 H -1.479 2.329 1.504 1.00 . A A . 3 CYS HB3 1 1
5 800 1 1 3 CYS N N 1.362 1.281 2.960 1.00 . A A . 3 CYS N 1 1
5 801 1 1 3 CYS O O -0.824 -0.274 3.294 1.00 . A A . 3 CYS O 1 1
5 802 1 1 3 CYS SG S 0.377 3.412 0.566 1.00 . A A . 3 CYS SG 1 1
5 803 1 1 4 PRO C C -3.773 -0.025 4.122 1.00 . A A . 4 PRO C 1 1
5 804 1 1 4 PRO CA C -2.793 0.558 5.144 1.00 . A A . 4 PRO CA 1 1
5 805 1 1 4 PRO CB C -3.519 1.485 6.123 1.00 . A A . 4 PRO CB 1 1
5 806 1 1 4 PRO CD C -2.032 2.800 4.788 1.00 . A A . 4 PRO CD 1 1
5 807 1 1 4 PRO CG C -3.398 2.860 5.471 1.00 . A A . 4 PRO CG 1 1
5 808 1 1 4 PRO HA H -2.292 -0.222 5.712 1.00 . A A . 4 PRO HA 1 1
5 809 1 1 4 PRO HB3 H -2.987 1.488 7.075 1.00 . A A . 4 PRO HB3 1 1
5 810 1 1 4 PRO HD3 H -1.255 3.136 5.477 1.00 . A A . 4 PRO HD3 1 1
5 811 1 1 4 PRO HG3 H -3.465 3.673 6.196 1.00 . A A . 4 PRO HG3 1 1
5 812 1 1 4 PRO N N -1.813 1.398 4.466 1.00 . A A . 4 PRO N 1 1
5 813 1 1 4 PRO O O -3.897 0.526 3.029 1.00 . A A . 4 PRO O 1 1
5 814 1 1 5 PHE C C -6.432 -0.532 3.046 1.00 . A A . 5 PHE C 1 1
5 815 1 1 5 PHE CA C -5.556 -1.648 3.619 1.00 . A A . 5 PHE CA 1 1
5 816 1 1 5 PHE CB C -6.441 -2.639 4.393 1.00 . A A . 5 PHE CB 1 1
5 817 1 1 5 PHE CD1 C -5.721 -4.928 3.585 1.00 . A A . 5 PHE CD1 1 1
5 818 1 1 5 PHE CD2 C -5.447 -4.385 5.940 1.00 . A A . 5 PHE CD2 1 1
5 819 1 1 5 PHE CE1 C -5.182 -6.205 3.817 1.00 . A A . 5 PHE CE1 1 1
5 820 1 1 5 PHE CE2 C -4.884 -5.652 6.166 1.00 . A A . 5 PHE CE2 1 1
5 821 1 1 5 PHE CG C -5.835 -4.006 4.643 1.00 . A A . 5 PHE CG 1 1
5 822 1 1 5 PHE CZ C -4.753 -6.564 5.106 1.00 . A A . 5 PHE CZ 1 1
5 823 1 1 5 PHE H H -4.226 -1.606 5.320 1.00 . A A . 5 PHE H 1 1
5 824 1 1 5 PHE HA H -5.088 -2.160 2.777 1.00 . A A . 5 PHE HA 1 1
5 825 1 1 5 PHE HB3 H -7.350 -2.804 3.810 1.00 . A A . 5 PHE HB3 1 1
5 826 1 1 5 PHE HD1 H -5.987 -4.637 2.579 1.00 . A A . 5 PHE HD1 1 1
5 827 1 1 5 PHE HD2 H -5.455 -3.664 6.747 1.00 . A A . 5 PHE HD2 1 1
5 828 1 1 5 PHE HE1 H -5.048 -6.891 2.993 1.00 . A A . 5 PHE HE1 1 1
5 829 1 1 5 PHE HE2 H -4.448 -5.872 7.131 1.00 . A A . 5 PHE HE2 1 1
5 830 1 1 5 PHE HZ H -4.273 -7.516 5.276 1.00 . A A . 5 PHE HZ 1 1
5 831 1 1 5 PHE N N -4.500 -1.096 4.472 1.00 . A A . 5 PHE N 1 1
5 832 1 1 5 PHE O O -6.639 -0.450 1.837 1.00 . A A . 5 PHE O 1 1
5 833 1 1 6 GLY C C -6.714 2.621 2.993 1.00 . A A . 6 GLY C 1 1
5 834 1 1 6 GLY CA C -7.664 1.540 3.510 1.00 . A A . 6 GLY CA 1 1
5 835 1 1 6 GLY H H -6.672 0.257 4.888 1.00 . A A . 6 GLY H 1 1
5 836 1 1 6 GLY HA2 H -8.387 1.289 2.733 1.00 . A A . 6 GLY HA2 1 1
5 837 1 1 6 GLY HA3 H -8.207 1.925 4.375 1.00 . A A . 6 GLY HA3 1 1
5 838 1 1 6 GLY N N -6.922 0.356 3.916 1.00 . A A . 6 GLY N 1 1
5 839 1 1 6 GLY O O -6.640 3.705 3.568 1.00 . A A . 6 GLY O 1 1
5 840 1 1 7 GLY C C -4.261 2.634 0.170 1.00 . A A . 7 GLY C 1 1
5 841 1 1 7 GLY CA C -5.001 3.248 1.356 1.00 . A A . 7 GLY CA 1 1
5 842 1 1 7 GLY H H -6.047 1.391 1.540 1.00 . A A . 7 GLY H 1 1
5 843 1 1 7 GLY HA2 H -5.507 4.158 1.030 1.00 . A A . 7 GLY HA2 1 1
5 844 1 1 7 GLY HA3 H -4.269 3.507 2.121 1.00 . A A . 7 GLY HA3 1 1
5 845 1 1 7 GLY N N -5.979 2.329 1.919 1.00 . A A . 7 GLY N 1 1
5 846 1 1 7 GLY O O -4.055 3.299 -0.845 1.00 . A A . 7 GLY O 1 1
5 847 1 1 8 CYS C C -3.701 0.767 -2.092 1.00 . A A . 8 CYS C 1 1
5 848 1 1 8 CYS CA C -3.056 0.680 -0.710 1.00 . A A . 8 CYS CA 1 1
5 849 1 1 8 CYS CB C -2.831 -0.787 -0.331 1.00 . A A . 8 CYS CB 1 1
5 850 1 1 8 CYS H H -4.036 0.884 1.165 1.00 . A A . 8 CYS H 1 1
5 851 1 1 8 CYS HA H -2.079 1.160 -0.761 1.00 . A A . 8 CYS HA 1 1
5 852 1 1 8 CYS HB3 H -3.777 -1.249 -0.044 1.00 . A A . 8 CYS HB3 1 1
5 853 1 1 8 CYS N N -3.840 1.372 0.302 1.00 . A A . 8 CYS N 1 1
5 854 1 1 8 CYS O O -4.889 0.493 -2.252 1.00 . A A . 8 CYS O 1 1
5 855 1 1 8 CYS SG S -2.164 -1.723 -1.730 1.00 . A A . 8 CYS SG 1 1
5 856 1 1 9 HIS C C -1.874 0.236 -4.995 1.00 . A A . 9 HIS C 1 1
5 857 1 1 9 HIS CA C -3.150 0.911 -4.494 1.00 . A A . 9 HIS CA 1 1
5 858 1 1 9 HIS CB C -3.390 2.251 -5.197 1.00 . A A . 9 HIS CB 1 1
5 859 1 1 9 HIS CD2 C -5.731 3.236 -5.574 1.00 . A A . 9 HIS CD2 1 1
5 860 1 1 9 HIS CE1 C -6.194 3.935 -3.547 1.00 . A A . 9 HIS CE1 1 1
5 861 1 1 9 HIS CG C -4.661 2.946 -4.769 1.00 . A A . 9 HIS CG 1 1
5 862 1 1 9 HIS H H -1.910 1.280 -2.916 1.00 . A A . 9 HIS H 1 1
5 863 1 1 9 HIS HA H -3.999 0.243 -4.645 1.00 . A A . 9 HIS HA 1 1
5 864 1 1 9 HIS HB3 H -3.438 2.067 -6.267 1.00 . A A . 9 HIS HB3 1 1
5 865 1 1 9 HIS HD1 H -4.397 3.305 -2.665 1.00 . A A . 9 HIS HD1 1 1
5 866 1 1 9 HIS HD2 H -5.816 3.013 -6.627 1.00 . A A . 9 HIS HD2 1 1
5 867 1 1 9 HIS HE1 H -6.706 4.360 -2.698 1.00 . A A . 9 HIS HE1 1 1
5 868 1 1 9 HIS N N -2.897 1.137 -3.090 1.00 . A A . 9 HIS N 1 1
5 869 1 1 9 HIS ND1 N -4.965 3.396 -3.502 1.00 . A A . 9 HIS ND1 1 1
5 870 1 1 9 HIS NE2 N -6.700 3.868 -4.789 1.00 . A A . 9 HIS NE2 1 1
5 871 1 1 9 HIS O O -0.889 0.181 -4.258 1.00 . A A . 9 HIS O 1 1
5 872 1 1 10 GLU C C 0.586 -0.282 -6.682 1.00 . A A . 10 GLU C 1 1
5 873 1 1 10 GLU CA C -0.759 -1.008 -6.800 1.00 . A A . 10 GLU CA 1 1
5 874 1 1 10 GLU CB C -1.111 -1.344 -8.256 1.00 . A A . 10 GLU CB 1 1
5 875 1 1 10 GLU CD C -0.512 -2.568 -10.367 1.00 . A A . 10 GLU CD 1 1
5 876 1 1 10 GLU CG C -0.085 -2.252 -8.940 1.00 . A A . 10 GLU CG 1 1
5 877 1 1 10 GLU H H -2.703 -0.141 -6.793 1.00 . A A . 10 GLU H 1 1
5 878 1 1 10 GLU HA H -0.660 -1.918 -6.210 1.00 . A A . 10 GLU HA 1 1
5 879 1 1 10 GLU HB3 H -1.188 -0.423 -8.836 1.00 . A A . 10 GLU HB3 1 1
5 880 1 1 10 GLU HG3 H 0.015 -3.183 -8.380 1.00 . A A . 10 GLU HG3 1 1
5 881 1 1 10 GLU N N -1.868 -0.245 -6.236 1.00 . A A . 10 GLU N 1 1
5 882 1 1 10 GLU O O 1.630 -0.907 -6.508 1.00 . A A . 10 GLU O 1 1
5 883 1 1 10 GLU OE1 O -0.680 -1.591 -11.129 1.00 . A A . 10 GLU OE1 1 1
5 884 1 1 10 GLU OE2 O -0.681 -3.770 -10.662 1.00 . A A . 10 GLU OE2 1 1
5 885 1 1 11 LEU C C 2.469 1.625 -5.326 1.00 . A A . 11 LEU C 1 1
5 886 1 1 11 LEU CA C 1.753 1.878 -6.660 1.00 . A A . 11 LEU CA 1 1
5 887 1 1 11 LEU CB C 1.332 3.353 -6.814 1.00 . A A . 11 LEU CB 1 1
5 888 1 1 11 LEU CD1 C 1.789 5.670 -7.625 1.00 . A A . 11 LEU CD1 1 1
5 889 1 1 11 LEU CD2 C 3.699 4.342 -6.720 1.00 . A A . 11 LEU CD2 1 1
5 890 1 1 11 LEU CG C 2.377 4.261 -7.488 1.00 . A A . 11 LEU CG 1 1
5 891 1 1 11 LEU H H -0.350 1.490 -6.781 1.00 . A A . 11 LEU H 1 1
5 892 1 1 11 LEU HA H 2.414 1.605 -7.484 1.00 . A A . 11 LEU HA 1 1
5 893 1 1 11 LEU HB3 H 1.060 3.761 -5.839 1.00 . A A . 11 LEU HB3 1 1
5 894 1 1 11 LEU HD11 H 1.587 6.089 -6.638 1.00 . A A . 11 LEU HD11 1 1
5 895 1 1 11 LEU HD12 H 2.492 6.317 -8.150 1.00 . A A . 11 LEU HD12 1 1
5 896 1 1 11 LEU HD13 H 0.859 5.634 -8.194 1.00 . A A . 11 LEU HD13 1 1
5 897 1 1 11 LEU HD21 H 4.316 5.142 -7.131 1.00 . A A . 11 LEU HD21 1 1
5 898 1 1 11 LEU HD22 H 3.513 4.544 -5.665 1.00 . A A . 11 LEU HD22 1 1
5 899 1 1 11 LEU HD23 H 4.250 3.410 -6.828 1.00 . A A . 11 LEU HD23 1 1
5 900 1 1 11 LEU HG H 2.581 3.882 -8.491 1.00 . A A . 11 LEU HG 1 1
5 901 1 1 11 LEU N N 0.557 1.049 -6.747 1.00 . A A . 11 LEU N 1 1
5 902 1 1 11 LEU O O 3.698 1.594 -5.246 1.00 . A A . 11 LEU O 1 1
5 903 1 1 12 CYS C C 2.663 0.011 -2.532 1.00 . A A . 12 CYS C 1 1
5 904 1 1 12 CYS CA C 2.230 1.426 -2.898 1.00 . A A . 12 CYS CA 1 1
5 905 1 1 12 CYS CB C 1.219 2.010 -1.922 1.00 . A A . 12 CYS CB 1 1
5 906 1 1 12 CYS H H 0.718 1.227 -4.397 1.00 . A A . 12 CYS H 1 1
5 907 1 1 12 CYS HA H 3.107 2.075 -2.851 1.00 . A A . 12 CYS HA 1 1
5 908 1 1 12 CYS HB3 H 0.390 1.321 -1.762 1.00 . A A . 12 CYS HB3 1 1
5 909 1 1 12 CYS N N 1.696 1.448 -4.252 1.00 . A A . 12 CYS N 1 1
5 910 1 1 12 CYS O O 2.070 -0.635 -1.671 1.00 . A A . 12 CYS O 1 1
5 911 1 1 12 CYS SG S 1.964 2.441 -0.337 1.00 . A A . 12 CYS SG 1 1
5 912 1 1 13 TYR C C 4.064 -2.629 -2.094 1.00 . A A . 13 TYR C 1 1
5 913 1 1 13 TYR CA C 4.263 -1.776 -3.340 1.00 . A A . 13 TYR CA 1 1
5 914 1 1 13 TYR CB C 5.762 -1.645 -3.644 1.00 . A A . 13 TYR CB 1 1
5 915 1 1 13 TYR CD1 C 6.932 -3.888 -3.483 1.00 . A A . 13 TYR CD1 1 1
5 916 1 1 13 TYR CD2 C 6.465 -2.964 -5.685 1.00 . A A . 13 TYR CD2 1 1
5 917 1 1 13 TYR CE1 C 7.572 -4.988 -4.080 1.00 . A A . 13 TYR CE1 1 1
5 918 1 1 13 TYR CE2 C 7.109 -4.061 -6.282 1.00 . A A . 13 TYR CE2 1 1
5 919 1 1 13 TYR CG C 6.388 -2.867 -4.284 1.00 . A A . 13 TYR CG 1 1
5 920 1 1 13 TYR CZ C 7.662 -5.072 -5.480 1.00 . A A . 13 TYR CZ 1 1
5 921 1 1 13 TYR H H 4.110 0.254 -3.859 1.00 . A A . 13 TYR H 1 1
5 922 1 1 13 TYR HA H 3.767 -2.257 -4.186 1.00 . A A . 13 TYR HA 1 1
5 923 1 1 13 TYR HB3 H 6.305 -1.407 -2.728 1.00 . A A . 13 TYR HB3 1 1
5 924 1 1 13 TYR HD1 H 6.870 -3.826 -2.405 1.00 . A A . 13 TYR HD1 1 1
5 925 1 1 13 TYR HD2 H 6.044 -2.187 -6.309 1.00 . A A . 13 TYR HD2 1 1
5 926 1 1 13 TYR HE1 H 7.991 -5.763 -3.455 1.00 . A A . 13 TYR HE1 1 1
5 927 1 1 13 TYR HE2 H 7.180 -4.127 -7.357 1.00 . A A . 13 TYR HE2 1 1
5 928 1 1 13 TYR HH H 8.638 -6.759 -5.431 1.00 . A A . 13 TYR HH 1 1
5 929 1 1 13 TYR N N 3.720 -0.426 -3.222 1.00 . A A . 13 TYR N 1 1
5 930 1 1 13 TYR O O 3.677 -3.791 -2.171 1.00 . A A . 13 TYR O 1 1
5 931 1 1 13 TYR OH O 8.303 -6.123 -6.066 1.00 . A A . 13 TYR OH 1 1
5 932 1 1 14 CYS C C 2.951 -3.277 0.632 1.00 . A A . 14 CYS C 1 1
5 933 1 1 14 CYS CA C 4.337 -2.693 0.348 1.00 . A A . 14 CYS CA 1 1
5 934 1 1 14 CYS CB C 4.759 -1.725 1.451 1.00 . A A . 14 CYS CB 1 1
5 935 1 1 14 CYS H H 4.628 -1.051 -1.040 1.00 . A A . 14 CYS H 1 1
5 936 1 1 14 CYS HA H 5.048 -3.521 0.340 1.00 . A A . 14 CYS HA 1 1
5 937 1 1 14 CYS HB3 H 4.179 -0.805 1.402 1.00 . A A . 14 CYS HB3 1 1
5 938 1 1 14 CYS N N 4.392 -2.031 -0.951 1.00 . A A . 14 CYS N 1 1
5 939 1 1 14 CYS O O 2.828 -4.454 0.951 1.00 . A A . 14 CYS O 1 1
5 940 1 1 14 CYS SG S 4.573 -2.449 3.096 1.00 . A A . 14 CYS SG 1 1
5 941 1 1 15 CYS C C 0.059 -3.655 1.715 1.00 . A A . 15 CYS C 1 1
5 942 1 1 15 CYS CA C 0.511 -2.772 0.538 1.00 . A A . 15 CYS CA 1 1
5 943 1 1 15 CYS CB C 0.130 -3.443 -0.782 1.00 . A A . 15 CYS CB 1 1
5 944 1 1 15 CYS H H 2.161 -1.501 0.176 1.00 . A A . 15 CYS H 1 1
5 945 1 1 15 CYS HA H -0.011 -1.817 0.610 1.00 . A A . 15 CYS HA 1 1
5 946 1 1 15 CYS HB3 H 0.566 -4.442 -0.814 1.00 . A A . 15 CYS HB3 1 1
5 947 1 1 15 CYS N N 1.929 -2.427 0.514 1.00 . A A . 15 CYS N 1 1
5 948 1 1 15 CYS O O 0.051 -4.882 1.623 1.00 . A A . 15 CYS O 1 1
5 949 1 1 15 CYS SG S -1.652 -3.601 -1.005 1.00 . A A . 15 CYS SG 1 1
5 950 1 1 16 ASP C C -2.263 -4.493 3.460 1.00 . A A . 16 ASP C 1 1
5 951 1 1 16 ASP CA C -1.014 -3.739 3.928 1.00 . A A . 16 ASP CA 1 1
5 952 1 1 16 ASP CB C -1.404 -2.700 4.977 1.00 . A A . 16 ASP CB 1 1
5 953 1 1 16 ASP CG C -2.304 -3.238 6.073 1.00 . A A . 16 ASP CG 1 1
5 954 1 1 16 ASP H H -0.409 -2.022 2.838 1.00 . A A . 16 ASP H 1 1
5 955 1 1 16 ASP HA H -0.315 -4.453 4.363 1.00 . A A . 16 ASP HA 1 1
5 956 1 1 16 ASP HB3 H -1.995 -1.971 4.444 1.00 . A A . 16 ASP HB3 1 1
5 957 1 1 16 ASP N N -0.379 -3.035 2.814 1.00 . A A . 16 ASP N 1 1
5 958 1 1 16 ASP O O -2.920 -4.076 2.503 1.00 . A A . 16 ASP O 1 1
5 959 1 1 16 ASP OD1 O -2.068 -4.391 6.487 1.00 . A A . 16 ASP OD1 1 1
5 960 1 1 16 ASP OD2 O -3.220 -2.472 6.455 1.00 . A A . 16 ASP OD2 1 1
6 961 1 1 1 VAL C C 4.789 2.012 5.448 1.00 . A A . 1 VAL C 1 1
6 962 1 1 1 VAL CA C 5.431 2.785 6.603 1.00 . A A . 1 VAL CA 1 1
6 963 1 1 1 VAL CB C 4.381 3.443 7.519 1.00 . A A . 1 VAL CB 1 1
6 964 1 1 1 VAL CG1 C 5.053 4.067 8.750 1.00 . A A . 1 VAL CG1 1 1
6 965 1 1 1 VAL CG2 C 3.552 4.510 6.790 1.00 . A A . 1 VAL CG2 1 1
6 966 1 1 1 VAL H1 H 6.283 3.861 5.039 1.00 . A A . 1 VAL H1 1 1
6 967 1 1 1 VAL HA H 6.026 2.084 7.190 1.00 . A A . 1 VAL HA 1 1
6 968 1 1 1 VAL HB H 3.698 2.670 7.875 1.00 . A A . 1 VAL HB 1 1
6 969 1 1 1 VAL HG11 H 5.624 3.307 9.284 1.00 . A A . 1 VAL HG11 1 1
6 970 1 1 1 VAL HG12 H 5.723 4.873 8.450 1.00 . A A . 1 VAL HG12 1 1
6 971 1 1 1 VAL HG13 H 4.292 4.470 9.419 1.00 . A A . 1 VAL HG13 1 1
6 972 1 1 1 VAL HG21 H 4.190 5.329 6.456 1.00 . A A . 1 VAL HG21 1 1
6 973 1 1 1 VAL HG22 H 3.047 4.076 5.928 1.00 . A A . 1 VAL HG22 1 1
6 974 1 1 1 VAL HG23 H 2.797 4.909 7.468 1.00 . A A . 1 VAL HG23 1 1
6 975 1 1 1 VAL N N 6.327 3.784 6.050 1.00 . A A . 1 VAL N 1 1
6 976 1 1 1 VAL O O 4.924 2.406 4.289 1.00 . A A . 1 VAL O 1 1
6 977 1 1 2 CYS C C 2.076 0.919 4.413 1.00 . A A . 2 CYS C 1 1
6 978 1 1 2 CYS CA C 3.351 0.155 4.766 1.00 . A A . 2 CYS CA 1 1
6 979 1 1 2 CYS CB C 2.987 -1.220 5.325 1.00 . A A . 2 CYS CB 1 1
6 980 1 1 2 CYS H H 3.999 0.659 6.730 1.00 . A A . 2 CYS H 1 1
6 981 1 1 2 CYS HA H 3.965 0.032 3.872 1.00 . A A . 2 CYS HA 1 1
6 982 1 1 2 CYS HB3 H 2.068 -1.141 5.906 1.00 . A A . 2 CYS HB3 1 1
6 983 1 1 2 CYS N N 4.106 0.908 5.760 1.00 . A A . 2 CYS N 1 1
6 984 1 1 2 CYS O O 1.668 1.815 5.152 1.00 . A A . 2 CYS O 1 1
6 985 1 1 2 CYS SG S 2.764 -2.517 4.099 1.00 . A A . 2 CYS SG 1 1
6 986 1 1 3 CYS C C -0.987 0.407 3.561 1.00 . A A . 3 CYS C 1 1
6 987 1 1 3 CYS CA C 0.165 1.186 2.933 1.00 . A A . 3 CYS CA 1 1
6 988 1 1 3 CYS CB C 0.006 1.238 1.417 1.00 . A A . 3 CYS CB 1 1
6 989 1 1 3 CYS H H 1.720 -0.267 2.809 1.00 . A A . 3 CYS H 1 1
6 990 1 1 3 CYS HA H 0.172 2.223 3.256 1.00 . A A . 3 CYS HA 1 1
6 991 1 1 3 CYS HB3 H -1.012 1.562 1.236 1.00 . A A . 3 CYS HB3 1 1
6 992 1 1 3 CYS N N 1.420 0.553 3.313 1.00 . A A . 3 CYS N 1 1
6 993 1 1 3 CYS O O -1.047 -0.802 3.347 1.00 . A A . 3 CYS O 1 1
6 994 1 1 3 CYS SG S 1.067 2.449 0.606 1.00 . A A . 3 CYS SG 1 1
6 995 1 1 4 PRO C C -4.047 0.006 3.812 1.00 . A A . 4 PRO C 1 1
6 996 1 1 4 PRO CA C -3.048 0.393 4.903 1.00 . A A . 4 PRO CA 1 1
6 997 1 1 4 PRO CB C -3.660 1.424 5.855 1.00 . A A . 4 PRO CB 1 1
6 998 1 1 4 PRO CD C -1.914 2.481 4.603 1.00 . A A . 4 PRO CD 1 1
6 999 1 1 4 PRO CG C -3.287 2.760 5.215 1.00 . A A . 4 PRO CG 1 1
6 1000 1 1 4 PRO HA H -2.750 -0.495 5.461 1.00 . A A . 4 PRO HA 1 1
6 1001 1 1 4 PRO HB3 H -3.180 1.345 6.831 1.00 . A A . 4 PRO HB3 1 1
6 1002 1 1 4 PRO HD3 H -1.130 2.715 5.325 1.00 . A A . 4 PRO HD3 1 1
6 1003 1 1 4 PRO HG3 H -3.259 3.576 5.939 1.00 . A A . 4 PRO HG3 1 1
6 1004 1 1 4 PRO N N -1.891 1.054 4.316 1.00 . A A . 4 PRO N 1 1
6 1005 1 1 4 PRO O O -3.896 0.407 2.661 1.00 . A A . 4 PRO O 1 1
6 1006 1 1 5 PHE C C -6.705 0.162 2.544 1.00 . A A . 5 PHE C 1 1
6 1007 1 1 5 PHE CA C -6.192 -1.078 3.276 1.00 . A A . 5 PHE CA 1 1
6 1008 1 1 5 PHE CB C -7.331 -1.765 4.050 1.00 . A A . 5 PHE CB 1 1
6 1009 1 1 5 PHE CD1 C -6.220 -3.956 4.630 1.00 . A A . 5 PHE CD1 1 1
6 1010 1 1 5 PHE CD2 C -6.856 -2.455 6.440 1.00 . A A . 5 PHE CD2 1 1
6 1011 1 1 5 PHE CE1 C -5.565 -4.788 5.553 1.00 . A A . 5 PHE CE1 1 1
6 1012 1 1 5 PHE CE2 C -6.185 -3.279 7.359 1.00 . A A . 5 PHE CE2 1 1
6 1013 1 1 5 PHE CG C -6.856 -2.781 5.069 1.00 . A A . 5 PHE CG 1 1
6 1014 1 1 5 PHE CZ C -5.529 -4.438 6.913 1.00 . A A . 5 PHE CZ 1 1
6 1015 1 1 5 PHE H H -5.136 -1.088 5.126 1.00 . A A . 5 PHE H 1 1
6 1016 1 1 5 PHE HA H -5.795 -1.777 2.539 1.00 . A A . 5 PHE HA 1 1
6 1017 1 1 5 PHE HB3 H -7.985 -2.263 3.332 1.00 . A A . 5 PHE HB3 1 1
6 1018 1 1 5 PHE HD1 H -6.163 -4.188 3.576 1.00 . A A . 5 PHE HD1 1 1
6 1019 1 1 5 PHE HD2 H -7.318 -1.544 6.792 1.00 . A A . 5 PHE HD2 1 1
6 1020 1 1 5 PHE HE1 H -4.994 -5.639 5.210 1.00 . A A . 5 PHE HE1 1 1
6 1021 1 1 5 PHE HE2 H -6.118 -2.995 8.399 1.00 . A A . 5 PHE HE2 1 1
6 1022 1 1 5 PHE HZ H -4.910 -5.010 7.591 1.00 . A A . 5 PHE HZ 1 1
6 1023 1 1 5 PHE N N -5.105 -0.721 4.184 1.00 . A A . 5 PHE N 1 1
6 1024 1 1 5 PHE O O -6.760 0.194 1.317 1.00 . A A . 5 PHE O 1 1
6 1025 1 1 6 GLY C C -6.211 3.292 2.314 1.00 . A A . 6 GLY C 1 1
6 1026 1 1 6 GLY CA C -7.437 2.497 2.759 1.00 . A A . 6 GLY CA 1 1
6 1027 1 1 6 GLY H H -6.915 1.134 4.302 1.00 . A A . 6 GLY H 1 1
6 1028 1 1 6 GLY HA2 H -8.109 2.361 1.910 1.00 . A A . 6 GLY HA2 1 1
6 1029 1 1 6 GLY HA3 H -7.965 3.055 3.532 1.00 . A A . 6 GLY HA3 1 1
6 1030 1 1 6 GLY N N -7.038 1.209 3.305 1.00 . A A . 6 GLY N 1 1
6 1031 1 1 6 GLY O O -5.969 4.388 2.814 1.00 . A A . 6 GLY O 1 1
6 1032 1 1 7 GLY C C -3.591 2.567 -0.243 1.00 . A A . 7 GLY C 1 1
6 1033 1 1 7 GLY CA C -4.222 3.376 0.886 1.00 . A A . 7 GLY CA 1 1
6 1034 1 1 7 GLY H H -5.657 1.801 1.073 1.00 . A A . 7 GLY H 1 1
6 1035 1 1 7 GLY HA2 H -4.467 4.374 0.517 1.00 . A A . 7 GLY HA2 1 1
6 1036 1 1 7 GLY HA3 H -3.498 3.467 1.697 1.00 . A A . 7 GLY HA3 1 1
6 1037 1 1 7 GLY N N -5.426 2.736 1.390 1.00 . A A . 7 GLY N 1 1
6 1038 1 1 7 GLY O O -3.240 3.120 -1.285 1.00 . A A . 7 GLY O 1 1
6 1039 1 1 8 CYS C C -3.386 0.418 -2.352 1.00 . A A . 8 CYS C 1 1
6 1040 1 1 8 CYS CA C -2.737 0.385 -0.969 1.00 . A A . 8 CYS CA 1 1
6 1041 1 1 8 CYS CB C -2.677 -1.052 -0.447 1.00 . A A . 8 CYS CB 1 1
6 1042 1 1 8 CYS H H -3.751 0.860 0.835 1.00 . A A . 8 CYS H 1 1
6 1043 1 1 8 CYS HA H -1.709 0.738 -1.059 1.00 . A A . 8 CYS HA 1 1
6 1044 1 1 8 CYS HB3 H -3.669 -1.392 -0.150 1.00 . A A . 8 CYS HB3 1 1
6 1045 1 1 8 CYS N N -3.424 1.259 -0.033 1.00 . A A . 8 CYS N 1 1
6 1046 1 1 8 CYS O O -4.593 0.234 -2.487 1.00 . A A . 8 CYS O 1 1
6 1047 1 1 8 CYS SG S -2.060 -2.179 -1.722 1.00 . A A . 8 CYS SG 1 1
6 1048 1 1 9 HIS C C -1.602 -0.294 -5.300 1.00 . A A . 9 HIS C 1 1
6 1049 1 1 9 HIS CA C -2.844 0.424 -4.771 1.00 . A A . 9 HIS CA 1 1
6 1050 1 1 9 HIS CB C -3.045 1.775 -5.465 1.00 . A A . 9 HIS CB 1 1
6 1051 1 1 9 HIS CD2 C -5.439 2.665 -5.751 1.00 . A A . 9 HIS CD2 1 1
6 1052 1 1 9 HIS CE1 C -5.736 3.607 -3.793 1.00 . A A . 9 HIS CE1 1 1
6 1053 1 1 9 HIS CG C -4.291 2.503 -5.021 1.00 . A A . 9 HIS CG 1 1
6 1054 1 1 9 HIS H H -1.567 0.725 -3.201 1.00 . A A . 9 HIS H 1 1
6 1055 1 1 9 HIS HA H -3.720 -0.213 -4.904 1.00 . A A . 9 HIS HA 1 1
6 1056 1 1 9 HIS HB3 H -3.104 1.603 -6.537 1.00 . A A . 9 HIS HB3 1 1
6 1057 1 1 9 HIS HD1 H -3.843 3.121 -3.018 1.00 . A A . 9 HIS HD1 1 1
6 1058 1 1 9 HIS HD2 H -5.615 2.302 -6.753 1.00 . A A . 9 HIS HD2 1 1
6 1059 1 1 9 HIS HE1 H -6.182 4.126 -2.956 1.00 . A A . 9 HIS HE1 1 1
6 1060 1 1 9 HIS N N -2.560 0.646 -3.372 1.00 . A A . 9 HIS N 1 1
6 1061 1 1 9 HIS ND1 N -4.491 3.102 -3.798 1.00 . A A . 9 HIS ND1 1 1
6 1062 1 1 9 HIS NE2 N -6.350 3.375 -4.964 1.00 . A A . 9 HIS NE2 1 1
6 1063 1 1 9 HIS O O -0.625 -0.426 -4.562 1.00 . A A . 9 HIS O 1 1
6 1064 1 1 10 GLU C C 0.839 -0.691 -7.033 1.00 . A A . 10 GLU C 1 1
6 1065 1 1 10 GLU CA C -0.489 -1.437 -7.171 1.00 . A A . 10 GLU CA 1 1
6 1066 1 1 10 GLU CB C -0.793 -1.695 -8.653 1.00 . A A . 10 GLU CB 1 1
6 1067 1 1 10 GLU CD C -2.366 -2.659 -10.357 1.00 . A A . 10 GLU CD 1 1
6 1068 1 1 10 GLU CG C -2.175 -2.319 -8.884 1.00 . A A . 10 GLU CG 1 1
6 1069 1 1 10 GLU H H -2.430 -0.574 -7.124 1.00 . A A . 10 GLU H 1 1
6 1070 1 1 10 GLU HA H -0.380 -2.381 -6.638 1.00 . A A . 10 GLU HA 1 1
6 1071 1 1 10 GLU HB3 H -0.034 -2.371 -9.053 1.00 . A A . 10 GLU HB3 1 1
6 1072 1 1 10 GLU HG3 H -2.966 -1.622 -8.620 1.00 . A A . 10 GLU HG3 1 1
6 1073 1 1 10 GLU N N -1.603 -0.712 -6.565 1.00 . A A . 10 GLU N 1 1
6 1074 1 1 10 GLU O O 1.902 -1.298 -6.938 1.00 . A A . 10 GLU O 1 1
6 1075 1 1 10 GLU OE1 O -2.422 -1.692 -11.146 1.00 . A A . 10 GLU OE1 1 1
6 1076 1 1 10 GLU OE2 O -2.437 -3.868 -10.659 1.00 . A A . 10 GLU OE2 1 1
6 1077 1 1 11 LEU C C 2.683 1.176 -5.577 1.00 . A A . 11 LEU C 1 1
6 1078 1 1 11 LEU CA C 1.903 1.531 -6.855 1.00 . A A . 11 LEU CA 1 1
6 1079 1 1 11 LEU CB C 1.377 2.979 -6.817 1.00 . A A . 11 LEU CB 1 1
6 1080 1 1 11 LEU CD1 C 1.626 5.404 -7.351 1.00 . A A . 11 LEU CD1 1 1
6 1081 1 1 11 LEU CD2 C 3.662 4.135 -6.658 1.00 . A A . 11 LEU CD2 1 1
6 1082 1 1 11 LEU CG C 2.325 4.040 -7.401 1.00 . A A . 11 LEU CG 1 1
6 1083 1 1 11 LEU H H -0.164 1.034 -7.083 1.00 . A A . 11 LEU H 1 1
6 1084 1 1 11 LEU HA H 2.555 1.407 -7.720 1.00 . A A . 11 LEU HA 1 1
6 1085 1 1 11 LEU HB3 H 1.109 3.245 -5.793 1.00 . A A . 11 LEU HB3 1 1
6 1086 1 1 11 LEU HD11 H 2.260 6.164 -7.808 1.00 . A A . 11 LEU HD11 1 1
6 1087 1 1 11 LEU HD12 H 0.685 5.361 -7.899 1.00 . A A . 11 LEU HD12 1 1
6 1088 1 1 11 LEU HD13 H 1.426 5.684 -6.316 1.00 . A A . 11 LEU HD13 1 1
6 1089 1 1 11 LEU HD21 H 4.203 5.024 -6.985 1.00 . A A . 11 LEU HD21 1 1
6 1090 1 1 11 LEU HD22 H 3.495 4.196 -5.583 1.00 . A A . 11 LEU HD22 1 1
6 1091 1 1 11 LEU HD23 H 4.278 3.269 -6.889 1.00 . A A . 11 LEU HD23 1 1
6 1092 1 1 11 LEU HG H 2.525 3.802 -8.447 1.00 . A A . 11 LEU HG 1 1
6 1093 1 1 11 LEU N N 0.762 0.640 -7.021 1.00 . A A . 11 LEU N 1 1
6 1094 1 1 11 LEU O O 3.912 1.225 -5.548 1.00 . A A . 11 LEU O 1 1
6 1095 1 1 12 CYS C C 2.901 -0.756 -2.897 1.00 . A A . 12 CYS C 1 1
6 1096 1 1 12 CYS CA C 2.545 0.698 -3.176 1.00 . A A . 12 CYS CA 1 1
6 1097 1 1 12 CYS CB C 1.603 1.244 -2.110 1.00 . A A . 12 CYS CB 1 1
6 1098 1 1 12 CYS H H 0.986 0.620 -4.624 1.00 . A A . 12 CYS H 1 1
6 1099 1 1 12 CYS HA H 3.453 1.300 -3.107 1.00 . A A . 12 CYS HA 1 1
6 1100 1 1 12 CYS HB3 H 0.689 0.653 -2.053 1.00 . A A . 12 CYS HB3 1 1
6 1101 1 1 12 CYS N N 1.964 0.846 -4.501 1.00 . A A . 12 CYS N 1 1
6 1102 1 1 12 CYS O O 2.073 -1.525 -2.420 1.00 . A A . 12 CYS O 1 1
6 1103 1 1 12 CYS SG S 2.391 1.283 -0.486 1.00 . A A . 12 CYS SG 1 1
6 1104 1 1 13 TYR C C 4.369 -3.128 -1.730 1.00 . A A . 13 TYR C 1 1
6 1105 1 1 13 TYR CA C 4.725 -2.427 -3.044 1.00 . A A . 13 TYR CA 1 1
6 1106 1 1 13 TYR CB C 6.233 -2.214 -3.175 1.00 . A A . 13 TYR CB 1 1
6 1107 1 1 13 TYR CD1 C 6.947 -2.815 -5.528 1.00 . A A . 13 TYR CD1 1 1
6 1108 1 1 13 TYR CD2 C 6.915 -0.466 -4.890 1.00 . A A . 13 TYR CD2 1 1
6 1109 1 1 13 TYR CE1 C 7.395 -2.459 -6.811 1.00 . A A . 13 TYR CE1 1 1
6 1110 1 1 13 TYR CE2 C 7.344 -0.110 -6.180 1.00 . A A . 13 TYR CE2 1 1
6 1111 1 1 13 TYR CG C 6.707 -1.820 -4.562 1.00 . A A . 13 TYR CG 1 1
6 1112 1 1 13 TYR CZ C 7.581 -1.108 -7.141 1.00 . A A . 13 TYR CZ 1 1
6 1113 1 1 13 TYR H H 4.807 -0.454 -3.560 1.00 . A A . 13 TYR H 1 1
6 1114 1 1 13 TYR HA H 4.375 -3.047 -3.871 1.00 . A A . 13 TYR HA 1 1
6 1115 1 1 13 TYR HB3 H 6.693 -3.146 -2.917 1.00 . A A . 13 TYR HB3 1 1
6 1116 1 1 13 TYR HD1 H 6.793 -3.857 -5.284 1.00 . A A . 13 TYR HD1 1 1
6 1117 1 1 13 TYR HD2 H 6.743 0.309 -4.157 1.00 . A A . 13 TYR HD2 1 1
6 1118 1 1 13 TYR HE1 H 7.586 -3.225 -7.549 1.00 . A A . 13 TYR HE1 1 1
6 1119 1 1 13 TYR HE2 H 7.479 0.933 -6.426 1.00 . A A . 13 TYR HE2 1 1
6 1120 1 1 13 TYR HH H 8.085 0.175 -8.518 1.00 . A A . 13 TYR HH 1 1
6 1121 1 1 13 TYR N N 4.154 -1.113 -3.172 1.00 . A A . 13 TYR N 1 1
6 1122 1 1 13 TYR O O 4.069 -4.317 -1.735 1.00 . A A . 13 TYR O 1 1
6 1123 1 1 13 TYR OH O 8.016 -0.772 -8.388 1.00 . A A . 13 TYR OH 1 1
6 1124 1 1 14 CYS C C 2.944 -3.613 0.963 1.00 . A A . 14 CYS C 1 1
6 1125 1 1 14 CYS CA C 4.342 -3.042 0.712 1.00 . A A . 14 CYS CA 1 1
6 1126 1 1 14 CYS CB C 4.779 -2.075 1.812 1.00 . A A . 14 CYS CB 1 1
6 1127 1 1 14 CYS H H 4.702 -1.439 -0.662 1.00 . A A . 14 CYS H 1 1
6 1128 1 1 14 CYS HA H 5.040 -3.881 0.740 1.00 . A A . 14 CYS HA 1 1
6 1129 1 1 14 CYS HB3 H 4.170 -1.172 1.810 1.00 . A A . 14 CYS HB3 1 1
6 1130 1 1 14 CYS N N 4.460 -2.415 -0.601 1.00 . A A . 14 CYS N 1 1
6 1131 1 1 14 CYS O O 2.807 -4.804 1.221 1.00 . A A . 14 CYS O 1 1
6 1132 1 1 14 CYS SG S 4.710 -2.844 3.444 1.00 . A A . 14 CYS SG 1 1
6 1133 1 1 15 CYS C C 0.097 -4.054 2.036 1.00 . A A . 15 CYS C 1 1
6 1134 1 1 15 CYS CA C 0.504 -3.137 0.871 1.00 . A A . 15 CYS CA 1 1
6 1135 1 1 15 CYS CB C 0.171 -3.791 -0.468 1.00 . A A . 15 CYS CB 1 1
6 1136 1 1 15 CYS H H 2.139 -1.801 0.668 1.00 . A A . 15 CYS H 1 1
6 1137 1 1 15 CYS HA H -0.074 -2.219 0.943 1.00 . A A . 15 CYS HA 1 1
6 1138 1 1 15 CYS HB3 H 0.638 -4.773 -0.502 1.00 . A A . 15 CYS HB3 1 1
6 1139 1 1 15 CYS N N 1.918 -2.758 0.884 1.00 . A A . 15 CYS N 1 1
6 1140 1 1 15 CYS O O -0.005 -5.267 1.867 1.00 . A A . 15 CYS O 1 1
6 1141 1 1 15 CYS SG S -1.601 -3.968 -0.761 1.00 . A A . 15 CYS SG 1 1
6 1142 1 1 16 ASP C C -0.222 -5.608 4.531 1.00 . A A . 16 ASP C 1 1
6 1143 1 1 16 ASP CA C -0.433 -4.089 4.499 1.00 . A A . 16 ASP CA 1 1
6 1144 1 1 16 ASP CB C -1.838 -3.682 4.937 1.00 . A A . 16 ASP CB 1 1
6 1145 1 1 16 ASP CG C -2.271 -4.425 6.193 1.00 . A A . 16 ASP CG 1 1
6 1146 1 1 16 ASP H H -0.277 -2.453 3.208 1.00 . A A . 16 ASP H 1 1
6 1147 1 1 16 ASP HA H 0.258 -3.665 5.228 1.00 . A A . 16 ASP HA 1 1
6 1148 1 1 16 ASP HB3 H -2.527 -3.886 4.119 1.00 . A A . 16 ASP HB3 1 1
6 1149 1 1 16 ASP N N -0.162 -3.458 3.208 1.00 . A A . 16 ASP N 1 1
6 1150 1 1 16 ASP O O 0.829 -6.076 4.970 1.00 . A A . 16 ASP O 1 1
6 1151 1 1 16 ASP OD1 O -2.554 -5.634 6.059 1.00 . A A . 16 ASP OD1 1 1
6 1152 1 1 16 ASP OD2 O -2.296 -3.776 7.258 1.00 . A A . 16 ASP OD2 1 1
7 1153 1 1 1 VAL C C 5.128 2.077 5.191 1.00 . A A . 1 VAL C 1 1
7 1154 1 1 1 VAL CA C 5.893 2.859 6.261 1.00 . A A . 1 VAL CA 1 1
7 1155 1 1 1 VAL CB C 4.961 3.751 7.105 1.00 . A A . 1 VAL CB 1 1
7 1156 1 1 1 VAL CG1 C 5.728 4.380 8.275 1.00 . A A . 1 VAL CG1 1 1
7 1157 1 1 1 VAL CG2 C 4.295 4.857 6.274 1.00 . A A . 1 VAL CG2 1 1
7 1158 1 1 1 VAL H1 H 6.862 3.647 4.597 1.00 . A A . 1 VAL H1 1 1
7 1159 1 1 1 VAL HA H 6.389 2.142 6.916 1.00 . A A . 1 VAL HA 1 1
7 1160 1 1 1 VAL HB H 4.174 3.125 7.528 1.00 . A A . 1 VAL HB 1 1
7 1161 1 1 1 VAL HG11 H 5.041 4.956 8.896 1.00 . A A . 1 VAL HG11 1 1
7 1162 1 1 1 VAL HG12 H 6.180 3.598 8.885 1.00 . A A . 1 VAL HG12 1 1
7 1163 1 1 1 VAL HG13 H 6.511 5.043 7.905 1.00 . A A . 1 VAL HG13 1 1
7 1164 1 1 1 VAL HG21 H 3.728 4.424 5.449 1.00 . A A . 1 VAL HG21 1 1
7 1165 1 1 1 VAL HG22 H 3.608 5.421 6.905 1.00 . A A . 1 VAL HG22 1 1
7 1166 1 1 1 VAL HG23 H 5.044 5.538 5.873 1.00 . A A . 1 VAL HG23 1 1
7 1167 1 1 1 VAL N N 6.916 3.657 5.609 1.00 . A A . 1 VAL N 1 1
7 1168 1 1 1 VAL O O 5.287 2.341 3.999 1.00 . A A . 1 VAL O 1 1
7 1169 1 1 2 CYS C C 2.247 1.331 4.344 1.00 . A A . 2 CYS C 1 1
7 1170 1 1 2 CYS CA C 3.403 0.408 4.714 1.00 . A A . 2 CYS CA 1 1
7 1171 1 1 2 CYS CB C 2.844 -0.833 5.411 1.00 . A A . 2 CYS CB 1 1
7 1172 1 1 2 CYS H H 4.191 0.977 6.606 1.00 . A A . 2 CYS H 1 1
7 1173 1 1 2 CYS HA H 3.953 0.118 3.819 1.00 . A A . 2 CYS HA 1 1
7 1174 1 1 2 CYS HB3 H 1.942 -0.568 5.961 1.00 . A A . 2 CYS HB3 1 1
7 1175 1 1 2 CYS N N 4.306 1.113 5.614 1.00 . A A . 2 CYS N 1 1
7 1176 1 1 2 CYS O O 2.014 2.320 5.039 1.00 . A A . 2 CYS O 1 1
7 1177 1 1 2 CYS SG S 2.461 -2.225 4.341 1.00 . A A . 2 CYS SG 1 1
7 1178 1 1 3 CYS C C -0.871 0.802 3.796 1.00 . A A . 3 CYS C 1 1
7 1179 1 1 3 CYS CA C 0.191 1.649 3.109 1.00 . A A . 3 CYS CA 1 1
7 1180 1 1 3 CYS CB C -0.160 1.787 1.634 1.00 . A A . 3 CYS CB 1 1
7 1181 1 1 3 CYS H H 1.627 0.112 2.834 1.00 . A A . 3 CYS H 1 1
7 1182 1 1 3 CYS HA H 0.218 2.660 3.507 1.00 . A A . 3 CYS HA 1 1
7 1183 1 1 3 CYS HB3 H -1.191 2.119 1.609 1.00 . A A . 3 CYS HB3 1 1
7 1184 1 1 3 CYS N N 1.474 0.990 3.311 1.00 . A A . 3 CYS N 1 1
7 1185 1 1 3 CYS O O -0.823 -0.415 3.619 1.00 . A A . 3 CYS O 1 1
7 1186 1 1 3 CYS SG S 0.794 3.030 0.749 1.00 . A A . 3 CYS SG 1 1
7 1187 1 1 4 PRO C C -3.825 0.152 3.985 1.00 . A A . 4 PRO C 1 1
7 1188 1 1 4 PRO CA C -2.941 0.685 5.114 1.00 . A A . 4 PRO CA 1 1
7 1189 1 1 4 PRO CB C -3.702 1.714 5.955 1.00 . A A . 4 PRO CB 1 1
7 1190 1 1 4 PRO CD C -1.956 2.837 4.757 1.00 . A A . 4 PRO CD 1 1
7 1191 1 1 4 PRO CG C -3.379 3.042 5.272 1.00 . A A . 4 PRO CG 1 1
7 1192 1 1 4 PRO HA H -2.594 -0.117 5.761 1.00 . A A . 4 PRO HA 1 1
7 1193 1 1 4 PRO HB3 H -3.298 1.720 6.969 1.00 . A A . 4 PRO HB3 1 1
7 1194 1 1 4 PRO HD3 H -1.236 3.161 5.510 1.00 . A A . 4 PRO HD3 1 1
7 1195 1 1 4 PRO HG3 H -3.458 3.890 5.954 1.00 . A A . 4 PRO HG3 1 1
7 1196 1 1 4 PRO N N -1.812 1.404 4.543 1.00 . A A . 4 PRO N 1 1
7 1197 1 1 4 PRO O O -3.772 0.683 2.878 1.00 . A A . 4 PRO O 1 1
7 1198 1 1 5 PHE C C -6.407 -0.169 2.650 1.00 . A A . 5 PHE C 1 1
7 1199 1 1 5 PHE CA C -5.633 -1.338 3.265 1.00 . A A . 5 PHE CA 1 1
7 1200 1 1 5 PHE CB C -6.600 -2.355 3.884 1.00 . A A . 5 PHE CB 1 1
7 1201 1 1 5 PHE CD1 C -5.829 -4.554 2.897 1.00 . A A . 5 PHE CD1 1 1
7 1202 1 1 5 PHE CD2 C -5.760 -4.277 5.314 1.00 . A A . 5 PHE CD2 1 1
7 1203 1 1 5 PHE CE1 C -5.333 -5.862 3.033 1.00 . A A . 5 PHE CE1 1 1
7 1204 1 1 5 PHE CE2 C -5.233 -5.573 5.447 1.00 . A A . 5 PHE CE2 1 1
7 1205 1 1 5 PHE CG C -6.037 -3.755 4.038 1.00 . A A . 5 PHE CG 1 1
7 1206 1 1 5 PHE CZ C -5.041 -6.374 4.309 1.00 . A A . 5 PHE CZ 1 1
7 1207 1 1 5 PHE H H -4.568 -1.344 5.146 1.00 . A A . 5 PHE H 1 1
7 1208 1 1 5 PHE HA H -5.082 -1.821 2.456 1.00 . A A . 5 PHE HA 1 1
7 1209 1 1 5 PHE HB3 H -7.472 -2.437 3.232 1.00 . A A . 5 PHE HB3 1 1
7 1210 1 1 5 PHE HD1 H -6.042 -4.164 1.912 1.00 . A A . 5 PHE HD1 1 1
7 1211 1 1 5 PHE HD2 H -5.862 -3.661 6.196 1.00 . A A . 5 PHE HD2 1 1
7 1212 1 1 5 PHE HE1 H -5.146 -6.465 2.156 1.00 . A A . 5 PHE HE1 1 1
7 1213 1 1 5 PHE HE2 H -4.897 -5.913 6.417 1.00 . A A . 5 PHE HE2 1 1
7 1214 1 1 5 PHE HZ H -4.582 -7.348 4.410 1.00 . A A . 5 PHE HZ 1 1
7 1215 1 1 5 PHE N N -4.668 -0.853 4.252 1.00 . A A . 5 PHE N 1 1
7 1216 1 1 5 PHE O O -6.532 -0.073 1.432 1.00 . A A . 5 PHE O 1 1
7 1217 1 1 6 GLY C C -6.443 2.990 2.585 1.00 . A A . 6 GLY C 1 1
7 1218 1 1 6 GLY CA C -7.505 1.990 3.047 1.00 . A A . 6 GLY CA 1 1
7 1219 1 1 6 GLY H H -6.711 0.629 4.478 1.00 . A A . 6 GLY H 1 1
7 1220 1 1 6 GLY HA2 H -8.203 1.797 2.232 1.00 . A A . 6 GLY HA2 1 1
7 1221 1 1 6 GLY HA3 H -8.061 2.421 3.881 1.00 . A A . 6 GLY HA3 1 1
7 1222 1 1 6 GLY N N -6.888 0.750 3.493 1.00 . A A . 6 GLY N 1 1
7 1223 1 1 6 GLY O O -6.298 4.056 3.179 1.00 . A A . 6 GLY O 1 1
7 1224 1 1 7 GLY C C -3.817 2.757 -0.066 1.00 . A A . 7 GLY C 1 1
7 1225 1 1 7 GLY CA C -4.625 3.485 1.006 1.00 . A A . 7 GLY CA 1 1
7 1226 1 1 7 GLY H H -5.844 1.731 1.130 1.00 . A A . 7 GLY H 1 1
7 1227 1 1 7 GLY HA2 H -5.055 4.393 0.581 1.00 . A A . 7 GLY HA2 1 1
7 1228 1 1 7 GLY HA3 H -3.949 3.761 1.817 1.00 . A A . 7 GLY HA3 1 1
7 1229 1 1 7 GLY N N -5.696 2.648 1.534 1.00 . A A . 7 GLY N 1 1
7 1230 1 1 7 GLY O O -3.452 3.349 -1.083 1.00 . A A . 7 GLY O 1 1
7 1231 1 1 8 CYS C C -3.265 0.680 -2.157 1.00 . A A . 8 CYS C 1 1
7 1232 1 1 8 CYS CA C -2.723 0.651 -0.728 1.00 . A A . 8 CYS CA 1 1
7 1233 1 1 8 CYS CB C -2.667 -0.792 -0.219 1.00 . A A . 8 CYS CB 1 1
7 1234 1 1 8 CYS H H -3.851 1.056 1.024 1.00 . A A . 8 CYS H 1 1
7 1235 1 1 8 CYS HA H -1.707 1.045 -0.737 1.00 . A A . 8 CYS HA 1 1
7 1236 1 1 8 CYS HB3 H -3.668 -1.134 0.037 1.00 . A A . 8 CYS HB3 1 1
7 1237 1 1 8 CYS N N -3.521 1.477 0.165 1.00 . A A . 8 CYS N 1 1
7 1238 1 1 8 CYS O O -4.465 0.527 -2.372 1.00 . A A . 8 CYS O 1 1
7 1239 1 1 8 CYS SG S -2.022 -1.919 -1.481 1.00 . A A . 8 CYS SG 1 1
7 1240 1 1 9 HIS C C -1.375 -0.305 -4.901 1.00 . A A . 9 HIS C 1 1
7 1241 1 1 9 HIS CA C -2.575 0.570 -4.523 1.00 . A A . 9 HIS CA 1 1
7 1242 1 1 9 HIS CB C -2.637 1.883 -5.310 1.00 . A A . 9 HIS CB 1 1
7 1243 1 1 9 HIS CD2 C -4.875 3.017 -5.859 1.00 . A A . 9 HIS CD2 1 1
7 1244 1 1 9 HIS CE1 C -5.336 3.939 -3.924 1.00 . A A . 9 HIS CE1 1 1
7 1245 1 1 9 HIS CG C -3.852 2.726 -4.996 1.00 . A A . 9 HIS CG 1 1
7 1246 1 1 9 HIS H H -1.378 0.906 -2.912 1.00 . A A . 9 HIS H 1 1
7 1247 1 1 9 HIS HA H -3.492 -0.001 -4.678 1.00 . A A . 9 HIS HA 1 1
7 1248 1 1 9 HIS HB3 H -2.671 1.643 -6.369 1.00 . A A . 9 HIS HB3 1 1
7 1249 1 1 9 HIS HD1 H -3.622 3.257 -2.926 1.00 . A A . 9 HIS HD1 1 1
7 1250 1 1 9 HIS HD2 H -4.952 2.694 -6.887 1.00 . A A . 9 HIS HD2 1 1
7 1251 1 1 9 HIS HE1 H -5.837 4.478 -3.134 1.00 . A A . 9 HIS HE1 1 1
7 1252 1 1 9 HIS N N -2.367 0.865 -3.125 1.00 . A A . 9 HIS N 1 1
7 1253 1 1 9 HIS ND1 N -4.153 3.315 -3.787 1.00 . A A . 9 HIS ND1 1 1
7 1254 1 1 9 HIS NE2 N -5.813 3.792 -5.170 1.00 . A A . 9 HIS NE2 1 1
7 1255 1 1 9 HIS O O -0.486 -0.506 -4.069 1.00 . A A . 9 HIS O 1 1
7 1256 1 1 10 GLU C C 1.130 -0.957 -6.448 1.00 . A A . 10 GLU C 1 1
7 1257 1 1 10 GLU CA C -0.229 -1.649 -6.605 1.00 . A A . 10 GLU CA 1 1
7 1258 1 1 10 GLU CB C -0.492 -2.114 -8.052 1.00 . A A . 10 GLU CB 1 1
7 1259 1 1 10 GLU CD C -0.724 0.247 -9.009 1.00 . A A . 10 GLU CD 1 1
7 1260 1 1 10 GLU CG C -1.311 -1.156 -8.940 1.00 . A A . 10 GLU CG 1 1
7 1261 1 1 10 GLU H H -1.887 -0.364 -6.844 1.00 . A A . 10 GLU H 1 1
7 1262 1 1 10 GLU HA H -0.183 -2.527 -5.961 1.00 . A A . 10 GLU HA 1 1
7 1263 1 1 10 GLU HB3 H -1.035 -3.059 -8.011 1.00 . A A . 10 GLU HB3 1 1
7 1264 1 1 10 GLU HG3 H -2.346 -1.101 -8.600 1.00 . A A . 10 GLU HG3 1 1
7 1265 1 1 10 GLU N N -1.322 -0.810 -6.130 1.00 . A A . 10 GLU N 1 1
7 1266 1 1 10 GLU O O 2.143 -1.618 -6.219 1.00 . A A . 10 GLU O 1 1
7 1267 1 1 10 GLU OE1 O -0.997 1.010 -8.055 1.00 . A A . 10 GLU OE1 1 1
7 1268 1 1 10 GLU OE2 O 0.007 0.516 -9.982 1.00 . A A . 10 GLU OE2 1 1
7 1269 1 1 11 LEU C C 2.960 0.905 -4.957 1.00 . A A . 11 LEU C 1 1
7 1270 1 1 11 LEU CA C 2.319 1.194 -6.317 1.00 . A A . 11 LEU CA 1 1
7 1271 1 1 11 LEU CB C 1.865 2.656 -6.395 1.00 . A A . 11 LEU CB 1 1
7 1272 1 1 11 LEU CD1 C 0.692 4.329 -7.855 1.00 . A A . 11 LEU CD1 1 1
7 1273 1 1 11 LEU CD2 C 2.982 3.542 -8.491 1.00 . A A . 11 LEU CD2 1 1
7 1274 1 1 11 LEU CG C 1.654 3.136 -7.840 1.00 . A A . 11 LEU CG 1 1
7 1275 1 1 11 LEU H H 0.279 0.856 -6.769 1.00 . A A . 11 LEU H 1 1
7 1276 1 1 11 LEU HA H 3.047 0.987 -7.101 1.00 . A A . 11 LEU HA 1 1
7 1277 1 1 11 LEU HB3 H 2.608 3.281 -5.920 1.00 . A A . 11 LEU HB3 1 1
7 1278 1 1 11 LEU HD11 H 0.549 4.675 -8.879 1.00 . A A . 11 LEU HD11 1 1
7 1279 1 1 11 LEU HD12 H -0.276 4.026 -7.453 1.00 . A A . 11 LEU HD12 1 1
7 1280 1 1 11 LEU HD13 H 1.094 5.145 -7.251 1.00 . A A . 11 LEU HD13 1 1
7 1281 1 1 11 LEU HD21 H 2.799 3.865 -9.516 1.00 . A A . 11 LEU HD21 1 1
7 1282 1 1 11 LEU HD22 H 3.439 4.361 -7.936 1.00 . A A . 11 LEU HD22 1 1
7 1283 1 1 11 LEU HD23 H 3.668 2.696 -8.511 1.00 . A A . 11 LEU HD23 1 1
7 1284 1 1 11 LEU HG H 1.214 2.334 -8.429 1.00 . A A . 11 LEU HG 1 1
7 1285 1 1 11 LEU N N 1.146 0.374 -6.525 1.00 . A A . 11 LEU N 1 1
7 1286 1 1 11 LEU O O 4.183 0.881 -4.829 1.00 . A A . 11 LEU O 1 1
7 1287 1 1 12 CYS C C 2.830 -0.706 -2.073 1.00 . A A . 12 CYS C 1 1
7 1288 1 1 12 CYS CA C 2.605 0.725 -2.542 1.00 . A A . 12 CYS CA 1 1
7 1289 1 1 12 CYS CB C 1.630 1.486 -1.654 1.00 . A A . 12 CYS CB 1 1
7 1290 1 1 12 CYS H H 1.154 0.558 -4.105 1.00 . A A . 12 CYS H 1 1
7 1291 1 1 12 CYS HA H 3.554 1.258 -2.474 1.00 . A A . 12 CYS HA 1 1
7 1292 1 1 12 CYS HB3 H 0.712 0.915 -1.514 1.00 . A A . 12 CYS HB3 1 1
7 1293 1 1 12 CYS N N 2.137 0.732 -3.920 1.00 . A A . 12 CYS N 1 1
7 1294 1 1 12 CYS O O 2.115 -1.218 -1.214 1.00 . A A . 12 CYS O 1 1
7 1295 1 1 12 CYS SG S 2.333 1.900 -0.046 1.00 . A A . 12 CYS SG 1 1
7 1296 1 1 13 TYR C C 3.926 -3.428 -1.318 1.00 . A A . 13 TYR C 1 1
7 1297 1 1 13 TYR CA C 4.215 -2.722 -2.639 1.00 . A A . 13 TYR CA 1 1
7 1298 1 1 13 TYR CB C 5.709 -2.747 -2.950 1.00 . A A . 13 TYR CB 1 1
7 1299 1 1 13 TYR CD1 C 5.786 -2.806 -5.483 1.00 . A A . 13 TYR CD1 1 1
7 1300 1 1 13 TYR CD2 C 6.820 -0.927 -4.328 1.00 . A A . 13 TYR CD2 1 1
7 1301 1 1 13 TYR CE1 C 6.164 -2.253 -6.719 1.00 . A A . 13 TYR CE1 1 1
7 1302 1 1 13 TYR CE2 C 7.198 -0.377 -5.564 1.00 . A A . 13 TYR CE2 1 1
7 1303 1 1 13 TYR CG C 6.115 -2.146 -4.284 1.00 . A A . 13 TYR CG 1 1
7 1304 1 1 13 TYR CZ C 6.860 -1.032 -6.759 1.00 . A A . 13 TYR CZ 1 1
7 1305 1 1 13 TYR H H 4.448 -0.813 -3.287 1.00 . A A . 13 TYR H 1 1
7 1306 1 1 13 TYR HA H 3.668 -3.233 -3.434 1.00 . A A . 13 TYR HA 1 1
7 1307 1 1 13 TYR HB3 H 5.983 -3.780 -2.958 1.00 . A A . 13 TYR HB3 1 1
7 1308 1 1 13 TYR HD1 H 5.245 -3.740 -5.458 1.00 . A A . 13 TYR HD1 1 1
7 1309 1 1 13 TYR HD2 H 7.063 -0.402 -3.415 1.00 . A A . 13 TYR HD2 1 1
7 1310 1 1 13 TYR HE1 H 5.908 -2.770 -7.632 1.00 . A A . 13 TYR HE1 1 1
7 1311 1 1 13 TYR HE2 H 7.725 0.565 -5.599 1.00 . A A . 13 TYR HE2 1 1
7 1312 1 1 13 TYR HH H 6.945 -1.015 -8.704 1.00 . A A . 13 TYR HH 1 1
7 1313 1 1 13 TYR N N 3.854 -1.329 -2.661 1.00 . A A . 13 TYR N 1 1
7 1314 1 1 13 TYR O O 3.410 -4.542 -1.304 1.00 . A A . 13 TYR O 1 1
7 1315 1 1 13 TYR OH O 7.249 -0.503 -7.953 1.00 . A A . 13 TYR OH 1 1
7 1316 1 1 14 CYS C C 2.721 -3.763 1.411 1.00 . A A . 14 CYS C 1 1
7 1317 1 1 14 CYS CA C 4.161 -3.335 1.126 1.00 . A A . 14 CYS CA 1 1
7 1318 1 1 14 CYS CB C 4.649 -2.328 2.166 1.00 . A A . 14 CYS CB 1 1
7 1319 1 1 14 CYS H H 4.680 -1.856 -0.355 1.00 . A A . 14 CYS H 1 1
7 1320 1 1 14 CYS HA H 4.791 -4.223 1.202 1.00 . A A . 14 CYS HA 1 1
7 1321 1 1 14 CYS HB3 H 4.154 -1.366 2.035 1.00 . A A . 14 CYS HB3 1 1
7 1322 1 1 14 CYS N N 4.307 -2.784 -0.216 1.00 . A A . 14 CYS N 1 1
7 1323 1 1 14 CYS O O 2.479 -4.893 1.821 1.00 . A A . 14 CYS O 1 1
7 1324 1 1 14 CYS SG S 4.368 -2.909 3.854 1.00 . A A . 14 CYS SG 1 1
7 1325 1 1 15 CYS C C -0.220 -3.905 2.302 1.00 . A A . 15 CYS C 1 1
7 1326 1 1 15 CYS CA C 0.345 -3.081 1.133 1.00 . A A . 15 CYS CA 1 1
7 1327 1 1 15 CYS CB C -0.002 -3.758 -0.194 1.00 . A A . 15 CYS CB 1 1
7 1328 1 1 15 CYS H H 2.110 -1.959 0.803 1.00 . A A . 15 CYS H 1 1
7 1329 1 1 15 CYS HA H -0.119 -2.094 1.152 1.00 . A A . 15 CYS HA 1 1
7 1330 1 1 15 CYS HB3 H 0.344 -4.791 -0.174 1.00 . A A . 15 CYS HB3 1 1
7 1331 1 1 15 CYS N N 1.784 -2.840 1.183 1.00 . A A . 15 CYS N 1 1
7 1332 1 1 15 CYS O O -0.414 -5.111 2.176 1.00 . A A . 15 CYS O 1 1
7 1333 1 1 15 CYS SG S -1.769 -3.762 -0.553 1.00 . A A . 15 CYS SG 1 1
7 1334 1 1 16 ASP C C -2.186 -4.913 4.312 1.00 . A A . 16 ASP C 1 1
7 1335 1 1 16 ASP CA C -1.179 -3.797 4.617 1.00 . A A . 16 ASP CA 1 1
7 1336 1 1 16 ASP CB C -1.864 -2.624 5.326 1.00 . A A . 16 ASP CB 1 1
7 1337 1 1 16 ASP CG C -2.903 -2.990 6.373 1.00 . A A . 16 ASP CG 1 1
7 1338 1 1 16 ASP H H -0.417 -2.231 3.417 1.00 . A A . 16 ASP H 1 1
7 1339 1 1 16 ASP HA H -0.410 -4.205 5.275 1.00 . A A . 16 ASP HA 1 1
7 1340 1 1 16 ASP HB3 H -2.398 -2.080 4.554 1.00 . A A . 16 ASP HB3 1 1
7 1341 1 1 16 ASP N N -0.544 -3.238 3.417 1.00 . A A . 16 ASP N 1 1
7 1342 1 1 16 ASP O O -1.927 -6.089 4.570 1.00 . A A . 16 ASP O 1 1
7 1343 1 1 16 ASP OD1 O -2.726 -4.034 7.034 1.00 . A A . 16 ASP OD1 1 1
7 1344 1 1 16 ASP OD2 O -3.867 -2.197 6.478 1.00 . A A . 16 ASP OD2 1 1
8 1345 1 1 1 VAL C C 4.770 1.880 5.622 1.00 . A A . 1 VAL C 1 1
8 1346 1 1 1 VAL CA C 5.399 2.690 6.758 1.00 . A A . 1 VAL CA 1 1
8 1347 1 1 1 VAL CB C 4.359 3.539 7.513 1.00 . A A . 1 VAL CB 1 1
8 1348 1 1 1 VAL CG1 C 5.001 4.232 8.720 1.00 . A A . 1 VAL CG1 1 1
8 1349 1 1 1 VAL CG2 C 3.692 4.588 6.612 1.00 . A A . 1 VAL CG2 1 1
8 1350 1 1 1 VAL H1 H 6.472 3.529 5.186 1.00 . A A . 1 VAL H1 1 1
8 1351 1 1 1 VAL HA H 5.866 1.993 7.456 1.00 . A A . 1 VAL HA 1 1
8 1352 1 1 1 VAL HB H 3.579 2.874 7.890 1.00 . A A . 1 VAL HB 1 1
8 1353 1 1 1 VAL HG11 H 5.461 3.489 9.373 1.00 . A A . 1 VAL HG11 1 1
8 1354 1 1 1 VAL HG12 H 5.762 4.941 8.393 1.00 . A A . 1 VAL HG12 1 1
8 1355 1 1 1 VAL HG13 H 4.238 4.770 9.284 1.00 . A A . 1 VAL HG13 1 1
8 1356 1 1 1 VAL HG21 H 3.195 4.107 5.770 1.00 . A A . 1 VAL HG21 1 1
8 1357 1 1 1 VAL HG22 H 2.945 5.139 7.184 1.00 . A A . 1 VAL HG22 1 1
8 1358 1 1 1 VAL HG23 H 4.433 5.294 6.232 1.00 . A A . 1 VAL HG23 1 1
8 1359 1 1 1 VAL N N 6.440 3.533 6.199 1.00 . A A . 1 VAL N 1 1
8 1360 1 1 1 VAL O O 5.006 2.178 4.451 1.00 . A A . 1 VAL O 1 1
8 1361 1 1 2 CYS C C 1.987 0.878 4.566 1.00 . A A . 2 CYS C 1 1
8 1362 1 1 2 CYS CA C 3.235 0.096 4.968 1.00 . A A . 2 CYS CA 1 1
8 1363 1 1 2 CYS CB C 2.838 -1.268 5.531 1.00 . A A . 2 CYS CB 1 1
8 1364 1 1 2 CYS H H 3.788 0.689 6.936 1.00 . A A . 2 CYS H 1 1
8 1365 1 1 2 CYS HA H 3.868 -0.051 4.093 1.00 . A A . 2 CYS HA 1 1
8 1366 1 1 2 CYS HB3 H 1.909 -1.175 6.093 1.00 . A A . 2 CYS HB3 1 1
8 1367 1 1 2 CYS N N 3.984 0.857 5.961 1.00 . A A . 2 CYS N 1 1
8 1368 1 1 2 CYS O O 1.591 1.811 5.264 1.00 . A A . 2 CYS O 1 1
8 1369 1 1 2 CYS SG S 2.630 -2.564 4.298 1.00 . A A . 2 CYS SG 1 1
8 1370 1 1 3 CYS C C -1.067 0.335 3.603 1.00 . A A . 3 CYS C 1 1
8 1371 1 1 3 CYS CA C 0.106 1.130 3.038 1.00 . A A . 3 CYS CA 1 1
8 1372 1 1 3 CYS CB C 0.019 1.195 1.517 1.00 . A A . 3 CYS CB 1 1
8 1373 1 1 3 CYS H H 1.636 -0.346 2.985 1.00 . A A . 3 CYS H 1 1
8 1374 1 1 3 CYS HA H 0.093 2.164 3.373 1.00 . A A . 3 CYS HA 1 1
8 1375 1 1 3 CYS HB3 H -0.982 1.540 1.287 1.00 . A A . 3 CYS HB3 1 1
8 1376 1 1 3 CYS N N 1.342 0.492 3.465 1.00 . A A . 3 CYS N 1 1
8 1377 1 1 3 CYS O O -1.131 -0.863 3.329 1.00 . A A . 3 CYS O 1 1
8 1378 1 1 3 CYS SG S 1.149 2.384 0.769 1.00 . A A . 3 CYS SG 1 1
8 1379 1 1 4 PRO C C -4.100 -0.133 3.801 1.00 . A A . 4 PRO C 1 1
8 1380 1 1 4 PRO CA C -3.141 0.265 4.922 1.00 . A A . 4 PRO CA 1 1
8 1381 1 1 4 PRO CB C -3.799 1.272 5.869 1.00 . A A . 4 PRO CB 1 1
8 1382 1 1 4 PRO CD C -2.017 2.368 4.706 1.00 . A A . 4 PRO CD 1 1
8 1383 1 1 4 PRO CG C -3.411 2.625 5.276 1.00 . A A . 4 PRO CG 1 1
8 1384 1 1 4 PRO HA H -2.835 -0.623 5.477 1.00 . A A . 4 PRO HA 1 1
8 1385 1 1 4 PRO HB3 H -3.359 1.173 6.862 1.00 . A A . 4 PRO HB3 1 1
8 1386 1 1 4 PRO HD3 H -1.258 2.580 5.461 1.00 . A A . 4 PRO HD3 1 1
8 1387 1 1 4 PRO HG3 H -3.414 3.422 6.021 1.00 . A A . 4 PRO HG3 1 1
8 1388 1 1 4 PRO N N -1.981 0.952 4.372 1.00 . A A . 4 PRO N 1 1
8 1389 1 1 4 PRO O O -3.929 0.283 2.658 1.00 . A A . 4 PRO O 1 1
8 1390 1 1 5 PHE C C -6.717 -0.085 2.433 1.00 . A A . 5 PHE C 1 1
8 1391 1 1 5 PHE CA C -6.169 -1.307 3.174 1.00 . A A . 5 PHE CA 1 1
8 1392 1 1 5 PHE CB C -7.292 -2.078 3.887 1.00 . A A . 5 PHE CB 1 1
8 1393 1 1 5 PHE CD1 C -5.895 -4.023 4.687 1.00 . A A . 5 PHE CD1 1 1
8 1394 1 1 5 PHE CD2 C -7.053 -2.659 6.340 1.00 . A A . 5 PHE CD2 1 1
8 1395 1 1 5 PHE CE1 C -5.204 -4.680 5.718 1.00 . A A . 5 PHE CE1 1 1
8 1396 1 1 5 PHE CE2 C -6.364 -3.321 7.370 1.00 . A A . 5 PHE CE2 1 1
8 1397 1 1 5 PHE CG C -6.805 -2.993 4.993 1.00 . A A . 5 PHE CG 1 1
8 1398 1 1 5 PHE CZ C -5.424 -4.316 7.057 1.00 . A A . 5 PHE CZ 1 1
8 1399 1 1 5 PHE H H -5.203 -1.261 5.073 1.00 . A A . 5 PHE H 1 1
8 1400 1 1 5 PHE HA H -5.697 -1.971 2.447 1.00 . A A . 5 PHE HA 1 1
8 1401 1 1 5 PHE HB3 H -7.830 -2.672 3.146 1.00 . A A . 5 PHE HB3 1 1
8 1402 1 1 5 PHE HD1 H -5.659 -4.256 3.659 1.00 . A A . 5 PHE HD1 1 1
8 1403 1 1 5 PHE HD2 H -7.734 -1.859 6.593 1.00 . A A . 5 PHE HD2 1 1
8 1404 1 1 5 PHE HE1 H -4.437 -5.408 5.491 1.00 . A A . 5 PHE HE1 1 1
8 1405 1 1 5 PHE HE2 H -6.518 -3.033 8.400 1.00 . A A . 5 PHE HE2 1 1
8 1406 1 1 5 PHE HZ H -4.816 -4.763 7.833 1.00 . A A . 5 PHE HZ 1 1
8 1407 1 1 5 PHE N N -5.144 -0.899 4.132 1.00 . A A . 5 PHE N 1 1
8 1408 1 1 5 PHE O O -6.719 -0.038 1.205 1.00 . A A . 5 PHE O 1 1
8 1409 1 1 6 GLY C C -6.316 3.058 2.280 1.00 . A A . 6 GLY C 1 1
8 1410 1 1 6 GLY CA C -7.540 2.219 2.646 1.00 . A A . 6 GLY CA 1 1
8 1411 1 1 6 GLY H H -7.043 0.851 4.192 1.00 . A A . 6 GLY H 1 1
8 1412 1 1 6 GLY HA2 H -8.164 2.079 1.762 1.00 . A A . 6 GLY HA2 1 1
8 1413 1 1 6 GLY HA3 H -8.123 2.748 3.400 1.00 . A A . 6 GLY HA3 1 1
8 1414 1 1 6 GLY N N -7.129 0.935 3.191 1.00 . A A . 6 GLY N 1 1
8 1415 1 1 6 GLY O O -6.122 4.142 2.824 1.00 . A A . 6 GLY O 1 1
8 1416 1 1 7 GLY C C -3.560 2.461 -0.171 1.00 . A A . 7 GLY C 1 1
8 1417 1 1 7 GLY CA C -4.270 3.229 0.940 1.00 . A A . 7 GLY CA 1 1
8 1418 1 1 7 GLY H H -5.679 1.622 1.018 1.00 . A A . 7 GLY H 1 1
8 1419 1 1 7 GLY HA2 H -4.519 4.229 0.581 1.00 . A A . 7 GLY HA2 1 1
8 1420 1 1 7 GLY HA3 H -3.590 3.319 1.789 1.00 . A A . 7 GLY HA3 1 1
8 1421 1 1 7 GLY N N -5.483 2.552 1.370 1.00 . A A . 7 GLY N 1 1
8 1422 1 1 7 GLY O O -3.138 3.049 -1.162 1.00 . A A . 7 GLY O 1 1
8 1423 1 1 8 CYS C C -3.288 0.365 -2.329 1.00 . A A . 8 CYS C 1 1
8 1424 1 1 8 CYS CA C -2.672 0.308 -0.934 1.00 . A A . 8 CYS CA 1 1
8 1425 1 1 8 CYS CB C -2.603 -1.139 -0.445 1.00 . A A . 8 CYS CB 1 1
8 1426 1 1 8 CYS H H -3.785 0.713 0.830 1.00 . A A . 8 CYS H 1 1
8 1427 1 1 8 CYS HA H -1.648 0.681 -0.986 1.00 . A A . 8 CYS HA 1 1
8 1428 1 1 8 CYS HB3 H -3.600 -1.505 -0.199 1.00 . A A . 8 CYS HB3 1 1
8 1429 1 1 8 CYS N N -3.407 1.146 -0.001 1.00 . A A . 8 CYS N 1 1
8 1430 1 1 8 CYS O O -4.469 0.074 -2.510 1.00 . A A . 8 CYS O 1 1
8 1431 1 1 8 CYS SG S -1.913 -2.216 -1.725 1.00 . A A . 8 CYS SG 1 1
8 1432 1 1 9 HIS C C -1.468 -0.138 -5.265 1.00 . A A . 9 HIS C 1 1
8 1433 1 1 9 HIS CA C -2.719 0.562 -4.733 1.00 . A A . 9 HIS CA 1 1
8 1434 1 1 9 HIS CB C -2.905 1.935 -5.390 1.00 . A A . 9 HIS CB 1 1
8 1435 1 1 9 HIS CD2 C -4.448 3.983 -5.308 1.00 . A A . 9 HIS CD2 1 1
8 1436 1 1 9 HIS CE1 C -6.009 3.253 -3.951 1.00 . A A . 9 HIS CE1 1 1
8 1437 1 1 9 HIS CG C -4.129 2.702 -4.944 1.00 . A A . 9 HIS CG 1 1
8 1438 1 1 9 HIS H H -1.500 0.910 -3.111 1.00 . A A . 9 HIS H 1 1
8 1439 1 1 9 HIS HA H -3.589 -0.072 -4.915 1.00 . A A . 9 HIS HA 1 1
8 1440 1 1 9 HIS HB3 H -2.973 1.793 -6.466 1.00 . A A . 9 HIS HB3 1 1
8 1441 1 1 9 HIS HD1 H -5.153 1.358 -3.631 1.00 . A A . 9 HIS HD1 1 1
8 1442 1 1 9 HIS HD2 H -3.873 4.619 -5.964 1.00 . A A . 9 HIS HD2 1 1
8 1443 1 1 9 HIS HE1 H -6.892 3.200 -3.332 1.00 . A A . 9 HIS HE1 1 1
8 1444 1 1 9 HIS N N -2.473 0.733 -3.317 1.00 . A A . 9 HIS N 1 1
8 1445 1 1 9 HIS ND1 N -5.121 2.256 -4.098 1.00 . A A . 9 HIS ND1 1 1
8 1446 1 1 9 HIS NE2 N -5.647 4.325 -4.674 1.00 . A A . 9 HIS NE2 1 1
8 1447 1 1 9 HIS O O -0.501 -0.296 -4.519 1.00 . A A . 9 HIS O 1 1
8 1448 1 1 10 GLU C C 1.005 -0.476 -6.975 1.00 . A A . 10 GLU C 1 1
8 1449 1 1 10 GLU CA C -0.334 -1.195 -7.180 1.00 . A A . 10 GLU CA 1 1
8 1450 1 1 10 GLU CB C -0.655 -1.392 -8.668 1.00 . A A . 10 GLU CB 1 1
8 1451 1 1 10 GLU CD C -1.388 -0.346 -10.834 1.00 . A A . 10 GLU CD 1 1
8 1452 1 1 10 GLU CG C -0.958 -0.075 -9.401 1.00 . A A . 10 GLU CG 1 1
8 1453 1 1 10 GLU H H -2.276 -0.354 -7.111 1.00 . A A . 10 GLU H 1 1
8 1454 1 1 10 GLU HA H -0.230 -2.172 -6.707 1.00 . A A . 10 GLU HA 1 1
8 1455 1 1 10 GLU HB3 H -1.523 -2.046 -8.763 1.00 . A A . 10 GLU HB3 1 1
8 1456 1 1 10 GLU HG3 H -0.069 0.554 -9.423 1.00 . A A . 10 GLU HG3 1 1
8 1457 1 1 10 GLU N N -1.458 -0.517 -6.542 1.00 . A A . 10 GLU N 1 1
8 1458 1 1 10 GLU O O 2.054 -1.111 -6.910 1.00 . A A . 10 GLU O 1 1
8 1459 1 1 10 GLU OE1 O -2.538 -0.807 -10.992 1.00 . A A . 10 GLU OE1 1 1
8 1460 1 1 10 GLU OE2 O -0.557 -0.099 -11.734 1.00 . A A . 10 GLU OE2 1 1
8 1461 1 1 11 LEU C C 2.881 1.305 -5.364 1.00 . A A . 11 LEU C 1 1
8 1462 1 1 11 LEU CA C 2.124 1.693 -6.640 1.00 . A A . 11 LEU CA 1 1
8 1463 1 1 11 LEU CB C 1.618 3.136 -6.545 1.00 . A A . 11 LEU CB 1 1
8 1464 1 1 11 LEU CD1 C 0.168 4.826 -7.708 1.00 . A A . 11 LEU CD1 1 1
8 1465 1 1 11 LEU CD2 C 2.357 4.182 -8.732 1.00 . A A . 11 LEU CD2 1 1
8 1466 1 1 11 LEU CG C 1.165 3.680 -7.910 1.00 . A A . 11 LEU CG 1 1
8 1467 1 1 11 LEU H H 0.078 1.322 -6.902 1.00 . A A . 11 LEU H 1 1
8 1468 1 1 11 LEU HA H 2.791 1.601 -7.496 1.00 . A A . 11 LEU HA 1 1
8 1469 1 1 11 LEU HB3 H 2.407 3.764 -6.153 1.00 . A A . 11 LEU HB3 1 1
8 1470 1 1 11 LEU HD11 H 0.631 5.629 -7.134 1.00 . A A . 11 LEU HD11 1 1
8 1471 1 1 11 LEU HD12 H -0.148 5.215 -8.677 1.00 . A A . 11 LEU HD12 1 1
8 1472 1 1 11 LEU HD13 H -0.711 4.465 -7.173 1.00 . A A . 11 LEU HD13 1 1
8 1473 1 1 11 LEU HD21 H 3.066 3.374 -8.913 1.00 . A A . 11 LEU HD21 1 1
8 1474 1 1 11 LEU HD22 H 2.005 4.555 -9.694 1.00 . A A . 11 LEU HD22 1 1
8 1475 1 1 11 LEU HD23 H 2.865 4.990 -8.204 1.00 . A A . 11 LEU HD23 1 1
8 1476 1 1 11 LEU HG H 0.674 2.885 -8.469 1.00 . A A . 11 LEU HG 1 1
8 1477 1 1 11 LEU N N 0.967 0.852 -6.858 1.00 . A A . 11 LEU N 1 1
8 1478 1 1 11 LEU O O 4.100 1.454 -5.296 1.00 . A A . 11 LEU O 1 1
8 1479 1 1 12 CYS C C 3.042 -0.786 -2.751 1.00 . A A . 12 CYS C 1 1
8 1480 1 1 12 CYS CA C 2.704 0.677 -2.995 1.00 . A A . 12 CYS CA 1 1
8 1481 1 1 12 CYS CB C 1.733 1.196 -1.942 1.00 . A A . 12 CYS CB 1 1
8 1482 1 1 12 CYS H H 1.186 0.626 -4.483 1.00 . A A . 12 CYS H 1 1
8 1483 1 1 12 CYS HA H 3.612 1.272 -2.883 1.00 . A A . 12 CYS HA 1 1
8 1484 1 1 12 CYS HB3 H 0.816 0.607 -1.927 1.00 . A A . 12 CYS HB3 1 1
8 1485 1 1 12 CYS N N 2.156 0.868 -4.330 1.00 . A A . 12 CYS N 1 1
8 1486 1 1 12 CYS O O 2.174 -1.587 -2.420 1.00 . A A . 12 CYS O 1 1
8 1487 1 1 12 CYS SG S 2.473 1.192 -0.295 1.00 . A A . 12 CYS SG 1 1
8 1488 1 1 13 TYR C C 4.480 -3.164 -1.492 1.00 . A A . 13 TYR C 1 1
8 1489 1 1 13 TYR CA C 4.863 -2.455 -2.796 1.00 . A A . 13 TYR CA 1 1
8 1490 1 1 13 TYR CB C 6.377 -2.288 -2.932 1.00 . A A . 13 TYR CB 1 1
8 1491 1 1 13 TYR CD1 C 6.868 -0.816 -4.950 1.00 . A A . 13 TYR CD1 1 1
8 1492 1 1 13 TYR CD2 C 7.322 -3.203 -5.095 1.00 . A A . 13 TYR CD2 1 1
8 1493 1 1 13 TYR CE1 C 7.298 -0.654 -6.277 1.00 . A A . 13 TYR CE1 1 1
8 1494 1 1 13 TYR CE2 C 7.775 -3.036 -6.415 1.00 . A A . 13 TYR CE2 1 1
8 1495 1 1 13 TYR CG C 6.867 -2.094 -4.357 1.00 . A A . 13 TYR CG 1 1
8 1496 1 1 13 TYR CZ C 7.750 -1.764 -7.010 1.00 . A A . 13 TYR CZ 1 1
8 1497 1 1 13 TYR H H 5.015 -0.444 -3.152 1.00 . A A . 13 TYR H 1 1
8 1498 1 1 13 TYR HA H 4.491 -3.056 -3.629 1.00 . A A . 13 TYR HA 1 1
8 1499 1 1 13 TYR HB3 H 6.824 -3.178 -2.533 1.00 . A A . 13 TYR HB3 1 1
8 1500 1 1 13 TYR HD1 H 6.541 0.051 -4.395 1.00 . A A . 13 TYR HD1 1 1
8 1501 1 1 13 TYR HD2 H 7.328 -4.188 -4.650 1.00 . A A . 13 TYR HD2 1 1
8 1502 1 1 13 TYR HE1 H 7.270 0.328 -6.727 1.00 . A A . 13 TYR HE1 1 1
8 1503 1 1 13 TYR HE2 H 8.130 -3.886 -6.977 1.00 . A A . 13 TYR HE2 1 1
8 1504 1 1 13 TYR HH H 8.090 -0.714 -8.616 1.00 . A A . 13 TYR HH 1 1
8 1505 1 1 13 TYR N N 4.322 -1.125 -2.894 1.00 . A A . 13 TYR N 1 1
8 1506 1 1 13 TYR O O 4.188 -4.356 -1.511 1.00 . A A . 13 TYR O 1 1
8 1507 1 1 13 TYR OH O 8.184 -1.611 -8.293 1.00 . A A . 13 TYR OH 1 1
8 1508 1 1 14 CYS C C 2.964 -3.673 1.139 1.00 . A A . 14 CYS C 1 1
8 1509 1 1 14 CYS CA C 4.367 -3.093 0.949 1.00 . A A . 14 CYS CA 1 1
8 1510 1 1 14 CYS CB C 4.744 -2.132 2.077 1.00 . A A . 14 CYS CB 1 1
8 1511 1 1 14 CYS H H 4.770 -1.480 -0.404 1.00 . A A . 14 CYS H 1 1
8 1512 1 1 14 CYS HA H 5.069 -3.928 1.003 1.00 . A A . 14 CYS HA 1 1
8 1513 1 1 14 CYS HB3 H 4.133 -1.232 2.050 1.00 . A A . 14 CYS HB3 1 1
8 1514 1 1 14 CYS N N 4.530 -2.458 -0.356 1.00 . A A . 14 CYS N 1 1
8 1515 1 1 14 CYS O O 2.819 -4.866 1.376 1.00 . A A . 14 CYS O 1 1
8 1516 1 1 14 CYS SG S 4.594 -2.915 3.699 1.00 . A A . 14 CYS SG 1 1
8 1517 1 1 15 CYS C C 0.065 -4.111 2.080 1.00 . A A . 15 CYS C 1 1
8 1518 1 1 15 CYS CA C 0.534 -3.194 0.941 1.00 . A A . 15 CYS CA 1 1
8 1519 1 1 15 CYS CB C 0.270 -3.847 -0.415 1.00 . A A . 15 CYS CB 1 1
8 1520 1 1 15 CYS H H 2.172 -1.856 0.838 1.00 . A A . 15 CYS H 1 1
8 1521 1 1 15 CYS HA H -0.045 -2.273 0.985 1.00 . A A . 15 CYS HA 1 1
8 1522 1 1 15 CYS HB3 H 0.741 -4.828 -0.424 1.00 . A A . 15 CYS HB3 1 1
8 1523 1 1 15 CYS N N 1.942 -2.816 1.027 1.00 . A A . 15 CYS N 1 1
8 1524 1 1 15 CYS O O 0.002 -5.327 1.921 1.00 . A A . 15 CYS O 1 1
8 1525 1 1 15 CYS SG S -1.484 -4.030 -0.799 1.00 . A A . 15 CYS SG 1 1
8 1526 1 1 16 ASP C C -1.522 -5.408 4.296 1.00 . A A . 16 ASP C 1 1
8 1527 1 1 16 ASP CA C -0.578 -4.214 4.482 1.00 . A A . 16 ASP CA 1 1
8 1528 1 1 16 ASP CB C -1.172 -3.202 5.468 1.00 . A A . 16 ASP CB 1 1
8 1529 1 1 16 ASP CG C -1.406 -3.820 6.837 1.00 . A A . 16 ASP CG 1 1
8 1530 1 1 16 ASP H H -0.327 -2.508 3.252 1.00 . A A . 16 ASP H 1 1
8 1531 1 1 16 ASP HA H 0.361 -4.587 4.894 1.00 . A A . 16 ASP HA 1 1
8 1532 1 1 16 ASP HB3 H -2.129 -2.847 5.086 1.00 . A A . 16 ASP HB3 1 1
8 1533 1 1 16 ASP N N -0.285 -3.521 3.228 1.00 . A A . 16 ASP N 1 1
8 1534 1 1 16 ASP O O -1.132 -6.564 4.464 1.00 . A A . 16 ASP O 1 1
8 1535 1 1 16 ASP OD1 O -2.294 -4.694 6.914 1.00 . A A . 16 ASP OD1 1 1
8 1536 1 1 16 ASP OD2 O -0.702 -3.396 7.777 1.00 . A A . 16 ASP OD2 1 1
9 1537 1 1 1 VAL C C 5.356 2.445 4.994 1.00 . A A . 1 VAL C 1 1
9 1538 1 1 1 VAL CA C 6.115 3.189 6.096 1.00 . A A . 1 VAL CA 1 1
9 1539 1 1 1 VAL CB C 5.165 3.929 7.058 1.00 . A A . 1 VAL CB 1 1
9 1540 1 1 1 VAL CG1 C 5.945 4.516 8.241 1.00 . A A . 1 VAL CG1 1 1
9 1541 1 1 1 VAL CG2 C 4.375 5.044 6.359 1.00 . A A . 1 VAL CG2 1 1
9 1542 1 1 1 VAL H1 H 6.946 4.184 4.469 1.00 . A A . 1 VAL H1 1 1
9 1543 1 1 1 VAL HA H 6.693 2.456 6.661 1.00 . A A . 1 VAL HA 1 1
9 1544 1 1 1 VAL HB H 4.451 3.211 7.461 1.00 . A A . 1 VAL HB 1 1
9 1545 1 1 1 VAL HG11 H 6.488 3.724 8.757 1.00 . A A . 1 VAL HG11 1 1
9 1546 1 1 1 VAL HG12 H 6.654 5.268 7.896 1.00 . A A . 1 VAL HG12 1 1
9 1547 1 1 1 VAL HG13 H 5.251 4.981 8.944 1.00 . A A . 1 VAL HG13 1 1
9 1548 1 1 1 VAL HG21 H 3.685 5.501 7.070 1.00 . A A . 1 VAL HG21 1 1
9 1549 1 1 1 VAL HG22 H 5.050 5.813 5.982 1.00 . A A . 1 VAL HG22 1 1
9 1550 1 1 1 VAL HG23 H 3.797 4.639 5.530 1.00 . A A . 1 VAL HG23 1 1
9 1551 1 1 1 VAL N N 7.043 4.115 5.476 1.00 . A A . 1 VAL N 1 1
9 1552 1 1 1 VAL O O 5.447 2.815 3.822 1.00 . A A . 1 VAL O 1 1
9 1553 1 1 2 CYS C C 2.505 1.545 4.172 1.00 . A A . 2 CYS C 1 1
9 1554 1 1 2 CYS CA C 3.742 0.693 4.438 1.00 . A A . 2 CYS CA 1 1
9 1555 1 1 2 CYS CB C 3.306 -0.639 5.050 1.00 . A A . 2 CYS CB 1 1
9 1556 1 1 2 CYS H H 4.555 1.171 6.345 1.00 . A A . 2 CYS H 1 1
9 1557 1 1 2 CYS HA H 4.281 0.516 3.508 1.00 . A A . 2 CYS HA 1 1
9 1558 1 1 2 CYS HB3 H 2.406 -0.491 5.648 1.00 . A A . 2 CYS HB3 1 1
9 1559 1 1 2 CYS N N 4.620 1.396 5.365 1.00 . A A . 2 CYS N 1 1
9 1560 1 1 2 CYS O O 2.215 2.454 4.949 1.00 . A A . 2 CYS O 1 1
9 1561 1 1 2 CYS SG S 2.990 -1.966 3.879 1.00 . A A . 2 CYS SG 1 1
9 1562 1 1 3 CYS C C -0.523 0.787 3.838 1.00 . A A . 3 CYS C 1 1
9 1563 1 1 3 CYS CA C 0.370 1.749 3.067 1.00 . A A . 3 CYS CA 1 1
9 1564 1 1 3 CYS CB C -0.138 1.860 1.636 1.00 . A A . 3 CYS CB 1 1
9 1565 1 1 3 CYS H H 1.930 0.392 2.596 1.00 . A A . 3 CYS H 1 1
9 1566 1 1 3 CYS HA H 0.335 2.754 3.478 1.00 . A A . 3 CYS HA 1 1
9 1567 1 1 3 CYS HB3 H -1.196 2.078 1.719 1.00 . A A . 3 CYS HB3 1 1
9 1568 1 1 3 CYS N N 1.725 1.219 3.140 1.00 . A A . 3 CYS N 1 1
9 1569 1 1 3 CYS O O -0.378 -0.415 3.621 1.00 . A A . 3 CYS O 1 1
9 1570 1 1 3 CYS SG S 0.578 3.211 0.689 1.00 . A A . 3 CYS SG 1 1
9 1571 1 1 4 PRO C C -3.362 -0.155 4.352 1.00 . A A . 4 PRO C 1 1
9 1572 1 1 4 PRO CA C -2.397 0.431 5.382 1.00 . A A . 4 PRO CA 1 1
9 1573 1 1 4 PRO CB C -3.142 1.355 6.348 1.00 . A A . 4 PRO CB 1 1
9 1574 1 1 4 PRO CD C -1.686 2.681 4.982 1.00 . A A . 4 PRO CD 1 1
9 1575 1 1 4 PRO CG C -3.046 2.724 5.678 1.00 . A A . 4 PRO CG 1 1
9 1576 1 1 4 PRO HA H -1.900 -0.361 5.944 1.00 . A A . 4 PRO HA 1 1
9 1577 1 1 4 PRO HB3 H -2.616 1.381 7.304 1.00 . A A . 4 PRO HB3 1 1
9 1578 1 1 4 PRO HD3 H -0.912 3.064 5.649 1.00 . A A . 4 PRO HD3 1 1
9 1579 1 1 4 PRO HG3 H -3.122 3.544 6.393 1.00 . A A . 4 PRO HG3 1 1
9 1580 1 1 4 PRO N N -1.426 1.275 4.706 1.00 . A A . 4 PRO N 1 1
9 1581 1 1 4 PRO O O -3.527 0.416 3.277 1.00 . A A . 4 PRO O 1 1
9 1582 1 1 5 PHE C C -6.016 -0.887 3.302 1.00 . A A . 5 PHE C 1 1
9 1583 1 1 5 PHE CA C -5.012 -1.908 3.840 1.00 . A A . 5 PHE CA 1 1
9 1584 1 1 5 PHE CB C -5.690 -3.013 4.654 1.00 . A A . 5 PHE CB 1 1
9 1585 1 1 5 PHE CD1 C -6.313 -4.700 2.900 1.00 . A A . 5 PHE CD1 1 1
9 1586 1 1 5 PHE CD2 C -8.099 -3.517 4.057 1.00 . A A . 5 PHE CD2 1 1
9 1587 1 1 5 PHE CE1 C -7.266 -5.384 2.125 1.00 . A A . 5 PHE CE1 1 1
9 1588 1 1 5 PHE CE2 C -9.053 -4.198 3.282 1.00 . A A . 5 PHE CE2 1 1
9 1589 1 1 5 PHE CG C -6.730 -3.781 3.874 1.00 . A A . 5 PHE CG 1 1
9 1590 1 1 5 PHE CZ C -8.637 -5.136 2.320 1.00 . A A . 5 PHE CZ 1 1
9 1591 1 1 5 PHE H H -3.749 -1.777 5.528 1.00 . A A . 5 PHE H 1 1
9 1592 1 1 5 PHE HA H -4.496 -2.352 2.988 1.00 . A A . 5 PHE HA 1 1
9 1593 1 1 5 PHE HB3 H -6.142 -2.585 5.549 1.00 . A A . 5 PHE HB3 1 1
9 1594 1 1 5 PHE HD1 H -5.253 -4.852 2.741 1.00 . A A . 5 PHE HD1 1 1
9 1595 1 1 5 PHE HD2 H -8.415 -2.779 4.780 1.00 . A A . 5 PHE HD2 1 1
9 1596 1 1 5 PHE HE1 H -6.943 -6.088 1.372 1.00 . A A . 5 PHE HE1 1 1
9 1597 1 1 5 PHE HE2 H -10.105 -3.995 3.419 1.00 . A A . 5 PHE HE2 1 1
9 1598 1 1 5 PHE HZ H -9.370 -5.656 1.718 1.00 . A A . 5 PHE HZ 1 1
9 1599 1 1 5 PHE N N -4.024 -1.264 4.687 1.00 . A A . 5 PHE N 1 1
9 1600 1 1 5 PHE O O -6.237 -0.793 2.097 1.00 . A A . 5 PHE O 1 1
9 1601 1 1 6 GLY C C -6.512 2.228 3.322 1.00 . A A . 6 GLY C 1 1
9 1602 1 1 6 GLY CA C -7.390 1.079 3.822 1.00 . A A . 6 GLY CA 1 1
9 1603 1 1 6 GLY H H -6.301 -0.164 5.163 1.00 . A A . 6 GLY H 1 1
9 1604 1 1 6 GLY HA2 H -8.102 0.799 3.044 1.00 . A A . 6 GLY HA2 1 1
9 1605 1 1 6 GLY HA3 H -7.948 1.410 4.698 1.00 . A A . 6 GLY HA3 1 1
9 1606 1 1 6 GLY N N -6.572 -0.064 4.197 1.00 . A A . 6 GLY N 1 1
9 1607 1 1 6 GLY O O -6.476 3.292 3.937 1.00 . A A . 6 GLY O 1 1
9 1608 1 1 7 GLY C C -4.119 2.439 0.453 1.00 . A A . 7 GLY C 1 1
9 1609 1 1 7 GLY CA C -4.884 2.999 1.652 1.00 . A A . 7 GLY CA 1 1
9 1610 1 1 7 GLY H H -5.831 1.089 1.808 1.00 . A A . 7 GLY H 1 1
9 1611 1 1 7 GLY HA2 H -5.448 3.877 1.339 1.00 . A A . 7 GLY HA2 1 1
9 1612 1 1 7 GLY HA3 H -4.160 3.296 2.412 1.00 . A A . 7 GLY HA3 1 1
9 1613 1 1 7 GLY N N -5.798 2.016 2.216 1.00 . A A . 7 GLY N 1 1
9 1614 1 1 7 GLY O O -3.944 3.131 -0.550 1.00 . A A . 7 GLY O 1 1
9 1615 1 1 8 CYS C C -3.498 0.628 -1.843 1.00 . A A . 8 CYS C 1 1
9 1616 1 1 8 CYS CA C -2.833 0.557 -0.468 1.00 . A A . 8 CYS CA 1 1
9 1617 1 1 8 CYS CB C -2.528 -0.902 -0.110 1.00 . A A . 8 CYS CB 1 1
9 1618 1 1 8 CYS H H -3.816 0.682 1.413 1.00 . A A . 8 CYS H 1 1
9 1619 1 1 8 CYS HA H -1.882 1.088 -0.520 1.00 . A A . 8 CYS HA 1 1
9 1620 1 1 8 CYS HB3 H -3.448 -1.418 0.168 1.00 . A A . 8 CYS HB3 1 1
9 1621 1 1 8 CYS N N -3.643 1.195 0.559 1.00 . A A . 8 CYS N 1 1
9 1622 1 1 8 CYS O O -4.676 0.314 -1.990 1.00 . A A . 8 CYS O 1 1
9 1623 1 1 8 CYS SG S -1.815 -1.780 -1.524 1.00 . A A . 8 CYS SG 1 1
9 1624 1 1 9 HIS C C -1.720 0.152 -4.783 1.00 . A A . 9 HIS C 1 1
9 1625 1 1 9 HIS CA C -2.987 0.818 -4.251 1.00 . A A . 9 HIS CA 1 1
9 1626 1 1 9 HIS CB C -3.245 2.158 -4.942 1.00 . A A . 9 HIS CB 1 1
9 1627 1 1 9 HIS CD2 C -5.582 3.159 -5.292 1.00 . A A . 9 HIS CD2 1 1
9 1628 1 1 9 HIS CE1 C -6.047 3.799 -3.246 1.00 . A A . 9 HIS CE1 1 1
9 1629 1 1 9 HIS CG C -4.513 2.845 -4.495 1.00 . A A . 9 HIS CG 1 1
9 1630 1 1 9 HIS H H -1.737 1.208 -2.674 1.00 . A A . 9 HIS H 1 1
9 1631 1 1 9 HIS HA H -3.837 0.148 -4.397 1.00 . A A . 9 HIS HA 1 1
9 1632 1 1 9 HIS HB3 H -3.308 1.977 -6.013 1.00 . A A . 9 HIS HB3 1 1
9 1633 1 1 9 HIS HD1 H -4.253 3.143 -2.380 1.00 . A A . 9 HIS HD1 1 1
9 1634 1 1 9 HIS HD2 H -5.668 2.966 -6.351 1.00 . A A . 9 HIS HD2 1 1
9 1635 1 1 9 HIS HE1 H -6.561 4.199 -2.384 1.00 . A A . 9 HIS HE1 1 1
9 1636 1 1 9 HIS N N -2.719 1.034 -2.847 1.00 . A A . 9 HIS N 1 1
9 1637 1 1 9 HIS ND1 N -4.819 3.256 -3.215 1.00 . A A . 9 HIS ND1 1 1
9 1638 1 1 9 HIS NE2 N -6.552 3.770 -4.491 1.00 . A A . 9 HIS NE2 1 1
9 1639 1 1 9 HIS O O -0.713 0.109 -4.075 1.00 . A A . 9 HIS O 1 1
9 1640 1 1 10 GLU C C 0.695 -0.464 -6.573 1.00 . A A . 10 GLU C 1 1
9 1641 1 1 10 GLU CA C -0.675 -1.153 -6.584 1.00 . A A . 10 GLU CA 1 1
9 1642 1 1 10 GLU CB C -1.079 -1.611 -7.992 1.00 . A A . 10 GLU CB 1 1
9 1643 1 1 10 GLU CD C -1.880 -0.955 -10.286 1.00 . A A . 10 GLU CD 1 1
9 1644 1 1 10 GLU CG C -1.383 -0.443 -8.942 1.00 . A A . 10 GLU CG 1 1
9 1645 1 1 10 GLU H H -2.588 -0.233 -6.567 1.00 . A A . 10 GLU H 1 1
9 1646 1 1 10 GLU HA H -0.567 -2.031 -5.949 1.00 . A A . 10 GLU HA 1 1
9 1647 1 1 10 GLU HB3 H -1.969 -2.239 -7.923 1.00 . A A . 10 GLU HB3 1 1
9 1648 1 1 10 GLU HG3 H -0.480 0.142 -9.111 1.00 . A A . 10 GLU HG3 1 1
9 1649 1 1 10 GLU N N -1.748 -0.344 -6.019 1.00 . A A . 10 GLU N 1 1
9 1650 1 1 10 GLU O O 1.725 -1.133 -6.555 1.00 . A A . 10 GLU O 1 1
9 1651 1 1 10 GLU OE1 O -3.029 -1.446 -10.304 1.00 . A A . 10 GLU OE1 1 1
9 1652 1 1 10 GLU OE2 O -1.101 -0.854 -11.257 1.00 . A A . 10 GLU OE2 1 1
9 1653 1 1 11 LEU C C 2.685 1.428 -5.215 1.00 . A A . 11 LEU C 1 1
9 1654 1 1 11 LEU CA C 1.933 1.649 -6.533 1.00 . A A . 11 LEU CA 1 1
9 1655 1 1 11 LEU CB C 1.554 3.127 -6.681 1.00 . A A . 11 LEU CB 1 1
9 1656 1 1 11 LEU CD1 C -0.528 3.354 -8.157 1.00 . A A . 11 LEU CD1 1 1
9 1657 1 1 11 LEU CD2 C 1.336 4.984 -8.348 1.00 . A A . 11 LEU CD2 1 1
9 1658 1 1 11 LEU CG C 0.996 3.516 -8.064 1.00 . A A . 11 LEU CG 1 1
9 1659 1 1 11 LEU H H -0.142 1.386 -6.496 1.00 . A A . 11 LEU H 1 1
9 1660 1 1 11 LEU HA H 2.581 1.353 -7.359 1.00 . A A . 11 LEU HA 1 1
9 1661 1 1 11 LEU HB3 H 2.473 3.673 -6.519 1.00 . A A . 11 LEU HB3 1 1
9 1662 1 1 11 LEU HD11 H -0.878 3.742 -9.114 1.00 . A A . 11 LEU HD11 1 1
9 1663 1 1 11 LEU HD12 H -0.817 2.309 -8.101 1.00 . A A . 11 LEU HD12 1 1
9 1664 1 1 11 LEU HD13 H -1.017 3.906 -7.354 1.00 . A A . 11 LEU HD13 1 1
9 1665 1 1 11 LEU HD21 H 2.418 5.123 -8.354 1.00 . A A . 11 LEU HD21 1 1
9 1666 1 1 11 LEU HD22 H 0.947 5.273 -9.325 1.00 . A A . 11 LEU HD22 1 1
9 1667 1 1 11 LEU HD23 H 0.896 5.625 -7.584 1.00 . A A . 11 LEU HD23 1 1
9 1668 1 1 11 LEU HG H 1.470 2.907 -8.835 1.00 . A A . 11 LEU HG 1 1
9 1669 1 1 11 LEU N N 0.717 0.870 -6.559 1.00 . A A . 11 LEU N 1 1
9 1670 1 1 11 LEU O O 3.915 1.465 -5.170 1.00 . A A . 11 LEU O 1 1
9 1671 1 1 12 CYS C C 3.047 -0.078 -2.391 1.00 . A A . 12 CYS C 1 1
9 1672 1 1 12 CYS CA C 2.509 1.294 -2.777 1.00 . A A . 12 CYS CA 1 1
9 1673 1 1 12 CYS CB C 1.474 1.821 -1.791 1.00 . A A . 12 CYS CB 1 1
9 1674 1 1 12 CYS H H 0.960 1.051 -4.224 1.00 . A A . 12 CYS H 1 1
9 1675 1 1 12 CYS HA H 3.336 2.007 -2.761 1.00 . A A . 12 CYS HA 1 1
9 1676 1 1 12 CYS HB3 H 0.689 1.085 -1.619 1.00 . A A . 12 CYS HB3 1 1
9 1677 1 1 12 CYS N N 1.947 1.250 -4.117 1.00 . A A . 12 CYS N 1 1
9 1678 1 1 12 CYS O O 2.481 -0.761 -1.542 1.00 . A A . 12 CYS O 1 1
9 1679 1 1 12 CYS SG S 2.205 2.303 -0.214 1.00 . A A . 12 CYS SG 1 1
9 1680 1 1 13 TYR C C 4.605 -2.613 -1.902 1.00 . A A . 13 TYR C 1 1
9 1681 1 1 13 TYR CA C 4.818 -1.736 -3.131 1.00 . A A . 13 TYR CA 1 1
9 1682 1 1 13 TYR CB C 6.318 -1.475 -3.342 1.00 . A A . 13 TYR CB 1 1
9 1683 1 1 13 TYR CD1 C 7.590 -3.658 -3.113 1.00 . A A . 13 TYR CD1 1 1
9 1684 1 1 13 TYR CD2 C 7.393 -2.638 -5.315 1.00 . A A . 13 TYR CD2 1 1
9 1685 1 1 13 TYR CE1 C 8.388 -4.679 -3.658 1.00 . A A . 13 TYR CE1 1 1
9 1686 1 1 13 TYR CE2 C 8.199 -3.655 -5.857 1.00 . A A . 13 TYR CE2 1 1
9 1687 1 1 13 TYR CG C 7.096 -2.631 -3.940 1.00 . A A . 13 TYR CG 1 1
9 1688 1 1 13 TYR CZ C 8.696 -4.673 -5.029 1.00 . A A . 13 TYR CZ 1 1
9 1689 1 1 13 TYR H H 4.512 0.268 -3.672 1.00 . A A . 13 TYR H 1 1
9 1690 1 1 13 TYR HA H 4.420 -2.249 -4.008 1.00 . A A . 13 TYR HA 1 1
9 1691 1 1 13 TYR HB3 H 6.780 -1.193 -2.395 1.00 . A A . 13 TYR HB3 1 1
9 1692 1 1 13 TYR HD1 H 7.373 -3.658 -2.055 1.00 . A A . 13 TYR HD1 1 1
9 1693 1 1 13 TYR HD2 H 7.024 -1.851 -5.958 1.00 . A A . 13 TYR HD2 1 1
9 1694 1 1 13 TYR HE1 H 8.767 -5.458 -3.014 1.00 . A A . 13 TYR HE1 1 1
9 1695 1 1 13 TYR HE2 H 8.442 -3.648 -6.909 1.00 . A A . 13 TYR HE2 1 1
9 1696 1 1 13 TYR HH H 9.780 -6.289 -4.912 1.00 . A A . 13 TYR HH 1 1
9 1697 1 1 13 TYR N N 4.156 -0.437 -3.044 1.00 . A A . 13 TYR N 1 1
9 1698 1 1 13 TYR O O 4.290 -3.794 -2.005 1.00 . A A . 13 TYR O 1 1
9 1699 1 1 13 TYR OH O 9.493 -5.643 -5.560 1.00 . A A . 13 TYR OH 1 1
9 1700 1 1 14 CYS C C 3.366 -3.285 0.800 1.00 . A A . 14 CYS C 1 1
9 1701 1 1 14 CYS CA C 4.752 -2.681 0.551 1.00 . A A . 14 CYS CA 1 1
9 1702 1 1 14 CYS CB C 5.140 -1.723 1.674 1.00 . A A . 14 CYS CB 1 1
9 1703 1 1 14 CYS H H 5.026 -1.015 -0.819 1.00 . A A . 14 CYS H 1 1
9 1704 1 1 14 CYS HA H 5.472 -3.502 0.554 1.00 . A A . 14 CYS HA 1 1
9 1705 1 1 14 CYS HB3 H 4.551 -0.809 1.623 1.00 . A A . 14 CYS HB3 1 1
9 1706 1 1 14 CYS N N 4.838 -2.007 -0.741 1.00 . A A . 14 CYS N 1 1
9 1707 1 1 14 CYS O O 3.251 -4.473 1.080 1.00 . A A . 14 CYS O 1 1
9 1708 1 1 14 CYS SG S 4.928 -2.473 3.304 1.00 . A A . 14 CYS SG 1 1
9 1709 1 1 15 CYS C C 0.477 -3.734 1.855 1.00 . A A . 15 CYS C 1 1
9 1710 1 1 15 CYS CA C 0.918 -2.805 0.711 1.00 . A A . 15 CYS CA 1 1
9 1711 1 1 15 CYS CB C 0.548 -3.445 -0.628 1.00 . A A . 15 CYS CB 1 1
9 1712 1 1 15 CYS H H 2.558 -1.509 0.382 1.00 . A A . 15 CYS H 1 1
9 1713 1 1 15 CYS HA H 0.374 -1.865 0.806 1.00 . A A . 15 CYS HA 1 1
9 1714 1 1 15 CYS HB3 H 1.013 -4.428 -0.697 1.00 . A A . 15 CYS HB3 1 1
9 1715 1 1 15 CYS N N 2.334 -2.443 0.701 1.00 . A A . 15 CYS N 1 1
9 1716 1 1 15 CYS O O 0.481 -4.956 1.711 1.00 . A A . 15 CYS O 1 1
9 1717 1 1 15 CYS SG S -1.232 -3.654 -0.841 1.00 . A A . 15 CYS SG 1 1
9 1718 1 1 16 ASP C C -1.794 -4.765 3.473 1.00 . A A . 16 ASP C 1 1
9 1719 1 1 16 ASP CA C -0.616 -3.961 4.034 1.00 . A A . 16 ASP CA 1 1
9 1720 1 1 16 ASP CB C -1.089 -3.020 5.146 1.00 . A A . 16 ASP CB 1 1
9 1721 1 1 16 ASP CG C -2.094 -3.660 6.090 1.00 . A A . 16 ASP CG 1 1
9 1722 1 1 16 ASP H H -0.016 -2.162 3.066 1.00 . A A . 16 ASP H 1 1
9 1723 1 1 16 ASP HA H 0.105 -4.666 4.451 1.00 . A A . 16 ASP HA 1 1
9 1724 1 1 16 ASP HB3 H -1.607 -2.204 4.659 1.00 . A A . 16 ASP HB3 1 1
9 1725 1 1 16 ASP N N 0.021 -3.173 2.979 1.00 . A A . 16 ASP N 1 1
9 1726 1 1 16 ASP O O -2.636 -4.226 2.753 1.00 . A A . 16 ASP O 1 1
9 1727 1 1 16 ASP OD1 O -1.990 -4.887 6.289 1.00 . A A . 16 ASP OD1 1 1
9 1728 1 1 16 ASP OD2 O -2.976 -2.903 6.556 1.00 . A A . 16 ASP OD2 1 1
10 1729 1 1 1 VAL C C 5.255 2.552 4.974 1.00 . A A . 1 VAL C 1 1
10 1730 1 1 1 VAL CA C 6.032 3.291 6.066 1.00 . A A . 1 VAL CA 1 1
10 1731 1 1 1 VAL CB C 5.101 4.048 7.034 1.00 . A A . 1 VAL CB 1 1
10 1732 1 1 1 VAL CG1 C 5.899 4.631 8.206 1.00 . A A . 1 VAL CG1 1 1
10 1733 1 1 1 VAL CG2 C 4.317 5.168 6.337 1.00 . A A . 1 VAL CG2 1 1
10 1734 1 1 1 VAL H1 H 6.864 4.263 4.426 1.00 . A A . 1 VAL H1 1 1
10 1735 1 1 1 VAL HA H 6.607 2.555 6.629 1.00 . A A . 1 VAL HA 1 1
10 1736 1 1 1 VAL HB H 4.382 3.340 7.447 1.00 . A A . 1 VAL HB 1 1
10 1737 1 1 1 VAL HG11 H 6.615 5.373 7.850 1.00 . A A . 1 VAL HG11 1 1
10 1738 1 1 1 VAL HG12 H 5.219 5.107 8.914 1.00 . A A . 1 VAL HG12 1 1
10 1739 1 1 1 VAL HG13 H 6.437 3.834 8.721 1.00 . A A . 1 VAL HG13 1 1
10 1740 1 1 1 VAL HG21 H 3.725 4.764 5.516 1.00 . A A . 1 VAL HG21 1 1
10 1741 1 1 1 VAL HG22 H 3.641 5.637 7.052 1.00 . A A . 1 VAL HG22 1 1
10 1742 1 1 1 VAL HG23 H 4.996 5.926 5.947 1.00 . A A . 1 VAL HG23 1 1
10 1743 1 1 1 VAL N N 6.966 4.204 5.433 1.00 . A A . 1 VAL N 1 1
10 1744 1 1 1 VAL O O 5.349 2.907 3.798 1.00 . A A . 1 VAL O 1 1
10 1745 1 1 2 CYS C C 2.386 1.665 4.166 1.00 . A A . 2 CYS C 1 1
10 1746 1 1 2 CYS CA C 3.618 0.812 4.442 1.00 . A A . 2 CYS CA 1 1
10 1747 1 1 2 CYS CB C 3.174 -0.510 5.072 1.00 . A A . 2 CYS CB 1 1
10 1748 1 1 2 CYS H H 4.434 1.309 6.342 1.00 . A A . 2 CYS H 1 1
10 1749 1 1 2 CYS HA H 4.155 0.620 3.514 1.00 . A A . 2 CYS HA 1 1
10 1750 1 1 2 CYS HB3 H 2.262 -0.356 5.650 1.00 . A A . 2 CYS HB3 1 1
10 1751 1 1 2 CYS N N 4.501 1.520 5.359 1.00 . A A . 2 CYS N 1 1
10 1752 1 1 2 CYS O O 2.098 2.582 4.935 1.00 . A A . 2 CYS O 1 1
10 1753 1 1 2 CYS SG S 2.895 -1.865 3.924 1.00 . A A . 2 CYS SG 1 1
10 1754 1 1 3 CYS C C -0.651 0.882 3.811 1.00 . A A . 3 CYS C 1 1
10 1755 1 1 3 CYS CA C 0.248 1.852 3.059 1.00 . A A . 3 CYS CA 1 1
10 1756 1 1 3 CYS CB C -0.242 1.988 1.624 1.00 . A A . 3 CYS CB 1 1
10 1757 1 1 3 CYS H H 1.822 0.505 2.590 1.00 . A A . 3 CYS H 1 1
10 1758 1 1 3 CYS HA H 0.203 2.852 3.485 1.00 . A A . 3 CYS HA 1 1
10 1759 1 1 3 CYS HB3 H -1.305 2.189 1.696 1.00 . A A . 3 CYS HB3 1 1
10 1760 1 1 3 CYS N N 1.606 1.330 3.136 1.00 . A A . 3 CYS N 1 1
10 1761 1 1 3 CYS O O -0.475 -0.320 3.618 1.00 . A A . 3 CYS O 1 1
10 1762 1 1 3 CYS SG S 0.471 3.373 0.724 1.00 . A A . 3 CYS SG 1 1
10 1763 1 1 4 PRO C C -3.496 -0.130 4.368 1.00 . A A . 4 PRO C 1 1
10 1764 1 1 4 PRO CA C -2.531 0.522 5.358 1.00 . A A . 4 PRO CA 1 1
10 1765 1 1 4 PRO CB C -3.283 1.458 6.308 1.00 . A A . 4 PRO CB 1 1
10 1766 1 1 4 PRO CD C -1.884 2.774 4.880 1.00 . A A . 4 PRO CD 1 1
10 1767 1 1 4 PRO CG C -3.241 2.802 5.583 1.00 . A A . 4 PRO CG 1 1
10 1768 1 1 4 PRO HA H -2.006 -0.237 5.940 1.00 . A A . 4 PRO HA 1 1
10 1769 1 1 4 PRO HB3 H -2.733 1.537 7.247 1.00 . A A . 4 PRO HB3 1 1
10 1770 1 1 4 PRO HD3 H -1.120 3.197 5.533 1.00 . A A . 4 PRO HD3 1 1
10 1771 1 1 4 PRO HG3 H -3.338 3.648 6.267 1.00 . A A . 4 PRO HG3 1 1
10 1772 1 1 4 PRO N N -1.588 1.368 4.644 1.00 . A A . 4 PRO N 1 1
10 1773 1 1 4 PRO O O -3.660 0.363 3.253 1.00 . A A . 4 PRO O 1 1
10 1774 1 1 5 PHE C C -6.124 -0.983 3.331 1.00 . A A . 5 PHE C 1 1
10 1775 1 1 5 PHE CA C -5.112 -1.944 3.956 1.00 . A A . 5 PHE CA 1 1
10 1776 1 1 5 PHE CB C -5.798 -3.036 4.794 1.00 . A A . 5 PHE CB 1 1
10 1777 1 1 5 PHE CD1 C -7.543 -4.042 3.250 1.00 . A A . 5 PHE CD1 1 1
10 1778 1 1 5 PHE CD2 C -5.661 -5.417 3.957 1.00 . A A . 5 PHE CD2 1 1
10 1779 1 1 5 PHE CE1 C -8.041 -5.117 2.493 1.00 . A A . 5 PHE CE1 1 1
10 1780 1 1 5 PHE CE2 C -6.161 -6.492 3.202 1.00 . A A . 5 PHE CE2 1 1
10 1781 1 1 5 PHE CG C -6.351 -4.191 3.983 1.00 . A A . 5 PHE CG 1 1
10 1782 1 1 5 PHE CZ C -7.352 -6.343 2.470 1.00 . A A . 5 PHE CZ 1 1
10 1783 1 1 5 PHE H H -3.861 -1.647 5.662 1.00 . A A . 5 PHE H 1 1
10 1784 1 1 5 PHE HA H -4.555 -2.415 3.148 1.00 . A A . 5 PHE HA 1 1
10 1785 1 1 5 PHE HB3 H -6.598 -2.603 5.393 1.00 . A A . 5 PHE HB3 1 1
10 1786 1 1 5 PHE HD1 H -8.076 -3.103 3.251 1.00 . A A . 5 PHE HD1 1 1
10 1787 1 1 5 PHE HD2 H -4.743 -5.542 4.520 1.00 . A A . 5 PHE HD2 1 1
10 1788 1 1 5 PHE HE1 H -8.950 -4.998 1.920 1.00 . A A . 5 PHE HE1 1 1
10 1789 1 1 5 PHE HE2 H -5.625 -7.431 3.183 1.00 . A A . 5 PHE HE2 1 1
10 1790 1 1 5 PHE HZ H -7.731 -7.167 1.884 1.00 . A A . 5 PHE HZ 1 1
10 1791 1 1 5 PHE N N -4.159 -1.214 4.783 1.00 . A A . 5 PHE N 1 1
10 1792 1 1 5 PHE O O -6.301 -0.947 2.114 1.00 . A A . 5 PHE O 1 1
10 1793 1 1 6 GLY C C -6.777 2.106 3.220 1.00 . A A . 6 GLY C 1 1
10 1794 1 1 6 GLY CA C -7.615 0.926 3.712 1.00 . A A . 6 GLY CA 1 1
10 1795 1 1 6 GLY H H -6.514 -0.196 5.145 1.00 . A A . 6 GLY H 1 1
10 1796 1 1 6 GLY HA2 H -8.268 0.581 2.909 1.00 . A A . 6 GLY HA2 1 1
10 1797 1 1 6 GLY HA3 H -8.236 1.251 4.547 1.00 . A A . 6 GLY HA3 1 1
10 1798 1 1 6 GLY N N -6.751 -0.152 4.167 1.00 . A A . 6 GLY N 1 1
10 1799 1 1 6 GLY O O -6.849 3.194 3.788 1.00 . A A . 6 GLY O 1 1
10 1800 1 1 7 GLY C C -4.278 2.424 0.448 1.00 . A A . 7 GLY C 1 1
10 1801 1 1 7 GLY CA C -5.091 2.922 1.642 1.00 . A A . 7 GLY CA 1 1
10 1802 1 1 7 GLY H H -5.920 0.954 1.803 1.00 . A A . 7 GLY H 1 1
10 1803 1 1 7 GLY HA2 H -5.687 3.782 1.331 1.00 . A A . 7 GLY HA2 1 1
10 1804 1 1 7 GLY HA3 H -4.397 3.239 2.420 1.00 . A A . 7 GLY HA3 1 1
10 1805 1 1 7 GLY N N -5.974 1.895 2.175 1.00 . A A . 7 GLY N 1 1
10 1806 1 1 7 GLY O O -4.107 3.155 -0.524 1.00 . A A . 7 GLY O 1 1
10 1807 1 1 8 CYS C C -3.465 0.757 -1.896 1.00 . A A . 8 CYS C 1 1
10 1808 1 1 8 CYS CA C -2.886 0.618 -0.486 1.00 . A A . 8 CYS CA 1 1
10 1809 1 1 8 CYS CB C -2.594 -0.855 -0.175 1.00 . A A . 8 CYS CB 1 1
10 1810 1 1 8 CYS H H -3.912 0.663 1.378 1.00 . A A . 8 CYS H 1 1
10 1811 1 1 8 CYS HA H -1.939 1.156 -0.462 1.00 . A A . 8 CYS HA 1 1
10 1812 1 1 8 CYS HB3 H -3.521 -1.381 0.051 1.00 . A A . 8 CYS HB3 1 1
10 1813 1 1 8 CYS N N -3.753 1.197 0.533 1.00 . A A . 8 CYS N 1 1
10 1814 1 1 8 CYS O O -4.651 0.519 -2.121 1.00 . A A . 8 CYS O 1 1
10 1815 1 1 8 CYS SG S -1.825 -1.688 -1.586 1.00 . A A . 8 CYS SG 1 1
10 1816 1 1 9 HIS C C -1.566 0.196 -4.728 1.00 . A A . 9 HIS C 1 1
10 1817 1 1 9 HIS CA C -2.808 0.962 -4.274 1.00 . A A . 9 HIS CA 1 1
10 1818 1 1 9 HIS CB C -2.890 2.327 -4.964 1.00 . A A . 9 HIS CB 1 1
10 1819 1 1 9 HIS CD2 C -4.321 4.455 -4.992 1.00 . A A . 9 HIS CD2 1 1
10 1820 1 1 9 HIS CE1 C -5.884 3.905 -3.555 1.00 . A A . 9 HIS CE1 1 1
10 1821 1 1 9 HIS CG C -4.066 3.184 -4.553 1.00 . A A . 9 HIS CG 1 1
10 1822 1 1 9 HIS H H -1.633 1.260 -2.627 1.00 . A A . 9 HIS H 1 1
10 1823 1 1 9 HIS HA H -3.699 0.370 -4.491 1.00 . A A . 9 HIS HA 1 1
10 1824 1 1 9 HIS HB3 H -2.954 2.162 -6.037 1.00 . A A . 9 HIS HB3 1 1
10 1825 1 1 9 HIS HD1 H -5.137 1.981 -3.144 1.00 . A A . 9 HIS HD1 1 1
10 1826 1 1 9 HIS HD2 H -3.725 5.017 -5.697 1.00 . A A . 9 HIS HD2 1 1
10 1827 1 1 9 HIS HE1 H -6.752 3.944 -2.914 1.00 . A A . 9 HIS HE1 1 1
10 1828 1 1 9 HIS N N -2.612 1.140 -2.851 1.00 . A A . 9 HIS N 1 1
10 1829 1 1 9 HIS ND1 N -5.060 2.850 -3.659 1.00 . A A . 9 HIS ND1 1 1
10 1830 1 1 9 HIS NE2 N -5.479 4.908 -4.352 1.00 . A A . 9 HIS NE2 1 1
10 1831 1 1 9 HIS O O -0.592 0.123 -3.975 1.00 . A A . 9 HIS O 1 1
10 1832 1 1 10 GLU C C 0.867 -0.426 -6.466 1.00 . A A . 10 GLU C 1 1
10 1833 1 1 10 GLU CA C -0.477 -1.160 -6.461 1.00 . A A . 10 GLU CA 1 1
10 1834 1 1 10 GLU CB C -0.841 -1.708 -7.852 1.00 . A A . 10 GLU CB 1 1
10 1835 1 1 10 GLU CD C -2.768 -0.365 -8.864 1.00 . A A . 10 GLU CD 1 1
10 1836 1 1 10 GLU CG C -1.268 -0.641 -8.879 1.00 . A A . 10 GLU CG 1 1
10 1837 1 1 10 GLU H H -2.348 -0.141 -6.564 1.00 . A A . 10 GLU H 1 1
10 1838 1 1 10 GLU HA H -0.353 -2.001 -5.779 1.00 . A A . 10 GLU HA 1 1
10 1839 1 1 10 GLU HB3 H -1.647 -2.438 -7.758 1.00 . A A . 10 GLU HB3 1 1
10 1840 1 1 10 GLU HG3 H -1.025 -1.013 -9.875 1.00 . A A . 10 GLU HG3 1 1
10 1841 1 1 10 GLU N N -1.564 -0.341 -5.943 1.00 . A A . 10 GLU N 1 1
10 1842 1 1 10 GLU O O 1.922 -1.055 -6.420 1.00 . A A . 10 GLU O 1 1
10 1843 1 1 10 GLU OE1 O -3.199 0.346 -7.929 1.00 . A A . 10 GLU OE1 1 1
10 1844 1 1 10 GLU OE2 O -3.454 -0.887 -9.766 1.00 . A A . 10 GLU OE2 1 1
10 1845 1 1 11 LEU C C 2.745 1.559 -5.111 1.00 . A A . 11 LEU C 1 1
10 1846 1 1 11 LEU CA C 2.013 1.744 -6.444 1.00 . A A . 11 LEU CA 1 1
10 1847 1 1 11 LEU CB C 1.545 3.192 -6.603 1.00 . A A . 11 LEU CB 1 1
10 1848 1 1 11 LEU CD1 C 0.146 4.690 -8.054 1.00 . A A . 11 LEU CD1 1 1
10 1849 1 1 11 LEU CD2 C 2.316 3.811 -8.937 1.00 . A A . 11 LEU CD2 1 1
10 1850 1 1 11 LEU CG C 1.109 3.498 -8.044 1.00 . A A . 11 LEU CG 1 1
10 1851 1 1 11 LEU H H -0.055 1.378 -6.475 1.00 . A A . 11 LEU H 1 1
10 1852 1 1 11 LEU HA H 2.679 1.483 -7.265 1.00 . A A . 11 LEU HA 1 1
10 1853 1 1 11 LEU HB3 H 2.349 3.859 -6.318 1.00 . A A . 11 LEU HB3 1 1
10 1854 1 1 11 LEU HD11 H -0.744 4.453 -7.469 1.00 . A A . 11 LEU HD11 1 1
10 1855 1 1 11 LEU HD12 H 0.633 5.568 -7.628 1.00 . A A . 11 LEU HD12 1 1
10 1856 1 1 11 LEU HD13 H -0.159 4.910 -9.078 1.00 . A A . 11 LEU HD13 1 1
10 1857 1 1 11 LEU HD21 H 2.997 2.962 -8.970 1.00 . A A . 11 LEU HD21 1 1
10 1858 1 1 11 LEU HD22 H 1.975 4.020 -9.952 1.00 . A A . 11 LEU HD22 1 1
10 1859 1 1 11 LEU HD23 H 2.849 4.682 -8.557 1.00 . A A . 11 LEU HD23 1 1
10 1860 1 1 11 LEU HG H 0.593 2.629 -8.454 1.00 . A A . 11 LEU HG 1 1
10 1861 1 1 11 LEU N N 0.835 0.907 -6.496 1.00 . A A . 11 LEU N 1 1
10 1862 1 1 11 LEU O O 3.974 1.584 -5.047 1.00 . A A . 11 LEU O 1 1
10 1863 1 1 12 CYS C C 3.001 0.070 -2.264 1.00 . A A . 12 CYS C 1 1
10 1864 1 1 12 CYS CA C 2.519 1.455 -2.672 1.00 . A A . 12 CYS CA 1 1
10 1865 1 1 12 CYS CB C 1.467 2.017 -1.725 1.00 . A A . 12 CYS CB 1 1
10 1866 1 1 12 CYS H H 1.001 1.206 -4.147 1.00 . A A . 12 CYS H 1 1
10 1867 1 1 12 CYS HA H 3.366 2.144 -2.643 1.00 . A A . 12 CYS HA 1 1
10 1868 1 1 12 CYS HB3 H 0.666 1.295 -1.566 1.00 . A A . 12 CYS HB3 1 1
10 1869 1 1 12 CYS N N 1.986 1.410 -4.024 1.00 . A A . 12 CYS N 1 1
10 1870 1 1 12 CYS O O 2.432 -0.567 -1.381 1.00 . A A . 12 CYS O 1 1
10 1871 1 1 12 CYS SG S 2.148 2.515 -0.132 1.00 . A A . 12 CYS SG 1 1
10 1872 1 1 13 TYR C C 4.418 -2.563 -1.810 1.00 . A A . 13 TYR C 1 1
10 1873 1 1 13 TYR CA C 4.614 -1.711 -3.058 1.00 . A A . 13 TYR CA 1 1
10 1874 1 1 13 TYR CB C 6.112 -1.582 -3.368 1.00 . A A . 13 TYR CB 1 1
10 1875 1 1 13 TYR CD1 C 7.283 -3.828 -3.242 1.00 . A A . 13 TYR CD1 1 1
10 1876 1 1 13 TYR CD2 C 6.777 -2.888 -5.431 1.00 . A A . 13 TYR CD2 1 1
10 1877 1 1 13 TYR CE1 C 7.909 -4.926 -3.859 1.00 . A A . 13 TYR CE1 1 1
10 1878 1 1 13 TYR CE2 C 7.405 -3.985 -6.046 1.00 . A A . 13 TYR CE2 1 1
10 1879 1 1 13 TYR CG C 6.727 -2.801 -4.026 1.00 . A A . 13 TYR CG 1 1
10 1880 1 1 13 TYR CZ C 7.973 -5.001 -5.261 1.00 . A A . 13 TYR CZ 1 1
10 1881 1 1 13 TYR H H 4.446 0.312 -3.593 1.00 . A A . 13 TYR H 1 1
10 1882 1 1 13 TYR HA H 4.117 -2.196 -3.900 1.00 . A A . 13 TYR HA 1 1
10 1883 1 1 13 TYR HB3 H 6.662 -1.356 -2.454 1.00 . A A . 13 TYR HB3 1 1
10 1884 1 1 13 TYR HD1 H 7.241 -3.773 -2.164 1.00 . A A . 13 TYR HD1 1 1
10 1885 1 1 13 TYR HD2 H 6.345 -2.108 -6.040 1.00 . A A . 13 TYR HD2 1 1
10 1886 1 1 13 TYR HE1 H 8.338 -5.705 -3.247 1.00 . A A . 13 TYR HE1 1 1
10 1887 1 1 13 TYR HE2 H 7.455 -4.044 -7.123 1.00 . A A . 13 TYR HE2 1 1
10 1888 1 1 13 TYR HH H 8.949 -6.688 -5.242 1.00 . A A . 13 TYR HH 1 1
10 1889 1 1 13 TYR N N 4.067 -0.363 -2.945 1.00 . A A . 13 TYR N 1 1
10 1890 1 1 13 TYR O O 4.034 -3.727 -1.886 1.00 . A A . 13 TYR O 1 1
10 1891 1 1 13 TYR OH O 8.598 -6.051 -5.866 1.00 . A A . 13 TYR OH 1 1
10 1892 1 1 14 CYS C C 3.277 -3.196 0.904 1.00 . A A . 14 CYS C 1 1
10 1893 1 1 14 CYS CA C 4.666 -2.614 0.635 1.00 . A A . 14 CYS CA 1 1
10 1894 1 1 14 CYS CB C 5.068 -1.637 1.738 1.00 . A A . 14 CYS CB 1 1
10 1895 1 1 14 CYS H H 4.974 -0.982 -0.764 1.00 . A A . 14 CYS H 1 1
10 1896 1 1 14 CYS HA H 5.379 -3.441 0.646 1.00 . A A . 14 CYS HA 1 1
10 1897 1 1 14 CYS HB3 H 4.488 -0.718 1.669 1.00 . A A . 14 CYS HB3 1 1
10 1898 1 1 14 CYS N N 4.741 -1.962 -0.668 1.00 . A A . 14 CYS N 1 1
10 1899 1 1 14 CYS O O 3.151 -4.370 1.235 1.00 . A A . 14 CYS O 1 1
10 1900 1 1 14 CYS SG S 4.849 -2.349 3.384 1.00 . A A . 14 CYS SG 1 1
10 1901 1 1 15 CYS C C 0.362 -3.646 1.831 1.00 . A A . 15 CYS C 1 1
10 1902 1 1 15 CYS CA C 0.842 -2.708 0.712 1.00 . A A . 15 CYS CA 1 1
10 1903 1 1 15 CYS CB C 0.527 -3.337 -0.647 1.00 . A A . 15 CYS CB 1 1
10 1904 1 1 15 CYS H H 2.493 -1.426 0.411 1.00 . A A . 15 CYS H 1 1
10 1905 1 1 15 CYS HA H 0.293 -1.769 0.794 1.00 . A A . 15 CYS HA 1 1
10 1906 1 1 15 CYS HB3 H 1.008 -4.314 -0.708 1.00 . A A . 15 CYS HB3 1 1
10 1907 1 1 15 CYS N N 2.255 -2.349 0.754 1.00 . A A . 15 CYS N 1 1
10 1908 1 1 15 CYS O O 0.329 -4.865 1.658 1.00 . A A . 15 CYS O 1 1
10 1909 1 1 15 CYS SG S -1.239 -3.570 -0.933 1.00 . A A . 15 CYS SG 1 1
10 1910 1 1 16 ASP C C -2.098 -4.471 3.280 1.00 . A A . 16 ASP C 1 1
10 1911 1 1 16 ASP CA C -0.841 -3.888 3.936 1.00 . A A . 16 ASP CA 1 1
10 1912 1 1 16 ASP CB C -1.204 -3.004 5.135 1.00 . A A . 16 ASP CB 1 1
10 1913 1 1 16 ASP CG C -2.297 -3.583 6.020 1.00 . A A . 16 ASP CG 1 1
10 1914 1 1 16 ASP H H -0.101 -2.087 3.077 1.00 . A A . 16 ASP H 1 1
10 1915 1 1 16 ASP HA H -0.228 -4.719 4.287 1.00 . A A . 16 ASP HA 1 1
10 1916 1 1 16 ASP HB3 H -1.608 -2.084 4.737 1.00 . A A . 16 ASP HB3 1 1
10 1917 1 1 16 ASP N N -0.091 -3.096 2.963 1.00 . A A . 16 ASP N 1 1
10 1918 1 1 16 ASP O O -2.668 -3.870 2.368 1.00 . A A . 16 ASP O 1 1
10 1919 1 1 16 ASP OD1 O -2.476 -4.819 5.993 1.00 . A A . 16 ASP OD1 1 1
10 1920 1 1 16 ASP OD2 O -2.985 -2.752 6.657 1.00 . A A . 16 ASP OD2 1 1
11 1921 1 1 1 VAL C C 5.000 2.545 5.147 1.00 . A A . 1 VAL C 1 1
11 1922 1 1 1 VAL CA C 5.713 3.150 6.357 1.00 . A A . 1 VAL CA 1 1
11 1923 1 1 1 VAL CB C 4.722 3.717 7.393 1.00 . A A . 1 VAL CB 1 1
11 1924 1 1 1 VAL CG1 C 5.466 4.183 8.651 1.00 . A A . 1 VAL CG1 1 1
11 1925 1 1 1 VAL CG2 C 3.886 4.876 6.831 1.00 . A A . 1 VAL CG2 1 1
11 1926 1 1 1 VAL H1 H 6.524 4.396 4.902 1.00 . A A . 1 VAL H1 1 1
11 1927 1 1 1 VAL HA H 6.310 2.368 6.826 1.00 . A A . 1 VAL HA 1 1
11 1928 1 1 1 VAL HB H 4.040 2.920 7.690 1.00 . A A . 1 VAL HB 1 1
11 1929 1 1 1 VAL HG11 H 4.748 4.516 9.400 1.00 . A A . 1 VAL HG11 1 1
11 1930 1 1 1 VAL HG12 H 6.048 3.357 9.064 1.00 . A A . 1 VAL HG12 1 1
11 1931 1 1 1 VAL HG13 H 6.138 5.008 8.413 1.00 . A A . 1 VAL HG13 1 1
11 1932 1 1 1 VAL HG21 H 4.527 5.711 6.552 1.00 . A A . 1 VAL HG21 1 1
11 1933 1 1 1 VAL HG22 H 3.323 4.550 5.957 1.00 . A A . 1 VAL HG22 1 1
11 1934 1 1 1 VAL HG23 H 3.179 5.214 7.589 1.00 . A A . 1 VAL HG23 1 1
11 1935 1 1 1 VAL N N 6.615 4.186 5.890 1.00 . A A . 1 VAL N 1 1
11 1936 1 1 1 VAL O O 5.082 3.092 4.047 1.00 . A A . 1 VAL O 1 1
11 1937 1 1 2 CYS C C 2.188 1.549 4.150 1.00 . A A . 2 CYS C 1 1
11 1938 1 1 2 CYS CA C 3.513 0.799 4.292 1.00 . A A . 2 CYS CA 1 1
11 1939 1 1 2 CYS CB C 3.271 -0.675 4.618 1.00 . A A . 2 CYS CB 1 1
11 1940 1 1 2 CYS H H 4.251 1.038 6.274 1.00 . A A . 2 CYS H 1 1
11 1941 1 1 2 CYS HA H 4.054 0.874 3.346 1.00 . A A . 2 CYS HA 1 1
11 1942 1 1 2 CYS HB3 H 2.476 -0.752 5.357 1.00 . A A . 2 CYS HB3 1 1
11 1943 1 1 2 CYS N N 4.319 1.412 5.341 1.00 . A A . 2 CYS N 1 1
11 1944 1 1 2 CYS O O 1.840 2.342 5.024 1.00 . A A . 2 CYS O 1 1
11 1945 1 1 2 CYS SG S 2.762 -1.615 3.176 1.00 . A A . 2 CYS SG 1 1
11 1946 1 1 3 CYS C C -0.918 1.107 3.389 1.00 . A A . 3 CYS C 1 1
11 1947 1 1 3 CYS CA C 0.183 2.006 2.833 1.00 . A A . 3 CYS CA 1 1
11 1948 1 1 3 CYS CB C -0.033 2.310 1.343 1.00 . A A . 3 CYS CB 1 1
11 1949 1 1 3 CYS H H 1.643 0.542 2.449 1.00 . A A . 3 CYS H 1 1
11 1950 1 1 3 CYS HA H 0.223 2.968 3.344 1.00 . A A . 3 CYS HA 1 1
11 1951 1 1 3 CYS HB3 H -0.481 3.296 1.285 1.00 . A A . 3 CYS HB3 1 1
11 1952 1 1 3 CYS N N 1.436 1.312 3.070 1.00 . A A . 3 CYS N 1 1
11 1953 1 1 3 CYS O O -0.896 -0.087 3.081 1.00 . A A . 3 CYS O 1 1
11 1954 1 1 3 CYS SG S 1.415 2.319 0.256 1.00 . A A . 3 CYS SG 1 1
11 1955 1 1 4 PRO C C -3.796 0.190 3.980 1.00 . A A . 4 PRO C 1 1
11 1956 1 1 4 PRO CA C -2.811 0.842 4.946 1.00 . A A . 4 PRO CA 1 1
11 1957 1 1 4 PRO CB C -3.532 1.825 5.875 1.00 . A A . 4 PRO CB 1 1
11 1958 1 1 4 PRO CD C -1.992 3.049 4.526 1.00 . A A . 4 PRO CD 1 1
11 1959 1 1 4 PRO CG C -3.372 3.169 5.169 1.00 . A A . 4 PRO CG 1 1
11 1960 1 1 4 PRO HA H -2.304 0.100 5.551 1.00 . A A . 4 PRO HA 1 1
11 1961 1 1 4 PRO HB3 H -3.013 1.857 6.835 1.00 . A A . 4 PRO HB3 1 1
11 1962 1 1 4 PRO HD3 H -1.224 3.358 5.239 1.00 . A A . 4 PRO HD3 1 1
11 1963 1 1 4 PRO HG3 H -3.440 4.014 5.857 1.00 . A A . 4 PRO HG3 1 1
11 1964 1 1 4 PRO N N -1.828 1.636 4.224 1.00 . A A . 4 PRO N 1 1
11 1965 1 1 4 PRO O O -4.011 0.724 2.895 1.00 . A A . 4 PRO O 1 1
11 1966 1 1 5 PHE C C -6.513 -0.436 3.100 1.00 . A A . 5 PHE C 1 1
11 1967 1 1 5 PHE CA C -5.548 -1.506 3.617 1.00 . A A . 5 PHE CA 1 1
11 1968 1 1 5 PHE CB C -6.309 -2.550 4.451 1.00 . A A . 5 PHE CB 1 1
11 1969 1 1 5 PHE CD1 C -5.475 -4.766 3.555 1.00 . A A . 5 PHE CD1 1 1
11 1970 1 1 5 PHE CD2 C -4.971 -4.182 5.862 1.00 . A A . 5 PHE CD2 1 1
11 1971 1 1 5 PHE CE1 C -4.716 -5.942 3.687 1.00 . A A . 5 PHE CE1 1 1
11 1972 1 1 5 PHE CE2 C -4.184 -5.340 5.983 1.00 . A A . 5 PHE CE2 1 1
11 1973 1 1 5 PHE CG C -5.582 -3.868 4.634 1.00 . A A . 5 PHE CG 1 1
11 1974 1 1 5 PHE CZ C -4.057 -6.223 4.897 1.00 . A A . 5 PHE CZ 1 1
11 1975 1 1 5 PHE H H -4.104 -1.378 5.227 1.00 . A A . 5 PHE H 1 1
11 1976 1 1 5 PHE HA H -5.136 -1.996 2.736 1.00 . A A . 5 PHE HA 1 1
11 1977 1 1 5 PHE HB3 H -7.247 -2.773 3.941 1.00 . A A . 5 PHE HB3 1 1
11 1978 1 1 5 PHE HD1 H -5.919 -4.524 2.600 1.00 . A A . 5 PHE HD1 1 1
11 1979 1 1 5 PHE HD2 H -4.993 -3.479 6.684 1.00 . A A . 5 PHE HD2 1 1
11 1980 1 1 5 PHE HE1 H -4.597 -6.606 2.842 1.00 . A A . 5 PHE HE1 1 1
11 1981 1 1 5 PHE HE2 H -3.614 -5.502 6.889 1.00 . A A . 5 PHE HE2 1 1
11 1982 1 1 5 PHE HZ H -3.429 -7.097 4.984 1.00 . A A . 5 PHE HZ 1 1
11 1983 1 1 5 PHE N N -4.452 -0.906 4.385 1.00 . A A . 5 PHE N 1 1
11 1984 1 1 5 PHE O O -6.853 -0.416 1.918 1.00 . A A . 5 PHE O 1 1
11 1985 1 1 6 GLY C C -6.834 2.695 2.907 1.00 . A A . 6 GLY C 1 1
11 1986 1 1 6 GLY CA C -7.714 1.643 3.585 1.00 . A A . 6 GLY CA 1 1
11 1987 1 1 6 GLY H H -6.573 0.436 4.918 1.00 . A A . 6 GLY H 1 1
11 1988 1 1 6 GLY HA2 H -8.517 1.348 2.908 1.00 . A A . 6 GLY HA2 1 1
11 1989 1 1 6 GLY HA3 H -8.162 2.075 4.480 1.00 . A A . 6 GLY HA3 1 1
11 1990 1 1 6 GLY N N -6.927 0.483 3.975 1.00 . A A . 6 GLY N 1 1
11 1991 1 1 6 GLY O O -6.683 3.797 3.429 1.00 . A A . 6 GLY O 1 1
11 1992 1 1 7 GLY C C -4.647 2.573 -0.125 1.00 . A A . 7 GLY C 1 1
11 1993 1 1 7 GLY CA C -5.368 3.268 1.028 1.00 . A A . 7 GLY CA 1 1
11 1994 1 1 7 GLY H H -6.374 1.417 1.412 1.00 . A A . 7 GLY H 1 1
11 1995 1 1 7 GLY HA2 H -5.954 4.100 0.636 1.00 . A A . 7 GLY HA2 1 1
11 1996 1 1 7 GLY HA3 H -4.614 3.661 1.711 1.00 . A A . 7 GLY HA3 1 1
11 1997 1 1 7 GLY N N -6.250 2.364 1.752 1.00 . A A . 7 GLY N 1 1
11 1998 1 1 7 GLY O O -4.564 3.121 -1.222 1.00 . A A . 7 GLY O 1 1
11 1999 1 1 8 CYS C C -3.985 0.516 -2.187 1.00 . A A . 8 CYS C 1 1
11 2000 1 1 8 CYS CA C -3.301 0.621 -0.821 1.00 . A A . 8 CYS CA 1 1
11 2001 1 1 8 CYS CB C -2.995 -0.778 -0.273 1.00 . A A . 8 CYS CB 1 1
11 2002 1 1 8 CYS H H -4.228 0.988 1.050 1.00 . A A . 8 CYS H 1 1
11 2003 1 1 8 CYS HA H -2.351 1.141 -0.947 1.00 . A A . 8 CYS HA 1 1
11 2004 1 1 8 CYS HB3 H -3.901 -1.219 0.145 1.00 . A A . 8 CYS HB3 1 1
11 2005 1 1 8 CYS N N -4.104 1.379 0.128 1.00 . A A . 8 CYS N 1 1
11 2006 1 1 8 CYS O O -5.158 0.156 -2.279 1.00 . A A . 8 CYS O 1 1
11 2007 1 1 8 CYS SG S -2.409 -1.892 -1.570 1.00 . A A . 8 CYS SG 1 1
11 2008 1 1 9 HIS C C -2.329 -0.076 -5.237 1.00 . A A . 9 HIS C 1 1
11 2009 1 1 9 HIS CA C -3.572 0.596 -4.640 1.00 . A A . 9 HIS CA 1 1
11 2010 1 1 9 HIS CB C -3.884 1.926 -5.345 1.00 . A A . 9 HIS CB 1 1
11 2011 1 1 9 HIS CD2 C -5.839 3.540 -5.721 1.00 . A A . 9 HIS CD2 1 1
11 2012 1 1 9 HIS CE1 C -7.137 3.004 -4.038 1.00 . A A . 9 HIS CE1 1 1
11 2013 1 1 9 HIS CG C -5.220 2.548 -5.009 1.00 . A A . 9 HIS CG 1 1
11 2014 1 1 9 HIS H H -2.269 1.066 -3.102 1.00 . A A . 9 HIS H 1 1
11 2015 1 1 9 HIS HA H -4.416 -0.089 -4.736 1.00 . A A . 9 HIS HA 1 1
11 2016 1 1 9 HIS HB3 H -3.879 1.763 -6.421 1.00 . A A . 9 HIS HB3 1 1
11 2017 1 1 9 HIS HD1 H -5.879 1.515 -3.253 1.00 . A A . 9 HIS HD1 1 1
11 2018 1 1 9 HIS HD2 H -5.458 4.015 -6.613 1.00 . A A . 9 HIS HD2 1 1
11 2019 1 1 9 HIS HE1 H -7.965 2.974 -3.345 1.00 . A A . 9 HIS HE1 1 1
11 2020 1 1 9 HIS N N -3.243 0.846 -3.247 1.00 . A A . 9 HIS N 1 1
11 2021 1 1 9 HIS ND1 N -6.051 2.219 -3.960 1.00 . A A . 9 HIS ND1 1 1
11 2022 1 1 9 HIS NE2 N -7.057 3.825 -5.098 1.00 . A A . 9 HIS NE2 1 1
11 2023 1 1 9 HIS O O -1.362 -0.310 -4.513 1.00 . A A . 9 HIS O 1 1
11 2024 1 1 10 GLU C C 0.143 -0.386 -6.969 1.00 . A A . 10 GLU C 1 1
11 2025 1 1 10 GLU CA C -1.233 -0.996 -7.258 1.00 . A A . 10 GLU CA 1 1
11 2026 1 1 10 GLU CB C -1.547 -0.980 -8.760 1.00 . A A . 10 GLU CB 1 1
11 2027 1 1 10 GLU CD C -2.229 0.354 -10.778 1.00 . A A . 10 GLU CD 1 1
11 2028 1 1 10 GLU CG C -1.809 0.429 -9.318 1.00 . A A . 10 GLU CG 1 1
11 2029 1 1 10 GLU H H -3.152 -0.127 -7.086 1.00 . A A . 10 GLU H 1 1
11 2030 1 1 10 GLU HA H -1.187 -2.030 -6.918 1.00 . A A . 10 GLU HA 1 1
11 2031 1 1 10 GLU HB3 H -2.431 -1.592 -8.949 1.00 . A A . 10 GLU HB3 1 1
11 2032 1 1 10 GLU HG3 H -0.905 1.033 -9.259 1.00 . A A . 10 GLU HG3 1 1
11 2033 1 1 10 GLU N N -2.330 -0.348 -6.543 1.00 . A A . 10 GLU N 1 1
11 2034 1 1 10 GLU O O 1.139 -1.102 -6.895 1.00 . A A . 10 GLU O 1 1
11 2035 1 1 10 GLU OE1 O -3.414 0.027 -11.000 1.00 . A A . 10 GLU OE1 1 1
11 2036 1 1 10 GLU OE2 O -1.356 0.608 -11.634 1.00 . A A . 10 GLU OE2 1 1
11 2037 1 1 11 LEU C C 2.119 1.200 -5.270 1.00 . A A . 11 LEU C 1 1
11 2038 1 1 11 LEU CA C 1.444 1.663 -6.570 1.00 . A A . 11 LEU CA 1 1
11 2039 1 1 11 LEU CB C 1.142 3.174 -6.542 1.00 . A A . 11 LEU CB 1 1
11 2040 1 1 11 LEU CD1 C 1.738 5.502 -7.235 1.00 . A A . 11 LEU CD1 1 1
11 2041 1 1 11 LEU CD2 C 3.590 3.924 -6.680 1.00 . A A . 11 LEU CD2 1 1
11 2042 1 1 11 LEU CG C 2.183 4.035 -7.278 1.00 . A A . 11 LEU CG 1 1
11 2043 1 1 11 LEU H H -0.665 1.448 -6.880 1.00 . A A . 11 LEU H 1 1
11 2044 1 1 11 LEU HA H 2.109 1.447 -7.407 1.00 . A A . 11 LEU HA 1 1
11 2045 1 1 11 LEU HB3 H 1.046 3.511 -5.508 1.00 . A A . 11 LEU HB3 1 1
11 2046 1 1 11 LEU HD11 H 1.697 5.850 -6.203 1.00 . A A . 11 LEU HD11 1 1
11 2047 1 1 11 LEU HD12 H 2.441 6.120 -7.793 1.00 . A A . 11 LEU HD12 1 1
11 2048 1 1 11 LEU HD13 H 0.750 5.603 -7.686 1.00 . A A . 11 LEU HD13 1 1
11 2049 1 1 11 LEU HD21 H 4.245 4.667 -7.136 1.00 . A A . 11 LEU HD21 1 1
11 2050 1 1 11 LEU HD22 H 3.557 4.093 -5.603 1.00 . A A . 11 LEU HD22 1 1
11 2051 1 1 11 LEU HD23 H 4.008 2.939 -6.884 1.00 . A A . 11 LEU HD23 1 1
11 2052 1 1 11 LEU HG H 2.222 3.720 -8.322 1.00 . A A . 11 LEU HG 1 1
11 2053 1 1 11 LEU N N 0.201 0.936 -6.804 1.00 . A A . 11 LEU N 1 1
11 2054 1 1 11 LEU O O 3.335 1.297 -5.116 1.00 . A A . 11 LEU O 1 1
11 2055 1 1 12 CYS C C 2.583 -0.927 -2.991 1.00 . A A . 12 CYS C 1 1
11 2056 1 1 12 CYS CA C 1.843 0.409 -2.981 1.00 . A A . 12 CYS CA 1 1
11 2057 1 1 12 CYS CB C 0.728 0.375 -1.944 1.00 . A A . 12 CYS CB 1 1
11 2058 1 1 12 CYS H H 0.362 0.525 -4.508 1.00 . A A . 12 CYS H 1 1
11 2059 1 1 12 CYS HA H 2.531 1.201 -2.677 1.00 . A A . 12 CYS HA 1 1
11 2060 1 1 12 CYS HB3 H 0.114 -0.512 -2.089 1.00 . A A . 12 CYS HB3 1 1
11 2061 1 1 12 CYS N N 1.331 0.729 -4.300 1.00 . A A . 12 CYS N 1 1
11 2062 1 1 12 CYS O O 1.965 -1.982 -2.899 1.00 . A A . 12 CYS O 1 1
11 2063 1 1 12 CYS SG S 1.472 0.326 -0.306 1.00 . A A . 12 CYS SG 1 1
11 2064 1 1 13 TYR C C 4.445 -3.135 -2.174 1.00 . A A . 13 TYR C 1 1
11 2065 1 1 13 TYR CA C 4.769 -2.053 -3.209 1.00 . A A . 13 TYR CA 1 1
11 2066 1 1 13 TYR CB C 6.230 -1.614 -3.063 1.00 . A A . 13 TYR CB 1 1
11 2067 1 1 13 TYR CD1 C 7.704 -3.676 -2.971 1.00 . A A . 13 TYR CD1 1 1
11 2068 1 1 13 TYR CD2 C 7.612 -2.389 -5.037 1.00 . A A . 13 TYR CD2 1 1
11 2069 1 1 13 TYR CE1 C 8.585 -4.586 -3.580 1.00 . A A . 13 TYR CE1 1 1
11 2070 1 1 13 TYR CE2 C 8.497 -3.297 -5.642 1.00 . A A . 13 TYR CE2 1 1
11 2071 1 1 13 TYR CG C 7.220 -2.571 -3.697 1.00 . A A . 13 TYR CG 1 1
11 2072 1 1 13 TYR CZ C 8.981 -4.397 -4.915 1.00 . A A . 13 TYR CZ 1 1
11 2073 1 1 13 TYR H H 4.325 0.029 -3.246 1.00 . A A . 13 TYR H 1 1
11 2074 1 1 13 TYR HA H 4.618 -2.465 -4.208 1.00 . A A . 13 TYR HA 1 1
11 2075 1 1 13 TYR HB3 H 6.481 -1.488 -2.009 1.00 . A A . 13 TYR HB3 1 1
11 2076 1 1 13 TYR HD1 H 7.389 -3.837 -1.951 1.00 . A A . 13 TYR HD1 1 1
11 2077 1 1 13 TYR HD2 H 7.226 -1.557 -5.608 1.00 . A A . 13 TYR HD2 1 1
11 2078 1 1 13 TYR HE1 H 8.944 -5.435 -3.017 1.00 . A A . 13 TYR HE1 1 1
11 2079 1 1 13 TYR HE2 H 8.796 -3.157 -6.670 1.00 . A A . 13 TYR HE2 1 1
11 2080 1 1 13 TYR HH H 10.089 -6.000 -4.937 1.00 . A A . 13 TYR HH 1 1
11 2081 1 1 13 TYR N N 3.912 -0.879 -3.086 1.00 . A A . 13 TYR N 1 1
11 2082 1 1 13 TYR O O 4.322 -4.311 -2.503 1.00 . A A . 13 TYR O 1 1
11 2083 1 1 13 TYR OH O 9.834 -5.277 -5.512 1.00 . A A . 13 TYR OH 1 1
11 2084 1 1 14 CYS C C 2.781 -3.974 0.509 1.00 . A A . 14 CYS C 1 1
11 2085 1 1 14 CYS CA C 4.245 -3.633 0.235 1.00 . A A . 14 CYS CA 1 1
11 2086 1 1 14 CYS CB C 4.915 -3.012 1.462 1.00 . A A . 14 CYS CB 1 1
11 2087 1 1 14 CYS H H 4.476 -1.729 -0.740 1.00 . A A . 14 CYS H 1 1
11 2088 1 1 14 CYS HA H 4.768 -4.566 0.017 1.00 . A A . 14 CYS HA 1 1
11 2089 1 1 14 CYS HB3 H 5.981 -2.953 1.255 1.00 . A A . 14 CYS HB3 1 1
11 2090 1 1 14 CYS N N 4.381 -2.725 -0.906 1.00 . A A . 14 CYS N 1 1
11 2091 1 1 14 CYS O O 2.437 -5.136 0.697 1.00 . A A . 14 CYS O 1 1
11 2092 1 1 14 CYS SG S 4.373 -1.348 1.891 1.00 . A A . 14 CYS SG 1 1
11 2093 1 1 15 CYS C C -0.013 -3.674 1.933 1.00 . A A . 15 CYS C 1 1
11 2094 1 1 15 CYS CA C 0.491 -2.960 0.671 1.00 . A A . 15 CYS CA 1 1
11 2095 1 1 15 CYS CB C -0.111 -3.618 -0.573 1.00 . A A . 15 CYS CB 1 1
11 2096 1 1 15 CYS H H 2.395 -2.055 0.368 1.00 . A A . 15 CYS H 1 1
11 2097 1 1 15 CYS HA H 0.164 -1.918 0.739 1.00 . A A . 15 CYS HA 1 1
11 2098 1 1 15 CYS HB3 H 0.236 -4.648 -0.614 1.00 . A A . 15 CYS HB3 1 1
11 2099 1 1 15 CYS N N 1.946 -2.937 0.534 1.00 . A A . 15 CYS N 1 1
11 2100 1 1 15 CYS O O -0.251 -4.880 1.919 1.00 . A A . 15 CYS O 1 1
11 2101 1 1 15 CYS SG S -1.914 -3.673 -0.622 1.00 . A A . 15 CYS SG 1 1
11 2102 1 1 16 ASP C C -2.531 -3.413 3.691 1.00 . A A . 16 ASP C 1 1
11 2103 1 1 16 ASP CA C -1.060 -3.414 4.116 1.00 . A A . 16 ASP CA 1 1
11 2104 1 1 16 ASP CB C -0.831 -2.523 5.336 1.00 . A A . 16 ASP CB 1 1
11 2105 1 1 16 ASP CG C -1.893 -2.766 6.398 1.00 . A A . 16 ASP CG 1 1
11 2106 1 1 16 ASP H H -0.109 -1.922 3.005 1.00 . A A . 16 ASP H 1 1
11 2107 1 1 16 ASP HA H -0.785 -4.435 4.381 1.00 . A A . 16 ASP HA 1 1
11 2108 1 1 16 ASP HB3 H -0.879 -1.478 5.053 1.00 . A A . 16 ASP HB3 1 1
11 2109 1 1 16 ASP N N -0.239 -2.926 3.020 1.00 . A A . 16 ASP N 1 1
11 2110 1 1 16 ASP O O -2.868 -2.980 2.588 1.00 . A A . 16 ASP O 1 1
11 2111 1 1 16 ASP OD1 O -1.667 -3.654 7.244 1.00 . A A . 16 ASP OD1 1 1
11 2112 1 1 16 ASP OD2 O -2.937 -2.080 6.308 1.00 . A A . 16 ASP OD2 1 1
12 2113 1 1 1 VAL C C 5.308 2.541 5.288 1.00 . A A . 1 VAL C 1 1
12 2114 1 1 1 VAL CA C 5.946 3.191 6.518 1.00 . A A . 1 VAL CA 1 1
12 2115 1 1 1 VAL CB C 4.907 3.924 7.387 1.00 . A A . 1 VAL CB 1 1
12 2116 1 1 1 VAL CG1 C 5.556 4.458 8.671 1.00 . A A . 1 VAL CG1 1 1
12 2117 1 1 1 VAL CG2 C 4.224 5.077 6.639 1.00 . A A . 1 VAL CG2 1 1
12 2118 1 1 1 VAL H1 H 6.993 4.253 5.066 1.00 . A A . 1 VAL H1 1 1
12 2119 1 1 1 VAL HA H 6.422 2.409 7.112 1.00 . A A . 1 VAL HA 1 1
12 2120 1 1 1 VAL HB H 4.137 3.209 7.680 1.00 . A A . 1 VAL HB 1 1
12 2121 1 1 1 VAL HG11 H 6.029 3.640 9.215 1.00 . A A . 1 VAL HG11 1 1
12 2122 1 1 1 VAL HG12 H 6.310 5.210 8.432 1.00 . A A . 1 VAL HG12 1 1
12 2123 1 1 1 VAL HG13 H 4.795 4.910 9.307 1.00 . A A . 1 VAL HG13 1 1
12 2124 1 1 1 VAL HG21 H 3.715 4.706 5.749 1.00 . A A . 1 VAL HG21 1 1
12 2125 1 1 1 VAL HG22 H 3.484 5.545 7.287 1.00 . A A . 1 VAL HG22 1 1
12 2126 1 1 1 VAL HG23 H 4.956 5.830 6.343 1.00 . A A . 1 VAL HG23 1 1
12 2127 1 1 1 VAL N N 6.978 4.108 6.070 1.00 . A A . 1 VAL N 1 1
12 2128 1 1 1 VAL O O 5.507 3.017 4.170 1.00 . A A . 1 VAL O 1 1
12 2129 1 1 2 CYS C C 2.441 1.583 4.284 1.00 . A A . 2 CYS C 1 1
12 2130 1 1 2 CYS CA C 3.770 0.843 4.426 1.00 . A A . 2 CYS CA 1 1
12 2131 1 1 2 CYS CB C 3.539 -0.637 4.732 1.00 . A A . 2 CYS CB 1 1
12 2132 1 1 2 CYS H H 4.390 1.150 6.437 1.00 . A A . 2 CYS H 1 1
12 2133 1 1 2 CYS HA H 4.315 0.934 3.484 1.00 . A A . 2 CYS HA 1 1
12 2134 1 1 2 CYS HB3 H 2.745 -0.731 5.470 1.00 . A A . 2 CYS HB3 1 1
12 2135 1 1 2 CYS N N 4.555 1.457 5.490 1.00 . A A . 2 CYS N 1 1
12 2136 1 1 2 CYS O O 2.083 2.367 5.163 1.00 . A A . 2 CYS O 1 1
12 2137 1 1 2 CYS SG S 3.043 -1.564 3.276 1.00 . A A . 2 CYS SG 1 1
12 2138 1 1 3 CYS C C -0.646 1.139 3.608 1.00 . A A . 3 CYS C 1 1
12 2139 1 1 3 CYS CA C 0.427 2.027 2.984 1.00 . A A . 3 CYS CA 1 1
12 2140 1 1 3 CYS CB C 0.151 2.282 1.495 1.00 . A A . 3 CYS CB 1 1
12 2141 1 1 3 CYS H H 1.918 0.588 2.572 1.00 . A A . 3 CYS H 1 1
12 2142 1 1 3 CYS HA H 0.481 3.005 3.462 1.00 . A A . 3 CYS HA 1 1
12 2143 1 1 3 CYS HB3 H -0.386 3.221 1.437 1.00 . A A . 3 CYS HB3 1 1
12 2144 1 1 3 CYS N N 1.696 1.351 3.199 1.00 . A A . 3 CYS N 1 1
12 2145 1 1 3 CYS O O -0.627 -0.061 3.325 1.00 . A A . 3 CYS O 1 1
12 2146 1 1 3 CYS SG S 1.576 2.415 0.389 1.00 . A A . 3 CYS SG 1 1
12 2147 1 1 4 PRO C C -3.499 0.233 4.279 1.00 . A A . 4 PRO C 1 1
12 2148 1 1 4 PRO CA C -2.504 0.911 5.216 1.00 . A A . 4 PRO CA 1 1
12 2149 1 1 4 PRO CB C -3.219 1.915 6.126 1.00 . A A . 4 PRO CB 1 1
12 2150 1 1 4 PRO CD C -1.694 3.107 4.725 1.00 . A A . 4 PRO CD 1 1
12 2151 1 1 4 PRO CG C -3.065 3.243 5.387 1.00 . A A . 4 PRO CG 1 1
12 2152 1 1 4 PRO HA H -1.996 0.169 5.831 1.00 . A A . 4 PRO HA 1 1
12 2153 1 1 4 PRO HB3 H -2.699 1.970 7.083 1.00 . A A . 4 PRO HB3 1 1
12 2154 1 1 4 PRO HD3 H -0.915 3.435 5.416 1.00 . A A . 4 PRO HD3 1 1
12 2155 1 1 4 PRO HG3 H -3.120 4.102 6.057 1.00 . A A . 4 PRO HG3 1 1
12 2156 1 1 4 PRO N N -1.531 1.686 4.459 1.00 . A A . 4 PRO N 1 1
12 2157 1 1 4 PRO O O -3.721 0.717 3.173 1.00 . A A . 4 PRO O 1 1
12 2158 1 1 5 PHE C C -6.101 -0.748 3.288 1.00 . A A . 5 PHE C 1 1
12 2159 1 1 5 PHE CA C -5.053 -1.652 3.935 1.00 . A A . 5 PHE CA 1 1
12 2160 1 1 5 PHE CB C -5.688 -2.729 4.829 1.00 . A A . 5 PHE CB 1 1
12 2161 1 1 5 PHE CD1 C -7.621 -3.700 3.496 1.00 . A A . 5 PHE CD1 1 1
12 2162 1 1 5 PHE CD2 C -5.690 -5.105 3.966 1.00 . A A . 5 PHE CD2 1 1
12 2163 1 1 5 PHE CE1 C -8.224 -4.765 2.803 1.00 . A A . 5 PHE CE1 1 1
12 2164 1 1 5 PHE CE2 C -6.296 -6.171 3.283 1.00 . A A . 5 PHE CE2 1 1
12 2165 1 1 5 PHE CG C -6.349 -3.866 4.075 1.00 . A A . 5 PHE CG 1 1
12 2166 1 1 5 PHE CZ C -7.563 -6.002 2.700 1.00 . A A . 5 PHE CZ 1 1
12 2167 1 1 5 PHE H H -3.794 -1.264 5.612 1.00 . A A . 5 PHE H 1 1
12 2168 1 1 5 PHE HA H -4.487 -2.137 3.139 1.00 . A A . 5 PHE HA 1 1
12 2169 1 1 5 PHE HB3 H -6.415 -2.274 5.501 1.00 . A A . 5 PHE HB3 1 1
12 2170 1 1 5 PHE HD1 H -8.136 -2.754 3.566 1.00 . A A . 5 PHE HD1 1 1
12 2171 1 1 5 PHE HD2 H -4.707 -5.235 4.399 1.00 . A A . 5 PHE HD2 1 1
12 2172 1 1 5 PHE HE1 H -9.193 -4.631 2.344 1.00 . A A . 5 PHE HE1 1 1
12 2173 1 1 5 PHE HE2 H -5.779 -7.117 3.196 1.00 . A A . 5 PHE HE2 1 1
12 2174 1 1 5 PHE HZ H -8.024 -6.820 2.164 1.00 . A A . 5 PHE HZ 1 1
12 2175 1 1 5 PHE N N -4.118 -0.863 4.727 1.00 . A A . 5 PHE N 1 1
12 2176 1 1 5 PHE O O -6.295 -0.767 2.073 1.00 . A A . 5 PHE O 1 1
12 2177 1 1 6 GLY C C -6.825 2.320 3.053 1.00 . A A . 6 GLY C 1 1
12 2178 1 1 6 GLY CA C -7.631 1.146 3.612 1.00 . A A . 6 GLY CA 1 1
12 2179 1 1 6 GLY H H -6.486 0.105 5.073 1.00 . A A . 6 GLY H 1 1
12 2180 1 1 6 GLY HA2 H -8.292 0.754 2.838 1.00 . A A . 6 GLY HA2 1 1
12 2181 1 1 6 GLY HA3 H -8.243 1.496 4.445 1.00 . A A . 6 GLY HA3 1 1
12 2182 1 1 6 GLY N N -6.739 0.102 4.097 1.00 . A A . 6 GLY N 1 1
12 2183 1 1 6 GLY O O -6.895 3.426 3.582 1.00 . A A . 6 GLY O 1 1
12 2184 1 1 7 GLY C C -4.338 2.500 0.262 1.00 . A A . 7 GLY C 1 1
12 2185 1 1 7 GLY CA C -5.182 3.082 1.395 1.00 . A A . 7 GLY CA 1 1
12 2186 1 1 7 GLY H H -5.998 1.122 1.663 1.00 . A A . 7 GLY H 1 1
12 2187 1 1 7 GLY HA2 H -5.790 3.900 1.007 1.00 . A A . 7 GLY HA2 1 1
12 2188 1 1 7 GLY HA3 H -4.508 3.475 2.157 1.00 . A A . 7 GLY HA3 1 1
12 2189 1 1 7 GLY N N -6.052 2.079 1.994 1.00 . A A . 7 GLY N 1 1
12 2190 1 1 7 GLY O O -4.119 3.162 -0.752 1.00 . A A . 7 GLY O 1 1
12 2191 1 1 8 CYS C C -3.698 0.546 -1.923 1.00 . A A . 8 CYS C 1 1
12 2192 1 1 8 CYS CA C -3.035 0.566 -0.542 1.00 . A A . 8 CYS CA 1 1
12 2193 1 1 8 CYS CB C -2.738 -0.854 -0.050 1.00 . A A . 8 CYS CB 1 1
12 2194 1 1 8 CYS H H -4.050 0.795 1.304 1.00 . A A . 8 CYS H 1 1
12 2195 1 1 8 CYS HA H -2.086 1.095 -0.628 1.00 . A A . 8 CYS HA 1 1
12 2196 1 1 8 CYS HB3 H -3.648 -1.308 0.344 1.00 . A A . 8 CYS HB3 1 1
12 2197 1 1 8 CYS N N -3.852 1.269 0.435 1.00 . A A . 8 CYS N 1 1
12 2198 1 1 8 CYS O O -4.909 0.380 -2.041 1.00 . A A . 8 CYS O 1 1
12 2199 1 1 8 CYS SG S -2.139 -1.936 -1.366 1.00 . A A . 8 CYS SG 1 1
12 2200 1 1 9 HIS C C -2.044 -0.132 -5.001 1.00 . A A . 9 HIS C 1 1
12 2201 1 1 9 HIS CA C -3.212 0.627 -4.368 1.00 . A A . 9 HIS CA 1 1
12 2202 1 1 9 HIS CB C -3.365 2.033 -4.965 1.00 . A A . 9 HIS CB 1 1
12 2203 1 1 9 HIS CD2 C -5.715 2.911 -5.498 1.00 . A A . 9 HIS CD2 1 1
12 2204 1 1 9 HIS CE1 C -6.325 3.614 -3.512 1.00 . A A . 9 HIS CE1 1 1
12 2205 1 1 9 HIS CG C -4.681 2.688 -4.628 1.00 . A A . 9 HIS CG 1 1
12 2206 1 1 9 HIS H H -1.884 0.774 -2.793 1.00 . A A . 9 HIS H 1 1
12 2207 1 1 9 HIS HA H -4.127 0.050 -4.517 1.00 . A A . 9 HIS HA 1 1
12 2208 1 1 9 HIS HB3 H -3.296 1.976 -6.049 1.00 . A A . 9 HIS HB3 1 1
12 2209 1 1 9 HIS HD1 H -4.552 3.077 -2.524 1.00 . A A . 9 HIS HD1 1 1
12 2210 1 1 9 HIS HD2 H -5.729 2.661 -6.549 1.00 . A A . 9 HIS HD2 1 1
12 2211 1 1 9 HIS HE1 H -6.907 4.025 -2.699 1.00 . A A . 9 HIS HE1 1 1
12 2212 1 1 9 HIS N N -2.880 0.743 -2.960 1.00 . A A . 9 HIS N 1 1
12 2213 1 1 9 HIS ND1 N -5.077 3.134 -3.389 1.00 . A A . 9 HIS ND1 1 1
12 2214 1 1 9 HIS NE2 N -6.757 3.508 -4.779 1.00 . A A . 9 HIS NE2 1 1
12 2215 1 1 9 HIS O O -1.079 -0.444 -4.302 1.00 . A A . 9 HIS O 1 1
12 2216 1 1 10 GLU C C 0.333 -0.458 -6.865 1.00 . A A . 10 GLU C 1 1
12 2217 1 1 10 GLU CA C -1.048 -1.103 -7.036 1.00 . A A . 10 GLU CA 1 1
12 2218 1 1 10 GLU CB C -1.436 -1.240 -8.518 1.00 . A A . 10 GLU CB 1 1
12 2219 1 1 10 GLU CD C -3.359 0.312 -9.174 1.00 . A A . 10 GLU CD 1 1
12 2220 1 1 10 GLU CG C -1.853 0.072 -9.210 1.00 . A A . 10 GLU CG 1 1
12 2221 1 1 10 GLU H H -2.888 -0.051 -6.845 1.00 . A A . 10 GLU H 1 1
12 2222 1 1 10 GLU HA H -0.978 -2.108 -6.617 1.00 . A A . 10 GLU HA 1 1
12 2223 1 1 10 GLU HB3 H -2.257 -1.955 -8.613 1.00 . A A . 10 GLU HB3 1 1
12 2224 1 1 10 GLU HG3 H -1.567 0.005 -10.261 1.00 . A A . 10 GLU HG3 1 1
12 2225 1 1 10 GLU N N -2.090 -0.391 -6.307 1.00 . A A . 10 GLU N 1 1
12 2226 1 1 10 GLU O O 1.352 -1.143 -6.904 1.00 . A A . 10 GLU O 1 1
12 2227 1 1 10 GLU OE1 O -3.858 0.586 -8.060 1.00 . A A . 10 GLU OE1 1 1
12 2228 1 1 10 GLU OE2 O -3.980 0.204 -10.250 1.00 . A A . 10 GLU OE2 1 1
12 2229 1 1 11 LEU C C 2.307 1.208 -5.166 1.00 . A A . 11 LEU C 1 1
12 2230 1 1 11 LEU CA C 1.592 1.617 -6.458 1.00 . A A . 11 LEU CA 1 1
12 2231 1 1 11 LEU CB C 1.211 3.098 -6.414 1.00 . A A . 11 LEU CB 1 1
12 2232 1 1 11 LEU CD1 C 0.037 4.919 -7.682 1.00 . A A . 11 LEU CD1 1 1
12 2233 1 1 11 LEU CD2 C 2.175 3.990 -8.585 1.00 . A A . 11 LEU CD2 1 1
12 2234 1 1 11 LEU CG C 0.893 3.654 -7.811 1.00 . A A . 11 LEU CG 1 1
12 2235 1 1 11 LEU H H -0.489 1.380 -6.627 1.00 . A A . 11 LEU H 1 1
12 2236 1 1 11 LEU HA H 2.264 1.439 -7.298 1.00 . A A . 11 LEU HA 1 1
12 2237 1 1 11 LEU HB3 H 2.028 3.662 -5.982 1.00 . A A . 11 LEU HB3 1 1
12 2238 1 1 11 LEU HD11 H -0.903 4.681 -7.182 1.00 . A A . 11 LEU HD11 1 1
12 2239 1 1 11 LEU HD12 H 0.571 5.674 -7.103 1.00 . A A . 11 LEU HD12 1 1
12 2240 1 1 11 LEU HD13 H -0.186 5.317 -8.672 1.00 . A A . 11 LEU HD13 1 1
12 2241 1 1 11 LEU HD21 H 2.785 3.100 -8.726 1.00 . A A . 11 LEU HD21 1 1
12 2242 1 1 11 LEU HD22 H 1.915 4.390 -9.565 1.00 . A A . 11 LEU HD22 1 1
12 2243 1 1 11 LEU HD23 H 2.756 4.737 -8.042 1.00 . A A . 11 LEU HD23 1 1
12 2244 1 1 11 LEU HG H 0.333 2.908 -8.374 1.00 . A A . 11 LEU HG 1 1
12 2245 1 1 11 LEU N N 0.373 0.861 -6.663 1.00 . A A . 11 LEU N 1 1
12 2246 1 1 11 LEU O O 3.521 1.369 -5.048 1.00 . A A . 11 LEU O 1 1
12 2247 1 1 12 CYS C C 2.905 -0.851 -2.858 1.00 . A A . 12 CYS C 1 1
12 2248 1 1 12 CYS CA C 2.116 0.457 -2.854 1.00 . A A . 12 CYS CA 1 1
12 2249 1 1 12 CYS CB C 1.030 0.402 -1.787 1.00 . A A . 12 CYS CB 1 1
12 2250 1 1 12 CYS H H 0.589 0.510 -4.334 1.00 . A A . 12 CYS H 1 1
12 2251 1 1 12 CYS HA H 2.781 1.280 -2.583 1.00 . A A . 12 CYS HA 1 1
12 2252 1 1 12 CYS HB3 H 0.446 -0.511 -1.890 1.00 . A A . 12 CYS HB3 1 1
12 2253 1 1 12 CYS N N 1.561 0.732 -4.166 1.00 . A A . 12 CYS N 1 1
12 2254 1 1 12 CYS O O 2.325 -1.925 -2.740 1.00 . A A . 12 CYS O 1 1
12 2255 1 1 12 CYS SG S 1.815 0.431 -0.167 1.00 . A A . 12 CYS SG 1 1
12 2256 1 1 13 TYR C C 4.846 -2.995 -2.085 1.00 . A A . 13 TYR C 1 1
12 2257 1 1 13 TYR CA C 5.128 -1.895 -3.112 1.00 . A A . 13 TYR CA 1 1
12 2258 1 1 13 TYR CB C 6.575 -1.409 -2.967 1.00 . A A . 13 TYR CB 1 1
12 2259 1 1 13 TYR CD1 C 8.097 -3.438 -2.934 1.00 . A A . 13 TYR CD1 1 1
12 2260 1 1 13 TYR CD2 C 7.970 -2.098 -4.963 1.00 . A A . 13 TYR CD2 1 1
12 2261 1 1 13 TYR CE1 C 8.987 -4.319 -3.572 1.00 . A A . 13 TYR CE1 1 1
12 2262 1 1 13 TYR CE2 C 8.865 -2.977 -5.598 1.00 . A A . 13 TYR CE2 1 1
12 2263 1 1 13 TYR CG C 7.589 -2.323 -3.626 1.00 . A A . 13 TYR CG 1 1
12 2264 1 1 13 TYR CZ C 9.368 -4.089 -4.905 1.00 . A A . 13 TYR CZ 1 1
12 2265 1 1 13 TYR H H 4.607 0.167 -3.145 1.00 . A A . 13 TYR H 1 1
12 2266 1 1 13 TYR HA H 4.988 -2.305 -4.114 1.00 . A A . 13 TYR HA 1 1
12 2267 1 1 13 TYR HB3 H 6.829 -1.298 -1.913 1.00 . A A . 13 TYR HB3 1 1
12 2268 1 1 13 TYR HD1 H 7.790 -3.633 -1.917 1.00 . A A . 13 TYR HD1 1 1
12 2269 1 1 13 TYR HD2 H 7.566 -1.259 -5.511 1.00 . A A . 13 TYR HD2 1 1
12 2270 1 1 13 TYR HE1 H 9.359 -5.178 -3.035 1.00 . A A . 13 TYR HE1 1 1
12 2271 1 1 13 TYR HE2 H 9.152 -2.807 -6.625 1.00 . A A . 13 TYR HE2 1 1
12 2272 1 1 13 TYR HH H 10.490 -5.682 -4.981 1.00 . A A . 13 TYR HH 1 1
12 2273 1 1 13 TYR N N 4.229 -0.754 -2.979 1.00 . A A . 13 TYR N 1 1
12 2274 1 1 13 TYR O O 4.773 -4.173 -2.422 1.00 . A A . 13 TYR O 1 1
12 2275 1 1 13 TYR OH O 10.225 -4.943 -5.533 1.00 . A A . 13 TYR OH 1 1
12 2276 1 1 14 CYS C C 3.159 -3.903 0.539 1.00 . A A . 14 CYS C 1 1
12 2277 1 1 14 CYS CA C 4.620 -3.516 0.310 1.00 . A A . 14 CYS CA 1 1
12 2278 1 1 14 CYS CB C 5.245 -2.897 1.563 1.00 . A A . 14 CYS CB 1 1
12 2279 1 1 14 CYS H H 4.805 -1.594 -0.641 1.00 . A A . 14 CYS H 1 1
12 2280 1 1 14 CYS HA H 5.174 -4.431 0.094 1.00 . A A . 14 CYS HA 1 1
12 2281 1 1 14 CYS HB3 H 6.313 -2.811 1.383 1.00 . A A . 14 CYS HB3 1 1
12 2282 1 1 14 CYS N N 4.755 -2.593 -0.815 1.00 . A A . 14 CYS N 1 1
12 2283 1 1 14 CYS O O 2.848 -5.082 0.652 1.00 . A A . 14 CYS O 1 1
12 2284 1 1 14 CYS SG S 4.654 -1.251 2.000 1.00 . A A . 14 CYS SG 1 1
12 2285 1 1 15 CYS C C 0.402 -3.670 2.055 1.00 . A A . 15 CYS C 1 1
12 2286 1 1 15 CYS CA C 0.846 -2.938 0.781 1.00 . A A . 15 CYS CA 1 1
12 2287 1 1 15 CYS CB C 0.219 -3.609 -0.441 1.00 . A A . 15 CYS CB 1 1
12 2288 1 1 15 CYS H H 2.717 -1.989 0.462 1.00 . A A . 15 CYS H 1 1
12 2289 1 1 15 CYS HA H 0.505 -1.900 0.857 1.00 . A A . 15 CYS HA 1 1
12 2290 1 1 15 CYS HB3 H 0.590 -4.631 -0.490 1.00 . A A . 15 CYS HB3 1 1
12 2291 1 1 15 CYS N N 2.296 -2.888 0.604 1.00 . A A . 15 CYS N 1 1
12 2292 1 1 15 CYS O O 0.438 -4.897 2.118 1.00 . A A . 15 CYS O 1 1
12 2293 1 1 15 CYS SG S -1.581 -3.702 -0.422 1.00 . A A . 15 CYS SG 1 1
12 2294 1 1 16 ASP C C -1.818 -4.473 3.851 1.00 . A A . 16 ASP C 1 1
12 2295 1 1 16 ASP CA C -0.650 -3.569 4.256 1.00 . A A . 16 ASP CA 1 1
12 2296 1 1 16 ASP CB C -1.119 -2.484 5.229 1.00 . A A . 16 ASP CB 1 1
12 2297 1 1 16 ASP CG C -2.058 -3.009 6.305 1.00 . A A . 16 ASP CG 1 1
12 2298 1 1 16 ASP H H -0.141 -1.927 2.998 1.00 . A A . 16 ASP H 1 1
12 2299 1 1 16 ASP HA H 0.097 -4.188 4.753 1.00 . A A . 16 ASP HA 1 1
12 2300 1 1 16 ASP HB3 H -1.690 -1.773 4.645 1.00 . A A . 16 ASP HB3 1 1
12 2301 1 1 16 ASP N N -0.059 -2.937 3.077 1.00 . A A . 16 ASP N 1 1
12 2302 1 1 16 ASP O O -2.664 -4.078 3.048 1.00 . A A . 16 ASP O 1 1
12 2303 1 1 16 ASP OD1 O -1.943 -4.207 6.633 1.00 . A A . 16 ASP OD1 1 1
12 2304 1 1 16 ASP OD2 O -2.910 -2.200 6.738 1.00 . A A . 16 ASP OD2 1 1
13 2305 1 1 1 VAL C C 5.374 2.615 5.166 1.00 . A A . 1 VAL C 1 1
13 2306 1 1 1 VAL CA C 6.063 3.277 6.361 1.00 . A A . 1 VAL CA 1 1
13 2307 1 1 1 VAL CB C 5.051 3.932 7.319 1.00 . A A . 1 VAL CB 1 1
13 2308 1 1 1 VAL CG1 C 5.758 4.465 8.571 1.00 . A A . 1 VAL CG1 1 1
13 2309 1 1 1 VAL CG2 C 4.260 5.069 6.654 1.00 . A A . 1 VAL CG2 1 1
13 2310 1 1 1 VAL H1 H 6.938 4.426 4.864 1.00 . A A . 1 VAL H1 1 1
13 2311 1 1 1 VAL HA H 6.623 2.512 6.900 1.00 . A A . 1 VAL HA 1 1
13 2312 1 1 1 VAL HB H 4.338 3.170 7.642 1.00 . A A . 1 VAL HB 1 1
13 2313 1 1 1 VAL HG11 H 6.305 3.657 9.059 1.00 . A A . 1 VAL HG11 1 1
13 2314 1 1 1 VAL HG12 H 6.456 5.259 8.305 1.00 . A A . 1 VAL HG12 1 1
13 2315 1 1 1 VAL HG13 H 5.021 4.861 9.270 1.00 . A A . 1 VAL HG13 1 1
13 2316 1 1 1 VAL HG21 H 3.538 5.473 7.363 1.00 . A A . 1 VAL HG21 1 1
13 2317 1 1 1 VAL HG22 H 4.931 5.868 6.340 1.00 . A A . 1 VAL HG22 1 1
13 2318 1 1 1 VAL HG23 H 3.717 4.696 5.784 1.00 . A A . 1 VAL HG23 1 1
13 2319 1 1 1 VAL N N 7.006 4.260 5.862 1.00 . A A . 1 VAL N 1 1
13 2320 1 1 1 VAL O O 5.466 3.121 4.046 1.00 . A A . 1 VAL O 1 1
13 2321 1 1 2 CYS C C 2.529 1.587 4.286 1.00 . A A . 2 CYS C 1 1
13 2322 1 1 2 CYS CA C 3.868 0.857 4.376 1.00 . A A . 2 CYS CA 1 1
13 2323 1 1 2 CYS CB C 3.660 -0.620 4.709 1.00 . A A . 2 CYS CB 1 1
13 2324 1 1 2 CYS H H 4.620 1.152 6.343 1.00 . A A . 2 CYS H 1 1
13 2325 1 1 2 CYS HA H 4.372 0.942 3.409 1.00 . A A . 2 CYS HA 1 1
13 2326 1 1 2 CYS HB3 H 2.898 -0.709 5.480 1.00 . A A . 2 CYS HB3 1 1
13 2327 1 1 2 CYS N N 4.696 1.488 5.396 1.00 . A A . 2 CYS N 1 1
13 2328 1 1 2 CYS O O 2.206 2.376 5.173 1.00 . A A . 2 CYS O 1 1
13 2329 1 1 2 CYS SG S 3.102 -1.562 3.287 1.00 . A A . 2 CYS SG 1 1
13 2330 1 1 3 CYS C C -0.588 1.121 3.716 1.00 . A A . 3 CYS C 1 1
13 2331 1 1 3 CYS CA C 0.464 2.017 3.065 1.00 . A A . 3 CYS CA 1 1
13 2332 1 1 3 CYS CB C 0.151 2.287 1.586 1.00 . A A . 3 CYS CB 1 1
13 2333 1 1 3 CYS H H 1.922 0.569 2.608 1.00 . A A . 3 CYS H 1 1
13 2334 1 1 3 CYS HA H 0.526 2.989 3.552 1.00 . A A . 3 CYS HA 1 1
13 2335 1 1 3 CYS HB3 H -0.261 3.288 1.522 1.00 . A A . 3 CYS HB3 1 1
13 2336 1 1 3 CYS N N 1.737 1.339 3.238 1.00 . A A . 3 CYS N 1 1
13 2337 1 1 3 CYS O O -0.558 -0.084 3.454 1.00 . A A . 3 CYS O 1 1
13 2338 1 1 3 CYS SG S 1.507 2.187 0.391 1.00 . A A . 3 CYS SG 1 1
13 2339 1 1 4 PRO C C -3.427 0.209 4.411 1.00 . A A . 4 PRO C 1 1
13 2340 1 1 4 PRO CA C -2.432 0.898 5.342 1.00 . A A . 4 PRO CA 1 1
13 2341 1 1 4 PRO CB C -3.149 1.907 6.244 1.00 . A A . 4 PRO CB 1 1
13 2342 1 1 4 PRO CD C -1.646 3.093 4.816 1.00 . A A . 4 PRO CD 1 1
13 2343 1 1 4 PRO CG C -3.013 3.225 5.485 1.00 . A A . 4 PRO CG 1 1
13 2344 1 1 4 PRO HA H -1.917 0.164 5.960 1.00 . A A . 4 PRO HA 1 1
13 2345 1 1 4 PRO HB3 H -2.620 1.979 7.196 1.00 . A A . 4 PRO HB3 1 1
13 2346 1 1 4 PRO HD3 H -0.867 3.441 5.496 1.00 . A A . 4 PRO HD3 1 1
13 2347 1 1 4 PRO HG3 H -3.073 4.093 6.142 1.00 . A A . 4 PRO HG3 1 1
13 2348 1 1 4 PRO N N -1.469 1.670 4.571 1.00 . A A . 4 PRO N 1 1
13 2349 1 1 4 PRO O O -3.654 0.688 3.305 1.00 . A A . 4 PRO O 1 1
13 2350 1 1 5 PHE C C -6.021 -0.778 3.417 1.00 . A A . 5 PHE C 1 1
13 2351 1 1 5 PHE CA C -4.984 -1.679 4.088 1.00 . A A . 5 PHE CA 1 1
13 2352 1 1 5 PHE CB C -5.628 -2.721 5.013 1.00 . A A . 5 PHE CB 1 1
13 2353 1 1 5 PHE CD1 C -7.751 -3.590 3.926 1.00 . A A . 5 PHE CD1 1 1
13 2354 1 1 5 PHE CD2 C -5.787 -5.026 4.002 1.00 . A A . 5 PHE CD2 1 1
13 2355 1 1 5 PHE CE1 C -8.469 -4.608 3.275 1.00 . A A . 5 PHE CE1 1 1
13 2356 1 1 5 PHE CE2 C -6.506 -6.047 3.357 1.00 . A A . 5 PHE CE2 1 1
13 2357 1 1 5 PHE CG C -6.409 -3.799 4.294 1.00 . A A . 5 PHE CG 1 1
13 2358 1 1 5 PHE CZ C -7.848 -5.839 2.995 1.00 . A A . 5 PHE CZ 1 1
13 2359 1 1 5 PHE H H -3.715 -1.288 5.749 1.00 . A A . 5 PHE H 1 1
13 2360 1 1 5 PHE HA H -4.425 -2.191 3.304 1.00 . A A . 5 PHE HA 1 1
13 2361 1 1 5 PHE HB3 H -6.278 -2.224 5.733 1.00 . A A . 5 PHE HB3 1 1
13 2362 1 1 5 PHE HD1 H -8.232 -2.645 4.137 1.00 . A A . 5 PHE HD1 1 1
13 2363 1 1 5 PHE HD2 H -4.751 -5.180 4.270 1.00 . A A . 5 PHE HD2 1 1
13 2364 1 1 5 PHE HE1 H -9.496 -4.443 2.984 1.00 . A A . 5 PHE HE1 1 1
13 2365 1 1 5 PHE HE2 H -6.022 -6.987 3.135 1.00 . A A . 5 PHE HE2 1 1
13 2366 1 1 5 PHE HZ H -8.399 -6.622 2.493 1.00 . A A . 5 PHE HZ 1 1
13 2367 1 1 5 PHE N N -4.039 -0.888 4.865 1.00 . A A . 5 PHE N 1 1
13 2368 1 1 5 PHE O O -6.195 -0.810 2.200 1.00 . A A . 5 PHE O 1 1
13 2369 1 1 6 GLY C C -6.753 2.290 3.130 1.00 . A A . 6 GLY C 1 1
13 2370 1 1 6 GLY CA C -7.558 1.116 3.694 1.00 . A A . 6 GLY CA 1 1
13 2371 1 1 6 GLY H H -6.430 0.100 5.185 1.00 . A A . 6 GLY H 1 1
13 2372 1 1 6 GLY HA2 H -8.205 0.710 2.916 1.00 . A A . 6 GLY HA2 1 1
13 2373 1 1 6 GLY HA3 H -8.184 1.471 4.511 1.00 . A A . 6 GLY HA3 1 1
13 2374 1 1 6 GLY N N -6.669 0.084 4.206 1.00 . A A . 6 GLY N 1 1
13 2375 1 1 6 GLY O O -6.850 3.405 3.637 1.00 . A A . 6 GLY O 1 1
13 2376 1 1 7 GLY C C -4.231 2.467 0.366 1.00 . A A . 7 GLY C 1 1
13 2377 1 1 7 GLY CA C -5.100 3.051 1.480 1.00 . A A . 7 GLY CA 1 1
13 2378 1 1 7 GLY H H -5.881 1.078 1.780 1.00 . A A . 7 GLY H 1 1
13 2379 1 1 7 GLY HA2 H -5.720 3.848 1.070 1.00 . A A . 7 GLY HA2 1 1
13 2380 1 1 7 GLY HA3 H -4.443 3.472 2.242 1.00 . A A . 7 GLY HA3 1 1
13 2381 1 1 7 GLY N N -5.956 2.041 2.089 1.00 . A A . 7 GLY N 1 1
13 2382 1 1 7 GLY O O -3.998 3.118 -0.651 1.00 . A A . 7 GLY O 1 1
13 2383 1 1 8 CYS C C -3.680 0.419 -1.756 1.00 . A A . 8 CYS C 1 1
13 2384 1 1 8 CYS CA C -2.952 0.504 -0.411 1.00 . A A . 8 CYS CA 1 1
13 2385 1 1 8 CYS CB C -2.648 -0.894 0.139 1.00 . A A . 8 CYS CB 1 1
13 2386 1 1 8 CYS H H -3.946 0.783 1.437 1.00 . A A . 8 CYS H 1 1
13 2387 1 1 8 CYS HA H -2.009 1.027 -0.563 1.00 . A A . 8 CYS HA 1 1
13 2388 1 1 8 CYS HB3 H -3.530 -1.291 0.645 1.00 . A A . 8 CYS HB3 1 1
13 2389 1 1 8 CYS N N -3.738 1.244 0.563 1.00 . A A . 8 CYS N 1 1
13 2390 1 1 8 CYS O O -4.888 0.192 -1.803 1.00 . A A . 8 CYS O 1 1
13 2391 1 1 8 CYS SG S -2.212 -2.094 -1.137 1.00 . A A . 8 CYS SG 1 1
13 2392 1 1 9 HIS C C -2.185 -0.096 -5.013 1.00 . A A . 9 HIS C 1 1
13 2393 1 1 9 HIS CA C -3.398 0.358 -4.205 1.00 . A A . 9 HIS CA 1 1
13 2394 1 1 9 HIS CB C -4.064 1.623 -4.776 1.00 . A A . 9 HIS CB 1 1
13 2395 1 1 9 HIS CD2 C -6.467 0.843 -5.175 1.00 . A A . 9 HIS CD2 1 1
13 2396 1 1 9 HIS CE1 C -6.636 1.133 -7.342 1.00 . A A . 9 HIS CE1 1 1
13 2397 1 1 9 HIS CG C -5.270 1.325 -5.634 1.00 . A A . 9 HIS CG 1 1
13 2398 1 1 9 HIS H H -1.932 0.701 -2.759 1.00 . A A . 9 HIS H 1 1
13 2399 1 1 9 HIS HA H -4.115 -0.465 -4.188 1.00 . A A . 9 HIS HA 1 1
13 2400 1 1 9 HIS HB3 H -3.344 2.229 -5.329 1.00 . A A . 9 HIS HB3 1 1
13 2401 1 1 9 HIS HD1 H -4.704 1.860 -7.661 1.00 . A A . 9 HIS HD1 1 1
13 2402 1 1 9 HIS HD2 H -6.705 0.604 -4.149 1.00 . A A . 9 HIS HD2 1 1
13 2403 1 1 9 HIS HE1 H -7.025 1.164 -8.350 1.00 . A A . 9 HIS HE1 1 1
13 2404 1 1 9 HIS N N -2.932 0.591 -2.849 1.00 . A A . 9 HIS N 1 1
13 2405 1 1 9 HIS ND1 N -5.394 1.507 -6.996 1.00 . A A . 9 HIS ND1 1 1
13 2406 1 1 9 HIS NE2 N -7.330 0.719 -6.269 1.00 . A A . 9 HIS NE2 1 1
13 2407 1 1 9 HIS O O -1.182 -0.510 -4.434 1.00 . A A . 9 HIS O 1 1
13 2408 1 1 10 GLU C C 0.173 -0.043 -6.958 1.00 . A A . 10 GLU C 1 1
13 2409 1 1 10 GLU CA C -1.260 -0.490 -7.272 1.00 . A A . 10 GLU CA 1 1
13 2410 1 1 10 GLU CB C -1.690 -0.095 -8.690 1.00 . A A . 10 GLU CB 1 1
13 2411 1 1 10 GLU CD C -2.930 1.820 -9.769 1.00 . A A . 10 GLU CD 1 1
13 2412 1 1 10 GLU CG C -1.760 1.429 -8.886 1.00 . A A . 10 GLU CG 1 1
13 2413 1 1 10 GLU H H -3.094 0.430 -6.726 1.00 . A A . 10 GLU H 1 1
13 2414 1 1 10 GLU HA H -1.264 -1.576 -7.187 1.00 . A A . 10 GLU HA 1 1
13 2415 1 1 10 GLU HB3 H -2.678 -0.524 -8.877 1.00 . A A . 10 GLU HB3 1 1
13 2416 1 1 10 GLU HG3 H -0.836 1.778 -9.349 1.00 . A A . 10 GLU HG3 1 1
13 2417 1 1 10 GLU N N -2.259 0.015 -6.337 1.00 . A A . 10 GLU N 1 1
13 2418 1 1 10 GLU O O 1.111 -0.826 -7.077 1.00 . A A . 10 GLU O 1 1
13 2419 1 1 10 GLU OE1 O -2.753 1.806 -11.003 1.00 . A A . 10 GLU OE1 1 1
13 2420 1 1 10 GLU OE2 O -3.989 2.104 -9.168 1.00 . A A . 10 GLU OE2 1 1
13 2421 1 1 11 LEU C C 2.268 1.250 -5.001 1.00 . A A . 11 LEU C 1 1
13 2422 1 1 11 LEU CA C 1.649 1.800 -6.289 1.00 . A A . 11 LEU CA 1 1
13 2423 1 1 11 LEU CB C 1.457 3.317 -6.185 1.00 . A A . 11 LEU CB 1 1
13 2424 1 1 11 LEU CD1 C 0.569 5.328 -7.397 1.00 . A A . 11 LEU CD1 1 1
13 2425 1 1 11 LEU CD2 C 2.597 4.168 -8.287 1.00 . A A . 11 LEU CD2 1 1
13 2426 1 1 11 LEU CG C 1.259 3.969 -7.561 1.00 . A A . 11 LEU CG 1 1
13 2427 1 1 11 LEU H H -0.447 1.821 -6.445 1.00 . A A . 11 LEU H 1 1
13 2428 1 1 11 LEU HA H 2.319 1.578 -7.119 1.00 . A A . 11 LEU HA 1 1
13 2429 1 1 11 LEU HB3 H 2.322 3.753 -5.703 1.00 . A A . 11 LEU HB3 1 1
13 2430 1 1 11 LEU HD11 H -0.408 5.194 -6.931 1.00 . A A . 11 LEU HD11 1 1
13 2431 1 1 11 LEU HD12 H 1.178 5.983 -6.772 1.00 . A A . 11 LEU HD12 1 1
13 2432 1 1 11 LEU HD13 H 0.430 5.791 -8.374 1.00 . A A . 11 LEU HD13 1 1
13 2433 1 1 11 LEU HD21 H 2.421 4.640 -9.254 1.00 . A A . 11 LEU HD21 1 1
13 2434 1 1 11 LEU HD22 H 3.254 4.807 -7.696 1.00 . A A . 11 LEU HD22 1 1
13 2435 1 1 11 LEU HD23 H 3.090 3.212 -8.456 1.00 . A A . 11 LEU HD23 1 1
13 2436 1 1 11 LEU HG H 0.624 3.328 -8.172 1.00 . A A . 11 LEU HG 1 1
13 2437 1 1 11 LEU N N 0.350 1.216 -6.555 1.00 . A A . 11 LEU N 1 1
13 2438 1 1 11 LEU O O 3.466 1.410 -4.767 1.00 . A A . 11 LEU O 1 1
13 2439 1 1 12 CYS C C 2.695 -0.974 -2.771 1.00 . A A . 12 CYS C 1 1
13 2440 1 1 12 CYS CA C 1.902 0.331 -2.783 1.00 . A A . 12 CYS CA 1 1
13 2441 1 1 12 CYS CB C 0.733 0.256 -1.808 1.00 . A A . 12 CYS CB 1 1
13 2442 1 1 12 CYS H H 0.515 0.401 -4.403 1.00 . A A . 12 CYS H 1 1
13 2443 1 1 12 CYS HA H 2.547 1.138 -2.428 1.00 . A A . 12 CYS HA 1 1
13 2444 1 1 12 CYS HB3 H 0.147 -0.639 -2.005 1.00 . A A . 12 CYS HB3 1 1
13 2445 1 1 12 CYS N N 1.456 0.655 -4.124 1.00 . A A . 12 CYS N 1 1
13 2446 1 1 12 CYS O O 2.138 -2.045 -2.552 1.00 . A A . 12 CYS O 1 1
13 2447 1 1 12 CYS SG S 1.398 0.187 -0.137 1.00 . A A . 12 CYS SG 1 1
13 2448 1 1 13 TYR C C 4.707 -3.084 -2.105 1.00 . A A . 13 TYR C 1 1
13 2449 1 1 13 TYR CA C 4.919 -1.995 -3.159 1.00 . A A . 13 TYR CA 1 1
13 2450 1 1 13 TYR CB C 6.358 -1.473 -3.083 1.00 . A A . 13 TYR CB 1 1
13 2451 1 1 13 TYR CD1 C 7.939 -3.456 -3.076 1.00 . A A . 13 TYR CD1 1 1
13 2452 1 1 13 TYR CD2 C 7.712 -2.143 -5.114 1.00 . A A . 13 TYR CD2 1 1
13 2453 1 1 13 TYR CE1 C 8.848 -4.308 -3.727 1.00 . A A . 13 TYR CE1 1 1
13 2454 1 1 13 TYR CE2 C 8.625 -2.992 -5.761 1.00 . A A . 13 TYR CE2 1 1
13 2455 1 1 13 TYR CG C 7.372 -2.369 -3.766 1.00 . A A . 13 TYR CG 1 1
13 2456 1 1 13 TYR CZ C 9.189 -4.075 -5.071 1.00 . A A . 13 TYR CZ 1 1
13 2457 1 1 13 TYR H H 4.342 0.052 -3.246 1.00 . A A . 13 TYR H 1 1
13 2458 1 1 13 TYR HA H 4.747 -2.422 -4.149 1.00 . A A . 13 TYR HA 1 1
13 2459 1 1 13 TYR HB3 H 6.651 -1.335 -2.040 1.00 . A A . 13 TYR HB3 1 1
13 2460 1 1 13 TYR HD1 H 7.667 -3.650 -2.048 1.00 . A A . 13 TYR HD1 1 1
13 2461 1 1 13 TYR HD2 H 7.266 -1.322 -5.657 1.00 . A A . 13 TYR HD2 1 1
13 2462 1 1 13 TYR HE1 H 9.270 -5.145 -3.190 1.00 . A A . 13 TYR HE1 1 1
13 2463 1 1 13 TYR HE2 H 8.884 -2.819 -6.795 1.00 . A A . 13 TYR HE2 1 1
13 2464 1 1 13 TYR HH H 10.382 -5.616 -5.155 1.00 . A A . 13 TYR HH 1 1
13 2465 1 1 13 TYR N N 4.003 -0.870 -3.004 1.00 . A A . 13 TYR N 1 1
13 2466 1 1 13 TYR O O 4.656 -4.269 -2.421 1.00 . A A . 13 TYR O 1 1
13 2467 1 1 13 TYR OH O 10.069 -4.897 -5.709 1.00 . A A . 13 TYR OH 1 1
13 2468 1 1 14 CYS C C 3.148 -3.978 0.616 1.00 . A A . 14 CYS C 1 1
13 2469 1 1 14 CYS CA C 4.586 -3.563 0.307 1.00 . A A . 14 CYS CA 1 1
13 2470 1 1 14 CYS CB C 5.255 -2.901 1.515 1.00 . A A . 14 CYS CB 1 1
13 2471 1 1 14 CYS H H 4.674 -1.657 -0.695 1.00 . A A . 14 CYS H 1 1
13 2472 1 1 14 CYS HA H 5.151 -4.470 0.085 1.00 . A A . 14 CYS HA 1 1
13 2473 1 1 14 CYS HB3 H 6.311 -2.798 1.284 1.00 . A A . 14 CYS HB3 1 1
13 2474 1 1 14 CYS N N 4.650 -2.661 -0.843 1.00 . A A . 14 CYS N 1 1
13 2475 1 1 14 CYS O O 2.869 -5.162 0.769 1.00 . A A . 14 CYS O 1 1
13 2476 1 1 14 CYS SG S 4.651 -1.255 1.934 1.00 . A A . 14 CYS SG 1 1
13 2477 1 1 15 CYS C C 0.473 -3.751 2.297 1.00 . A A . 15 CYS C 1 1
13 2478 1 1 15 CYS CA C 0.833 -3.056 0.978 1.00 . A A . 15 CYS CA 1 1
13 2479 1 1 15 CYS CB C 0.147 -3.759 -0.191 1.00 . A A . 15 CYS CB 1 1
13 2480 1 1 15 CYS H H 2.658 -2.079 0.507 1.00 . A A . 15 CYS H 1 1
13 2481 1 1 15 CYS HA H 0.475 -2.026 1.061 1.00 . A A . 15 CYS HA 1 1
13 2482 1 1 15 CYS HB3 H 0.502 -4.786 -0.215 1.00 . A A . 15 CYS HB3 1 1
13 2483 1 1 15 CYS N N 2.268 -2.980 0.710 1.00 . A A . 15 CYS N 1 1
13 2484 1 1 15 CYS O O 0.560 -4.972 2.410 1.00 . A A . 15 CYS O 1 1
13 2485 1 1 15 CYS SG S -1.654 -3.809 -0.101 1.00 . A A . 15 CYS SG 1 1
13 2486 1 1 16 ASP C C -1.636 -4.557 4.214 1.00 . A A . 16 ASP C 1 1
13 2487 1 1 16 ASP CA C -0.507 -3.572 4.531 1.00 . A A . 16 ASP CA 1 1
13 2488 1 1 16 ASP CB C -1.016 -2.448 5.437 1.00 . A A . 16 ASP CB 1 1
13 2489 1 1 16 ASP CG C -1.917 -2.949 6.556 1.00 . A A . 16 ASP CG 1 1
13 2490 1 1 16 ASP H H -0.085 -1.985 3.179 1.00 . A A . 16 ASP H 1 1
13 2491 1 1 16 ASP HA H 0.281 -4.118 5.051 1.00 . A A . 16 ASP HA 1 1
13 2492 1 1 16 ASP HB3 H -1.623 -1.803 4.813 1.00 . A A . 16 ASP HB3 1 1
13 2493 1 1 16 ASP N N 0.026 -2.988 3.302 1.00 . A A . 16 ASP N 1 1
13 2494 1 1 16 ASP O O -2.530 -4.248 3.425 1.00 . A A . 16 ASP O 1 1
13 2495 1 1 16 ASP OD1 O -1.696 -4.095 6.997 1.00 . A A . 16 ASP OD1 1 1
13 2496 1 1 16 ASP OD2 O -2.839 -2.181 6.911 1.00 . A A . 16 ASP OD2 1 1
14 2497 1 1 1 VAL C C 5.698 1.696 5.734 1.00 . A A . 1 VAL C 1 1
14 2498 1 1 1 VAL CA C 6.256 2.529 6.892 1.00 . A A . 1 VAL CA 1 1
14 2499 1 1 1 VAL CB C 5.627 3.935 6.978 1.00 . A A . 1 VAL CB 1 1
14 2500 1 1 1 VAL CG1 C 6.174 4.699 8.192 1.00 . A A . 1 VAL CG1 1 1
14 2501 1 1 1 VAL CG2 C 5.855 4.762 5.705 1.00 . A A . 1 VAL CG2 1 1
14 2502 1 1 1 VAL H1 H 8.052 2.130 5.921 1.00 . A A . 1 VAL H1 1 1
14 2503 1 1 1 VAL HA H 6.051 1.993 7.819 1.00 . A A . 1 VAL HA 1 1
14 2504 1 1 1 VAL HB H 4.551 3.829 7.123 1.00 . A A . 1 VAL HB 1 1
14 2505 1 1 1 VAL HG11 H 6.014 4.116 9.098 1.00 . A A . 1 VAL HG11 1 1
14 2506 1 1 1 VAL HG12 H 7.241 4.891 8.074 1.00 . A A . 1 VAL HG12 1 1
14 2507 1 1 1 VAL HG13 H 5.653 5.651 8.291 1.00 . A A . 1 VAL HG13 1 1
14 2508 1 1 1 VAL HG21 H 5.380 5.736 5.815 1.00 . A A . 1 VAL HG21 1 1
14 2509 1 1 1 VAL HG22 H 6.922 4.908 5.531 1.00 . A A . 1 VAL HG22 1 1
14 2510 1 1 1 VAL HG23 H 5.417 4.261 4.841 1.00 . A A . 1 VAL HG23 1 1
14 2511 1 1 1 VAL N N 7.696 2.623 6.734 1.00 . A A . 1 VAL N 1 1
14 2512 1 1 1 VAL O O 6.464 1.210 4.902 1.00 . A A . 1 VAL O 1 1
14 2513 1 1 2 CYS C C 2.323 1.597 4.438 1.00 . A A . 2 CYS C 1 1
14 2514 1 1 2 CYS CA C 3.669 0.897 4.576 1.00 . A A . 2 CYS CA 1 1
14 2515 1 1 2 CYS CB C 3.478 -0.591 4.878 1.00 . A A . 2 CYS CB 1 1
14 2516 1 1 2 CYS H H 3.777 2.021 6.334 1.00 . A A . 2 CYS H 1 1
14 2517 1 1 2 CYS HA H 4.227 1.028 3.645 1.00 . A A . 2 CYS HA 1 1
14 2518 1 1 2 CYS HB3 H 2.688 -0.705 5.615 1.00 . A A . 2 CYS HB3 1 1
14 2519 1 1 2 CYS N N 4.375 1.542 5.671 1.00 . A A . 2 CYS N 1 1
14 2520 1 1 2 CYS O O 1.967 2.378 5.322 1.00 . A A . 2 CYS O 1 1
14 2521 1 1 2 CYS SG S 3.000 -1.524 3.422 1.00 . A A . 2 CYS SG 1 1
14 2522 1 1 3 CYS C C -0.767 1.094 3.672 1.00 . A A . 3 CYS C 1 1
14 2523 1 1 3 CYS CA C 0.312 2.025 3.127 1.00 . A A . 3 CYS CA 1 1
14 2524 1 1 3 CYS CB C 0.092 2.348 1.643 1.00 . A A . 3 CYS CB 1 1
14 2525 1 1 3 CYS H H 1.804 0.598 2.724 1.00 . A A . 3 CYS H 1 1
14 2526 1 1 3 CYS HA H 0.330 2.979 3.652 1.00 . A A . 3 CYS HA 1 1
14 2527 1 1 3 CYS HB3 H -0.367 3.330 1.596 1.00 . A A . 3 CYS HB3 1 1
14 2528 1 1 3 CYS N N 1.578 1.354 3.356 1.00 . A A . 3 CYS N 1 1
14 2529 1 1 3 CYS O O -0.734 -0.092 3.332 1.00 . A A . 3 CYS O 1 1
14 2530 1 1 3 CYS SG S 1.535 2.379 0.551 1.00 . A A . 3 CYS SG 1 1
14 2531 1 1 4 PRO C C -3.573 0.084 4.230 1.00 . A A . 4 PRO C 1 1
14 2532 1 1 4 PRO CA C -2.645 0.763 5.231 1.00 . A A . 4 PRO CA 1 1
14 2533 1 1 4 PRO CB C -3.420 1.716 6.146 1.00 . A A . 4 PRO CB 1 1
14 2534 1 1 4 PRO CD C -1.883 2.994 4.844 1.00 . A A . 4 PRO CD 1 1
14 2535 1 1 4 PRO CG C -3.280 3.071 5.455 1.00 . A A . 4 PRO CG 1 1
14 2536 1 1 4 PRO HA H -2.141 0.022 5.847 1.00 . A A . 4 PRO HA 1 1
14 2537 1 1 4 PRO HB3 H -2.930 1.757 7.120 1.00 . A A . 4 PRO HB3 1 1
14 2538 1 1 4 PRO HD3 H -1.140 3.316 5.576 1.00 . A A . 4 PRO HD3 1 1
14 2539 1 1 4 PRO HG3 H -3.388 3.906 6.148 1.00 . A A . 4 PRO HG3 1 1
14 2540 1 1 4 PRO N N -1.673 1.589 4.533 1.00 . A A . 4 PRO N 1 1
14 2541 1 1 4 PRO O O -3.808 0.625 3.155 1.00 . A A . 4 PRO O 1 1
14 2542 1 1 5 PHE C C -6.144 -0.858 3.184 1.00 . A A . 5 PHE C 1 1
14 2543 1 1 5 PHE CA C -5.116 -1.804 3.811 1.00 . A A . 5 PHE CA 1 1
14 2544 1 1 5 PHE CB C -5.774 -2.845 4.725 1.00 . A A . 5 PHE CB 1 1
14 2545 1 1 5 PHE CD1 C -6.157 -5.008 3.488 1.00 . A A . 5 PHE CD1 1 1
14 2546 1 1 5 PHE CD2 C -8.053 -3.525 3.850 1.00 . A A . 5 PHE CD2 1 1
14 2547 1 1 5 PHE CE1 C -6.997 -5.926 2.834 1.00 . A A . 5 PHE CE1 1 1
14 2548 1 1 5 PHE CE2 C -8.893 -4.439 3.189 1.00 . A A . 5 PHE CE2 1 1
14 2549 1 1 5 PHE CG C -6.685 -3.814 4.006 1.00 . A A . 5 PHE CG 1 1
14 2550 1 1 5 PHE CZ C -8.366 -5.642 2.686 1.00 . A A . 5 PHE CZ 1 1
14 2551 1 1 5 PHE H H -3.777 -1.530 5.441 1.00 . A A . 5 PHE H 1 1
14 2552 1 1 5 PHE HA H -4.605 -2.304 2.988 1.00 . A A . 5 PHE HA 1 1
14 2553 1 1 5 PHE HB3 H -6.336 -2.342 5.512 1.00 . A A . 5 PHE HB3 1 1
14 2554 1 1 5 PHE HD1 H -5.101 -5.216 3.596 1.00 . A A . 5 PHE HD1 1 1
14 2555 1 1 5 PHE HD2 H -8.461 -2.600 4.231 1.00 . A A . 5 PHE HD2 1 1
14 2556 1 1 5 PHE HE1 H -6.586 -6.845 2.442 1.00 . A A . 5 PHE HE1 1 1
14 2557 1 1 5 PHE HE2 H -9.943 -4.215 3.065 1.00 . A A . 5 PHE HE2 1 1
14 2558 1 1 5 PHE HZ H -9.011 -6.346 2.179 1.00 . A A . 5 PHE HZ 1 1
14 2559 1 1 5 PHE N N -4.126 -1.077 4.592 1.00 . A A . 5 PHE N 1 1
14 2560 1 1 5 PHE O O -6.318 -0.838 1.967 1.00 . A A . 5 PHE O 1 1
14 2561 1 1 6 GLY C C -6.845 2.217 3.002 1.00 . A A . 6 GLY C 1 1
14 2562 1 1 6 GLY CA C -7.659 1.035 3.532 1.00 . A A . 6 GLY CA 1 1
14 2563 1 1 6 GLY H H -6.547 -0.047 4.988 1.00 . A A . 6 GLY H 1 1
14 2564 1 1 6 GLY HA2 H -8.316 0.661 2.745 1.00 . A A . 6 GLY HA2 1 1
14 2565 1 1 6 GLY HA3 H -8.278 1.373 4.364 1.00 . A A . 6 GLY HA3 1 1
14 2566 1 1 6 GLY N N -6.781 -0.023 4.008 1.00 . A A . 6 GLY N 1 1
14 2567 1 1 6 GLY O O -6.912 3.309 3.561 1.00 . A A . 6 GLY O 1 1
14 2568 1 1 7 GLY C C -4.303 2.496 0.261 1.00 . A A . 7 GLY C 1 1
14 2569 1 1 7 GLY CA C -5.216 3.037 1.361 1.00 . A A . 7 GLY CA 1 1
14 2570 1 1 7 GLY H H -6.013 1.055 1.578 1.00 . A A . 7 GLY H 1 1
14 2571 1 1 7 GLY HA2 H -5.842 3.829 0.948 1.00 . A A . 7 GLY HA2 1 1
14 2572 1 1 7 GLY HA3 H -4.587 3.460 2.146 1.00 . A A . 7 GLY HA3 1 1
14 2573 1 1 7 GLY N N -6.072 2.004 1.935 1.00 . A A . 7 GLY N 1 1
14 2574 1 1 7 GLY O O -4.023 3.193 -0.712 1.00 . A A . 7 GLY O 1 1
14 2575 1 1 8 CYS C C -3.594 0.565 -1.933 1.00 . A A . 8 CYS C 1 1
14 2576 1 1 8 CYS CA C -2.967 0.581 -0.534 1.00 . A A . 8 CYS CA 1 1
14 2577 1 1 8 CYS CB C -2.683 -0.842 -0.039 1.00 . A A . 8 CYS CB 1 1
14 2578 1 1 8 CYS H H -4.059 0.769 1.274 1.00 . A A . 8 CYS H 1 1
14 2579 1 1 8 CYS HA H -2.020 1.116 -0.595 1.00 . A A . 8 CYS HA 1 1
14 2580 1 1 8 CYS HB3 H -3.591 -1.274 0.382 1.00 . A A . 8 CYS HB3 1 1
14 2581 1 1 8 CYS N N -3.818 1.265 0.427 1.00 . A A . 8 CYS N 1 1
14 2582 1 1 8 CYS O O -4.802 0.393 -2.076 1.00 . A A . 8 CYS O 1 1
14 2583 1 1 8 CYS SG S -2.140 -1.964 -1.346 1.00 . A A . 8 CYS SG 1 1
14 2584 1 1 9 HIS C C -1.923 -0.092 -5.027 1.00 . A A . 9 HIS C 1 1
14 2585 1 1 9 HIS CA C -3.104 0.614 -4.361 1.00 . A A . 9 HIS CA 1 1
14 2586 1 1 9 HIS CB C -3.376 2.010 -4.949 1.00 . A A . 9 HIS CB 1 1
14 2587 1 1 9 HIS CD2 C -5.939 2.221 -4.877 1.00 . A A . 9 HIS CD2 1 1
14 2588 1 1 9 HIS CE1 C -6.361 2.333 -7.031 1.00 . A A . 9 HIS CE1 1 1
14 2589 1 1 9 HIS CG C -4.750 2.153 -5.553 1.00 . A A . 9 HIS CG 1 1
14 2590 1 1 9 HIS H H -1.758 0.780 -2.798 1.00 . A A . 9 HIS H 1 1
14 2591 1 1 9 HIS HA H -3.983 -0.024 -4.474 1.00 . A A . 9 HIS HA 1 1
14 2592 1 1 9 HIS HB3 H -2.631 2.272 -5.701 1.00 . A A . 9 HIS HB3 1 1
14 2593 1 1 9 HIS HD1 H -4.338 2.173 -7.644 1.00 . A A . 9 HIS HD1 1 1
14 2594 1 1 9 HIS HD2 H -6.068 2.186 -3.806 1.00 . A A . 9 HIS HD2 1 1
14 2595 1 1 9 HIS HE1 H -6.877 2.396 -7.978 1.00 . A A . 9 HIS HE1 1 1
14 2596 1 1 9 HIS N N -2.755 0.738 -2.959 1.00 . A A . 9 HIS N 1 1
14 2597 1 1 9 HIS ND1 N -5.030 2.230 -6.896 1.00 . A A . 9 HIS ND1 1 1
14 2598 1 1 9 HIS NE2 N -6.960 2.337 -5.828 1.00 . A A . 9 HIS NE2 1 1
14 2599 1 1 9 HIS O O -1.019 -0.561 -4.333 1.00 . A A . 9 HIS O 1 1
14 2600 1 1 10 GLU C C 0.517 -0.194 -6.777 1.00 . A A . 10 GLU C 1 1
14 2601 1 1 10 GLU CA C -0.842 -0.782 -7.132 1.00 . A A . 10 GLU CA 1 1
14 2602 1 1 10 GLU CB C -1.081 -0.598 -8.643 1.00 . A A . 10 GLU CB 1 1
14 2603 1 1 10 GLU CD C -3.220 0.740 -9.042 1.00 . A A . 10 GLU CD 1 1
14 2604 1 1 10 GLU CG C -2.560 -0.631 -9.043 1.00 . A A . 10 GLU CG 1 1
14 2605 1 1 10 GLU H H -2.540 0.480 -6.858 1.00 . A A . 10 GLU H 1 1
14 2606 1 1 10 GLU HA H -0.845 -1.842 -6.883 1.00 . A A . 10 GLU HA 1 1
14 2607 1 1 10 GLU HB3 H -0.554 -1.404 -9.156 1.00 . A A . 10 GLU HB3 1 1
14 2608 1 1 10 GLU HG3 H -3.098 -1.280 -8.359 1.00 . A A . 10 GLU HG3 1 1
14 2609 1 1 10 GLU N N -1.889 -0.123 -6.355 1.00 . A A . 10 GLU N 1 1
14 2610 1 1 10 GLU O O 1.530 -0.883 -6.700 1.00 . A A . 10 GLU O 1 1
14 2611 1 1 10 GLU OE1 O -2.814 1.565 -8.192 1.00 . A A . 10 GLU OE1 1 1
14 2612 1 1 10 GLU OE2 O -4.171 0.939 -9.822 1.00 . A A . 10 GLU OE2 1 1
14 2613 1 1 11 LEU C C 2.297 1.456 -4.918 1.00 . A A . 11 LEU C 1 1
14 2614 1 1 11 LEU CA C 1.659 1.920 -6.233 1.00 . A A . 11 LEU CA 1 1
14 2615 1 1 11 LEU CB C 1.205 3.382 -6.127 1.00 . A A . 11 LEU CB 1 1
14 2616 1 1 11 LEU CD1 C 0.165 3.555 -8.457 1.00 . A A . 11 LEU CD1 1 1
14 2617 1 1 11 LEU CD2 C 0.864 5.607 -7.214 1.00 . A A . 11 LEU CD2 1 1
14 2618 1 1 11 LEU CG C 1.187 4.130 -7.470 1.00 . A A . 11 LEU CG 1 1
14 2619 1 1 11 LEU H H -0.394 1.579 -6.655 1.00 . A A . 11 LEU H 1 1
14 2620 1 1 11 LEU HA H 2.412 1.830 -7.018 1.00 . A A . 11 LEU HA 1 1
14 2621 1 1 11 LEU HB3 H 1.906 3.887 -5.476 1.00 . A A . 11 LEU HB3 1 1
14 2622 1 1 11 LEU HD11 H -0.823 3.511 -7.997 1.00 . A A . 11 LEU HD11 1 1
14 2623 1 1 11 LEU HD12 H 0.115 4.186 -9.344 1.00 . A A . 11 LEU HD12 1 1
14 2624 1 1 11 LEU HD13 H 0.465 2.556 -8.771 1.00 . A A . 11 LEU HD13 1 1
14 2625 1 1 11 LEU HD21 H 1.604 6.038 -6.538 1.00 . A A . 11 LEU HD21 1 1
14 2626 1 1 11 LEU HD22 H 0.889 6.159 -8.155 1.00 . A A . 11 LEU HD22 1 1
14 2627 1 1 11 LEU HD23 H -0.126 5.703 -6.770 1.00 . A A . 11 LEU HD23 1 1
14 2628 1 1 11 LEU HG H 2.179 4.075 -7.921 1.00 . A A . 11 LEU HG 1 1
14 2629 1 1 11 LEU N N 0.504 1.120 -6.573 1.00 . A A . 11 LEU N 1 1
14 2630 1 1 11 LEU O O 3.489 1.674 -4.699 1.00 . A A . 11 LEU O 1 1
14 2631 1 1 12 CYS C C 2.809 -0.762 -2.704 1.00 . A A . 12 CYS C 1 1
14 2632 1 1 12 CYS CA C 2.012 0.541 -2.686 1.00 . A A . 12 CYS CA 1 1
14 2633 1 1 12 CYS CB C 0.880 0.444 -1.671 1.00 . A A . 12 CYS CB 1 1
14 2634 1 1 12 CYS H H 0.584 0.556 -4.268 1.00 . A A . 12 CYS H 1 1
14 2635 1 1 12 CYS HA H 2.660 1.353 -2.351 1.00 . A A . 12 CYS HA 1 1
14 2636 1 1 12 CYS HB3 H 0.303 -0.462 -1.844 1.00 . A A . 12 CYS HB3 1 1
14 2637 1 1 12 CYS N N 1.515 0.861 -4.012 1.00 . A A . 12 CYS N 1 1
14 2638 1 1 12 CYS O O 2.237 -1.843 -2.611 1.00 . A A . 12 CYS O 1 1
14 2639 1 1 12 CYS SG S 1.604 0.390 -0.025 1.00 . A A . 12 CYS SG 1 1
14 2640 1 1 13 TYR C C 4.763 -2.902 -1.935 1.00 . A A . 13 TYR C 1 1
14 2641 1 1 13 TYR CA C 5.036 -1.794 -2.956 1.00 . A A . 13 TYR CA 1 1
14 2642 1 1 13 TYR CB C 6.482 -1.303 -2.818 1.00 . A A . 13 TYR CB 1 1
14 2643 1 1 13 TYR CD1 C 8.035 -3.307 -2.815 1.00 . A A . 13 TYR CD1 1 1
14 2644 1 1 13 TYR CD2 C 7.852 -1.967 -4.839 1.00 . A A . 13 TYR CD2 1 1
14 2645 1 1 13 TYR CE1 C 8.939 -4.164 -3.466 1.00 . A A . 13 TYR CE1 1 1
14 2646 1 1 13 TYR CE2 C 8.757 -2.825 -5.490 1.00 . A A . 13 TYR CE2 1 1
14 2647 1 1 13 TYR CG C 7.496 -2.202 -3.498 1.00 . A A . 13 TYR CG 1 1
14 2648 1 1 13 TYR CZ C 9.299 -3.924 -4.802 1.00 . A A . 13 TYR CZ 1 1
14 2649 1 1 13 TYR H H 4.508 0.271 -2.957 1.00 . A A . 13 TYR H 1 1
14 2650 1 1 13 TYR HA H 4.891 -2.197 -3.960 1.00 . A A . 13 TYR HA 1 1
14 2651 1 1 13 TYR HB3 H 6.745 -1.201 -1.765 1.00 . A A . 13 TYR HB3 1 1
14 2652 1 1 13 TYR HD1 H 7.747 -3.511 -1.793 1.00 . A A . 13 TYR HD1 1 1
14 2653 1 1 13 TYR HD2 H 7.423 -1.134 -5.378 1.00 . A A . 13 TYR HD2 1 1
14 2654 1 1 13 TYR HE1 H 9.347 -5.018 -2.945 1.00 . A A . 13 TYR HE1 1 1
14 2655 1 1 13 TYR HE2 H 9.022 -2.635 -6.519 1.00 . A A . 13 TYR HE2 1 1
14 2656 1 1 13 TYR HH H 10.340 -4.516 -6.340 1.00 . A A . 13 TYR HH 1 1
14 2657 1 1 13 TYR N N 4.134 -0.655 -2.812 1.00 . A A . 13 TYR N 1 1
14 2658 1 1 13 TYR O O 4.685 -4.077 -2.282 1.00 . A A . 13 TYR O 1 1
14 2659 1 1 13 TYR OH O 10.174 -4.761 -5.428 1.00 . A A . 13 TYR OH 1 1
14 2660 1 1 14 CYS C C 3.129 -3.851 0.718 1.00 . A A . 14 CYS C 1 1
14 2661 1 1 14 CYS CA C 4.579 -3.446 0.462 1.00 . A A . 14 CYS CA 1 1
14 2662 1 1 14 CYS CB C 5.214 -2.817 1.706 1.00 . A A . 14 CYS CB 1 1
14 2663 1 1 14 CYS H H 4.743 -1.517 -0.476 1.00 . A A . 14 CYS H 1 1
14 2664 1 1 14 CYS HA H 5.142 -4.353 0.234 1.00 . A A . 14 CYS HA 1 1
14 2665 1 1 14 CYS HB3 H 6.278 -2.716 1.511 1.00 . A A . 14 CYS HB3 1 1
14 2666 1 1 14 CYS N N 4.687 -2.513 -0.661 1.00 . A A . 14 CYS N 1 1
14 2667 1 1 14 CYS O O 2.831 -5.030 0.873 1.00 . A A . 14 CYS O 1 1
14 2668 1 1 14 CYS SG S 4.605 -1.180 2.150 1.00 . A A . 14 CYS SG 1 1
14 2669 1 1 15 CYS C C 0.323 -3.661 2.160 1.00 . A A . 15 CYS C 1 1
14 2670 1 1 15 CYS CA C 0.799 -2.924 0.902 1.00 . A A . 15 CYS CA 1 1
14 2671 1 1 15 CYS CB C 0.211 -3.597 -0.339 1.00 . A A . 15 CYS CB 1 1
14 2672 1 1 15 CYS H H 2.666 -1.949 0.604 1.00 . A A . 15 CYS H 1 1
14 2673 1 1 15 CYS HA H 0.434 -1.896 0.976 1.00 . A A . 15 CYS HA 1 1
14 2674 1 1 15 CYS HB3 H 0.594 -4.614 -0.387 1.00 . A A . 15 CYS HB3 1 1
14 2675 1 1 15 CYS N N 2.252 -2.848 0.759 1.00 . A A . 15 CYS N 1 1
14 2676 1 1 15 CYS O O 0.215 -4.884 2.163 1.00 . A A . 15 CYS O 1 1
14 2677 1 1 15 CYS SG S -1.591 -3.708 -0.362 1.00 . A A . 15 CYS SG 1 1
14 2678 1 1 16 ASP C C -2.240 -3.576 3.973 1.00 . A A . 16 ASP C 1 1
14 2679 1 1 16 ASP CA C -0.762 -3.469 4.345 1.00 . A A . 16 ASP CA 1 1
14 2680 1 1 16 ASP CB C -0.560 -2.555 5.554 1.00 . A A . 16 ASP CB 1 1
14 2681 1 1 16 ASP CG C -1.573 -2.846 6.653 1.00 . A A . 16 ASP CG 1 1
14 2682 1 1 16 ASP H H 0.057 -1.908 3.208 1.00 . A A . 16 ASP H 1 1
14 2683 1 1 16 ASP HA H -0.395 -4.465 4.601 1.00 . A A . 16 ASP HA 1 1
14 2684 1 1 16 ASP HB3 H -0.690 -1.519 5.268 1.00 . A A . 16 ASP HB3 1 1
14 2685 1 1 16 ASP N N -0.026 -2.919 3.220 1.00 . A A . 16 ASP N 1 1
14 2686 1 1 16 ASP O O -2.681 -4.549 3.363 1.00 . A A . 16 ASP O 1 1
14 2687 1 1 16 ASP OD1 O -2.733 -2.411 6.465 1.00 . A A . 16 ASP OD1 1 1
14 2688 1 1 16 ASP OD2 O -1.181 -3.502 7.638 1.00 . A A . 16 ASP OD2 1 1
15 2689 1 1 1 VAL C C 5.412 2.497 5.341 1.00 . A A . 1 VAL C 1 1
15 2690 1 1 1 VAL CA C 6.105 3.084 6.572 1.00 . A A . 1 VAL CA 1 1
15 2691 1 1 1 VAL CB C 5.096 3.605 7.613 1.00 . A A . 1 VAL CB 1 1
15 2692 1 1 1 VAL CG1 C 5.818 4.044 8.893 1.00 . A A . 1 VAL CG1 1 1
15 2693 1 1 1 VAL CG2 C 4.248 4.770 7.079 1.00 . A A . 1 VAL CG2 1 1
15 2694 1 1 1 VAL H1 H 6.892 4.393 5.160 1.00 . A A . 1 VAL H1 1 1
15 2695 1 1 1 VAL HA H 6.713 2.301 7.027 1.00 . A A . 1 VAL HA 1 1
15 2696 1 1 1 VAL HB H 4.421 2.790 7.878 1.00 . A A . 1 VAL HB 1 1
15 2697 1 1 1 VAL HG11 H 5.086 4.346 9.643 1.00 . A A . 1 VAL HG11 1 1
15 2698 1 1 1 VAL HG12 H 6.405 3.216 9.289 1.00 . A A . 1 VAL HG12 1 1
15 2699 1 1 1 VAL HG13 H 6.480 4.885 8.687 1.00 . A A . 1 VAL HG13 1 1
15 2700 1 1 1 VAL HG21 H 4.880 5.625 6.837 1.00 . A A . 1 VAL HG21 1 1
15 2701 1 1 1 VAL HG22 H 3.703 4.465 6.185 1.00 . A A . 1 VAL HG22 1 1
15 2702 1 1 1 VAL HG23 H 3.525 5.071 7.838 1.00 . A A . 1 VAL HG23 1 1
15 2703 1 1 1 VAL N N 6.991 4.149 6.139 1.00 . A A . 1 VAL N 1 1
15 2704 1 1 1 VAL O O 5.473 3.088 4.261 1.00 . A A . 1 VAL O 1 1
15 2705 1 1 2 CYS C C 2.626 1.521 4.340 1.00 . A A . 2 CYS C 1 1
15 2706 1 1 2 CYS CA C 3.949 0.762 4.435 1.00 . A A . 2 CYS CA 1 1
15 2707 1 1 2 CYS CB C 3.702 -0.722 4.712 1.00 . A A . 2 CYS CB 1 1
15 2708 1 1 2 CYS H H 4.716 0.927 6.413 1.00 . A A . 2 CYS H 1 1
15 2709 1 1 2 CYS HA H 4.478 0.868 3.484 1.00 . A A . 2 CYS HA 1 1
15 2710 1 1 2 CYS HB3 H 2.923 -0.818 5.465 1.00 . A A . 2 CYS HB3 1 1
15 2711 1 1 2 CYS N N 4.766 1.339 5.494 1.00 . A A . 2 CYS N 1 1
15 2712 1 1 2 CYS O O 2.292 2.278 5.251 1.00 . A A . 2 CYS O 1 1
15 2713 1 1 2 CYS SG S 3.152 -1.603 3.249 1.00 . A A . 2 CYS SG 1 1
15 2714 1 1 3 CYS C C -0.476 1.141 3.673 1.00 . A A . 3 CYS C 1 1
15 2715 1 1 3 CYS CA C 0.605 2.043 3.084 1.00 . A A . 3 CYS CA 1 1
15 2716 1 1 3 CYS CB C 0.334 2.373 1.607 1.00 . A A . 3 CYS CB 1 1
15 2717 1 1 3 CYS H H 2.037 0.576 2.615 1.00 . A A . 3 CYS H 1 1
15 2718 1 1 3 CYS HA H 0.673 2.994 3.609 1.00 . A A . 3 CYS HA 1 1
15 2719 1 1 3 CYS HB3 H -0.071 3.378 1.575 1.00 . A A . 3 CYS HB3 1 1
15 2720 1 1 3 CYS N N 1.859 1.333 3.262 1.00 . A A . 3 CYS N 1 1
15 2721 1 1 3 CYS O O -0.458 -0.054 3.367 1.00 . A A . 3 CYS O 1 1
15 2722 1 1 3 CYS SG S 1.721 2.317 0.447 1.00 . A A . 3 CYS SG 1 1
15 2723 1 1 4 PRO C C -3.321 0.231 4.242 1.00 . A A . 4 PRO C 1 1
15 2724 1 1 4 PRO CA C -2.367 0.886 5.236 1.00 . A A . 4 PRO CA 1 1
15 2725 1 1 4 PRO CB C -3.114 1.875 6.137 1.00 . A A . 4 PRO CB 1 1
15 2726 1 1 4 PRO CD C -1.539 3.089 4.814 1.00 . A A . 4 PRO CD 1 1
15 2727 1 1 4 PRO CG C -2.932 3.215 5.427 1.00 . A A . 4 PRO CG 1 1
15 2728 1 1 4 PRO HA H -1.883 0.136 5.860 1.00 . A A . 4 PRO HA 1 1
15 2729 1 1 4 PRO HB3 H -2.628 1.912 7.112 1.00 . A A . 4 PRO HB3 1 1
15 2730 1 1 4 PRO HD3 H -0.785 3.402 5.537 1.00 . A A . 4 PRO HD3 1 1
15 2731 1 1 4 PRO HG3 H -3.012 4.062 6.110 1.00 . A A . 4 PRO HG3 1 1
15 2732 1 1 4 PRO N N -1.369 1.673 4.527 1.00 . A A . 4 PRO N 1 1
15 2733 1 1 4 PRO O O -3.538 0.775 3.163 1.00 . A A . 4 PRO O 1 1
15 2734 1 1 5 PHE C C -5.922 -0.690 3.209 1.00 . A A . 5 PHE C 1 1
15 2735 1 1 5 PHE CA C -4.868 -1.634 3.788 1.00 . A A . 5 PHE CA 1 1
15 2736 1 1 5 PHE CB C -5.486 -2.739 4.651 1.00 . A A . 5 PHE CB 1 1
15 2737 1 1 5 PHE CD1 C -5.939 -4.725 3.172 1.00 . A A . 5 PHE CD1 1 1
15 2738 1 1 5 PHE CD2 C -7.826 -3.389 3.932 1.00 . A A . 5 PHE CD2 1 1
15 2739 1 1 5 PHE CE1 C -6.818 -5.580 2.483 1.00 . A A . 5 PHE CE1 1 1
15 2740 1 1 5 PHE CE2 C -8.707 -4.240 3.239 1.00 . A A . 5 PHE CE2 1 1
15 2741 1 1 5 PHE CG C -6.444 -3.641 3.908 1.00 . A A . 5 PHE CG 1 1
15 2742 1 1 5 PHE CZ C -8.203 -5.339 2.520 1.00 . A A . 5 PHE CZ 1 1
15 2743 1 1 5 PHE H H -3.622 -1.363 5.475 1.00 . A A . 5 PHE H 1 1
15 2744 1 1 5 PHE HA H -4.331 -2.081 2.950 1.00 . A A . 5 PHE HA 1 1
15 2745 1 1 5 PHE HB3 H -5.996 -2.295 5.505 1.00 . A A . 5 PHE HB3 1 1
15 2746 1 1 5 PHE HD1 H -4.871 -4.887 3.138 1.00 . A A . 5 PHE HD1 1 1
15 2747 1 1 5 PHE HD2 H -8.209 -2.539 4.477 1.00 . A A . 5 PHE HD2 1 1
15 2748 1 1 5 PHE HE1 H -6.425 -6.415 1.922 1.00 . A A . 5 PHE HE1 1 1
15 2749 1 1 5 PHE HE2 H -9.769 -4.046 3.255 1.00 . A A . 5 PHE HE2 1 1
15 2750 1 1 5 PHE HZ H -8.878 -5.992 1.987 1.00 . A A . 5 PHE HZ 1 1
15 2751 1 1 5 PHE N N -3.915 -0.906 4.608 1.00 . A A . 5 PHE N 1 1
15 2752 1 1 5 PHE O O -6.138 -0.651 1.999 1.00 . A A . 5 PHE O 1 1
15 2753 1 1 6 GLY C C -6.571 2.391 3.107 1.00 . A A . 6 GLY C 1 1
15 2754 1 1 6 GLY CA C -7.396 1.221 3.648 1.00 . A A . 6 GLY CA 1 1
15 2755 1 1 6 GLY H H -6.255 0.086 5.040 1.00 . A A . 6 GLY H 1 1
15 2756 1 1 6 GLY HA2 H -8.090 0.877 2.879 1.00 . A A . 6 GLY HA2 1 1
15 2757 1 1 6 GLY HA3 H -7.974 1.557 4.508 1.00 . A A . 6 GLY HA3 1 1
15 2758 1 1 6 GLY N N -6.527 0.134 4.070 1.00 . A A . 6 GLY N 1 1
15 2759 1 1 6 GLY O O -6.571 3.469 3.697 1.00 . A A . 6 GLY O 1 1
15 2760 1 1 7 GLY C C -4.130 2.609 0.278 1.00 . A A . 7 GLY C 1 1
15 2761 1 1 7 GLY CA C -5.000 3.189 1.392 1.00 . A A . 7 GLY CA 1 1
15 2762 1 1 7 GLY H H -5.862 1.241 1.613 1.00 . A A . 7 GLY H 1 1
15 2763 1 1 7 GLY HA2 H -5.617 3.991 0.985 1.00 . A A . 7 GLY HA2 1 1
15 2764 1 1 7 GLY HA3 H -4.342 3.605 2.156 1.00 . A A . 7 GLY HA3 1 1
15 2765 1 1 7 GLY N N -5.864 2.181 1.995 1.00 . A A . 7 GLY N 1 1
15 2766 1 1 7 GLY O O -3.849 3.286 -0.710 1.00 . A A . 7 GLY O 1 1
15 2767 1 1 8 CYS C C -3.540 0.613 -1.901 1.00 . A A . 8 CYS C 1 1
15 2768 1 1 8 CYS CA C -2.875 0.638 -0.520 1.00 . A A . 8 CYS CA 1 1
15 2769 1 1 8 CYS CB C -2.616 -0.781 -0.001 1.00 . A A . 8 CYS CB 1 1
15 2770 1 1 8 CYS H H -3.923 0.886 1.304 1.00 . A A . 8 CYS H 1 1
15 2771 1 1 8 CYS HA H -1.916 1.148 -0.612 1.00 . A A . 8 CYS HA 1 1
15 2772 1 1 8 CYS HB3 H -3.523 -1.177 0.458 1.00 . A A . 8 CYS HB3 1 1
15 2773 1 1 8 CYS N N -3.684 1.363 0.446 1.00 . A A . 8 CYS N 1 1
15 2774 1 1 8 CYS O O -4.757 0.479 -2.010 1.00 . A A . 8 CYS O 1 1
15 2775 1 1 8 CYS SG S -2.144 -1.950 -1.293 1.00 . A A . 8 CYS SG 1 1
15 2776 1 1 9 HIS C C -1.966 -0.133 -5.030 1.00 . A A . 9 HIS C 1 1
15 2777 1 1 9 HIS CA C -3.114 0.607 -4.343 1.00 . A A . 9 HIS CA 1 1
15 2778 1 1 9 HIS CB C -3.370 2.001 -4.941 1.00 . A A . 9 HIS CB 1 1
15 2779 1 1 9 HIS CD2 C -5.917 2.319 -4.765 1.00 . A A . 9 HIS CD2 1 1
15 2780 1 1 9 HIS CE1 C -6.431 2.367 -6.901 1.00 . A A . 9 HIS CE1 1 1
15 2781 1 1 9 HIS CG C -4.763 2.176 -5.488 1.00 . A A . 9 HIS CG 1 1
15 2782 1 1 9 HIS H H -1.723 0.752 -2.816 1.00 . A A . 9 HIS H 1 1
15 2783 1 1 9 HIS HA H -4.010 -0.013 -4.426 1.00 . A A . 9 HIS HA 1 1
15 2784 1 1 9 HIS HB3 H -2.654 2.229 -5.730 1.00 . A A . 9 HIS HB3 1 1
15 2785 1 1 9 HIS HD1 H -4.446 2.104 -7.595 1.00 . A A . 9 HIS HD1 1 1
15 2786 1 1 9 HIS HD2 H -5.997 2.332 -3.688 1.00 . A A . 9 HIS HD2 1 1
15 2787 1 1 9 HIS HE1 H -6.987 2.418 -7.825 1.00 . A A . 9 HIS HE1 1 1
15 2788 1 1 9 HIS N N -2.724 0.740 -2.952 1.00 . A A . 9 HIS N 1 1
15 2789 1 1 9 HIS ND1 N -5.100 2.213 -6.820 1.00 . A A . 9 HIS ND1 1 1
15 2790 1 1 9 HIS NE2 N -6.975 2.442 -5.672 1.00 . A A . 9 HIS NE2 1 1
15 2791 1 1 9 HIS O O -1.052 -0.607 -4.355 1.00 . A A . 9 HIS O 1 1
15 2792 1 1 10 GLU C C 0.427 -0.251 -6.841 1.00 . A A . 10 GLU C 1 1
15 2793 1 1 10 GLU CA C -0.939 -0.848 -7.154 1.00 . A A . 10 GLU CA 1 1
15 2794 1 1 10 GLU CB C -1.219 -0.684 -8.658 1.00 . A A . 10 GLU CB 1 1
15 2795 1 1 10 GLU CD C -3.385 0.628 -9.015 1.00 . A A . 10 GLU CD 1 1
15 2796 1 1 10 GLU CG C -2.710 -0.736 -9.018 1.00 . A A . 10 GLU CG 1 1
15 2797 1 1 10 GLU H H -2.629 0.418 -6.852 1.00 . A A . 10 GLU H 1 1
15 2798 1 1 10 GLU HA H -0.934 -1.906 -6.890 1.00 . A A . 10 GLU HA 1 1
15 2799 1 1 10 GLU HB3 H -0.698 -1.489 -9.178 1.00 . A A . 10 GLU HB3 1 1
15 2800 1 1 10 GLU HG3 H -3.221 -1.382 -8.310 1.00 . A A . 10 GLU HG3 1 1
15 2801 1 1 10 GLU N N -1.968 -0.181 -6.359 1.00 . A A . 10 GLU N 1 1
15 2802 1 1 10 GLU O O 1.443 -0.936 -6.776 1.00 . A A . 10 GLU O 1 1
15 2803 1 1 10 GLU OE1 O -2.959 1.470 -8.194 1.00 . A A . 10 GLU OE1 1 1
15 2804 1 1 10 GLU OE2 O -4.361 0.804 -9.769 1.00 . A A . 10 GLU OE2 1 1
15 2805 1 1 11 LEU C C 2.238 1.416 -5.036 1.00 . A A . 11 LEU C 1 1
15 2806 1 1 11 LEU CA C 1.566 1.877 -6.335 1.00 . A A . 11 LEU CA 1 1
15 2807 1 1 11 LEU CB C 1.095 3.332 -6.211 1.00 . A A . 11 LEU CB 1 1
15 2808 1 1 11 LEU CD1 C -0.044 3.497 -8.498 1.00 . A A . 11 LEU CD1 1 1
15 2809 1 1 11 LEU CD2 C 0.680 5.554 -7.280 1.00 . A A . 11 LEU CD2 1 1
15 2810 1 1 11 LEU CG C 1.011 4.082 -7.552 1.00 . A A . 11 LEU CG 1 1
15 2811 1 1 11 LEU H H -0.489 1.519 -6.721 1.00 . A A . 11 LEU H 1 1
15 2812 1 1 11 LEU HA H 2.300 1.798 -7.138 1.00 . A A . 11 LEU HA 1 1
15 2813 1 1 11 LEU HB3 H 1.816 3.848 -5.591 1.00 . A A . 11 LEU HB3 1 1
15 2814 1 1 11 LEU HD11 H -1.011 3.438 -7.996 1.00 . A A . 11 LEU HD11 1 1
15 2815 1 1 11 LEU HD12 H -0.141 4.133 -9.379 1.00 . A A . 11 LEU HD12 1 1
15 2816 1 1 11 LEU HD13 H 0.256 2.505 -8.831 1.00 . A A . 11 LEU HD13 1 1
15 2817 1 1 11 LEU HD21 H -0.293 5.635 -6.794 1.00 . A A . 11 LEU HD21 1 1
15 2818 1 1 11 LEU HD22 H 1.440 5.993 -6.634 1.00 . A A . 11 LEU HD22 1 1
15 2819 1 1 11 LEU HD23 H 0.658 6.109 -8.218 1.00 . A A . 11 LEU HD23 1 1
15 2820 1 1 11 LEU HG H 1.984 4.041 -8.045 1.00 . A A . 11 LEU HG 1 1
15 2821 1 1 11 LEU N N 0.412 1.066 -6.652 1.00 . A A . 11 LEU N 1 1
15 2822 1 1 11 LEU O O 3.436 1.627 -4.850 1.00 . A A . 11 LEU O 1 1
15 2823 1 1 12 CYS C C 2.782 -0.809 -2.835 1.00 . A A . 12 CYS C 1 1
15 2824 1 1 12 CYS CA C 2.002 0.503 -2.794 1.00 . A A . 12 CYS CA 1 1
15 2825 1 1 12 CYS CB C 0.892 0.420 -1.754 1.00 . A A . 12 CYS CB 1 1
15 2826 1 1 12 CYS H H 0.536 0.533 -4.339 1.00 . A A . 12 CYS H 1 1
15 2827 1 1 12 CYS HA H 2.668 1.307 -2.473 1.00 . A A . 12 CYS HA 1 1
15 2828 1 1 12 CYS HB3 H 0.292 -0.471 -1.924 1.00 . A A . 12 CYS HB3 1 1
15 2829 1 1 12 CYS N N 1.476 0.830 -4.106 1.00 . A A . 12 CYS N 1 1
15 2830 1 1 12 CYS O O 2.205 -1.882 -2.700 1.00 . A A . 12 CYS O 1 1
15 2831 1 1 12 CYS SG S 1.650 0.326 -0.125 1.00 . A A . 12 CYS SG 1 1
15 2832 1 1 13 TYR C C 4.736 -2.971 -2.165 1.00 . A A . 13 TYR C 1 1
15 2833 1 1 13 TYR CA C 4.996 -1.855 -3.179 1.00 . A A . 13 TYR CA 1 1
15 2834 1 1 13 TYR CB C 6.444 -1.369 -3.045 1.00 . A A . 13 TYR CB 1 1
15 2835 1 1 13 TYR CD1 C 7.825 -2.230 -4.982 1.00 . A A . 13 TYR CD1 1 1
15 2836 1 1 13 TYR CD2 C 8.004 -3.358 -2.830 1.00 . A A . 13 TYR CD2 1 1
15 2837 1 1 13 TYR CE1 C 8.732 -3.150 -5.537 1.00 . A A . 13 TYR CE1 1 1
15 2838 1 1 13 TYR CE2 C 8.906 -4.280 -3.388 1.00 . A A . 13 TYR CE2 1 1
15 2839 1 1 13 TYR CG C 7.464 -2.328 -3.626 1.00 . A A . 13 TYR CG 1 1
15 2840 1 1 13 TYR CZ C 9.269 -4.176 -4.743 1.00 . A A . 13 TYR CZ 1 1
15 2841 1 1 13 TYR H H 4.475 0.208 -3.173 1.00 . A A . 13 TYR H 1 1
15 2842 1 1 13 TYR HA H 4.843 -2.248 -4.186 1.00 . A A . 13 TYR HA 1 1
15 2843 1 1 13 TYR HB3 H 6.683 -1.188 -1.996 1.00 . A A . 13 TYR HB3 1 1
15 2844 1 1 13 TYR HD1 H 7.398 -1.458 -5.604 1.00 . A A . 13 TYR HD1 1 1
15 2845 1 1 13 TYR HD2 H 7.714 -3.455 -1.794 1.00 . A A . 13 TYR HD2 1 1
15 2846 1 1 13 TYR HE1 H 9.006 -3.077 -6.579 1.00 . A A . 13 TYR HE1 1 1
15 2847 1 1 13 TYR HE2 H 9.306 -5.072 -2.772 1.00 . A A . 13 TYR HE2 1 1
15 2848 1 1 13 TYR HH H 10.430 -5.740 -4.671 1.00 . A A . 13 TYR HH 1 1
15 2849 1 1 13 TYR N N 4.102 -0.716 -3.009 1.00 . A A . 13 TYR N 1 1
15 2850 1 1 13 TYR O O 4.621 -4.140 -2.522 1.00 . A A . 13 TYR O 1 1
15 2851 1 1 13 TYR OH O 10.140 -5.068 -5.292 1.00 . A A . 13 TYR OH 1 1
15 2852 1 1 14 CYS C C 3.181 -3.928 0.513 1.00 . A A . 14 CYS C 1 1
15 2853 1 1 14 CYS CA C 4.630 -3.534 0.229 1.00 . A A . 14 CYS CA 1 1
15 2854 1 1 14 CYS CB C 5.301 -2.929 1.464 1.00 . A A . 14 CYS CB 1 1
15 2855 1 1 14 CYS H H 4.799 -1.598 -0.703 1.00 . A A . 14 CYS H 1 1
15 2856 1 1 14 CYS HA H 5.177 -4.444 -0.023 1.00 . A A . 14 CYS HA 1 1
15 2857 1 1 14 CYS HB3 H 6.362 -2.843 1.247 1.00 . A A . 14 CYS HB3 1 1
15 2858 1 1 14 CYS N N 4.717 -2.593 -0.887 1.00 . A A . 14 CYS N 1 1
15 2859 1 1 14 CYS O O 2.877 -5.108 0.637 1.00 . A A . 14 CYS O 1 1
15 2860 1 1 14 CYS SG S 4.731 -1.284 1.935 1.00 . A A . 14 CYS SG 1 1
15 2861 1 1 15 CYS C C 0.487 -3.699 2.140 1.00 . A A . 15 CYS C 1 1
15 2862 1 1 15 CYS CA C 0.880 -2.965 0.852 1.00 . A A . 15 CYS CA 1 1
15 2863 1 1 15 CYS CB C 0.204 -3.624 -0.351 1.00 . A A . 15 CYS CB 1 1
15 2864 1 1 15 CYS H H 2.737 -2.017 0.450 1.00 . A A . 15 CYS H 1 1
15 2865 1 1 15 CYS HA H 0.543 -1.929 0.957 1.00 . A A . 15 CYS HA 1 1
15 2866 1 1 15 CYS HB3 H 0.556 -4.651 -0.411 1.00 . A A . 15 CYS HB3 1 1
15 2867 1 1 15 CYS N N 2.321 -2.913 0.613 1.00 . A A . 15 CYS N 1 1
15 2868 1 1 15 CYS O O 0.516 -4.926 2.198 1.00 . A A . 15 CYS O 1 1
15 2869 1 1 15 CYS SG S -1.597 -3.682 -0.282 1.00 . A A . 15 CYS SG 1 1
15 2870 1 1 16 ASP C C -1.639 -4.496 4.044 1.00 . A A . 16 ASP C 1 1
15 2871 1 1 16 ASP CA C -0.462 -3.579 4.388 1.00 . A A . 16 ASP CA 1 1
15 2872 1 1 16 ASP CB C -0.904 -2.483 5.361 1.00 . A A . 16 ASP CB 1 1
15 2873 1 1 16 ASP CG C -1.867 -2.998 6.419 1.00 . A A . 16 ASP CG 1 1
15 2874 1 1 16 ASP H H 0.004 -1.950 3.097 1.00 . A A . 16 ASP H 1 1
15 2875 1 1 16 ASP HA H 0.307 -4.187 4.867 1.00 . A A . 16 ASP HA 1 1
15 2876 1 1 16 ASP HB3 H -1.445 -1.751 4.777 1.00 . A A . 16 ASP HB3 1 1
15 2877 1 1 16 ASP N N 0.080 -2.960 3.179 1.00 . A A . 16 ASP N 1 1
15 2878 1 1 16 ASP O O -2.513 -4.118 3.262 1.00 . A A . 16 ASP O 1 1
15 2879 1 1 16 ASP OD1 O -1.643 -4.133 6.884 1.00 . A A . 16 ASP OD1 1 1
15 2880 1 1 16 ASP OD2 O -2.840 -2.260 6.693 1.00 . A A . 16 ASP OD2 1 1
16 2881 1 1 1 VAL C C 5.446 2.475 5.221 1.00 . A A . 1 VAL C 1 1
16 2882 1 1 1 VAL CA C 6.132 3.115 6.430 1.00 . A A . 1 VAL CA 1 1
16 2883 1 1 1 VAL CB C 5.132 3.853 7.339 1.00 . A A . 1 VAL CB 1 1
16 2884 1 1 1 VAL CG1 C 5.832 4.377 8.600 1.00 . A A . 1 VAL CG1 1 1
16 2885 1 1 1 VAL CG2 C 4.431 5.014 6.619 1.00 . A A . 1 VAL CG2 1 1
16 2886 1 1 1 VAL H1 H 7.138 4.170 4.945 1.00 . A A . 1 VAL H1 1 1
16 2887 1 1 1 VAL HA H 6.622 2.326 7.003 1.00 . A A . 1 VAL HA 1 1
16 2888 1 1 1 VAL HB H 4.367 3.143 7.657 1.00 . A A . 1 VAL HB 1 1
16 2889 1 1 1 VAL HG11 H 5.098 4.832 9.264 1.00 . A A . 1 VAL HG11 1 1
16 2890 1 1 1 VAL HG12 H 6.317 3.553 9.122 1.00 . A A . 1 VAL HG12 1 1
16 2891 1 1 1 VAL HG13 H 6.582 5.124 8.337 1.00 . A A . 1 VAL HG13 1 1
16 2892 1 1 1 VAL HG21 H 3.719 5.486 7.297 1.00 . A A . 1 VAL HG21 1 1
16 2893 1 1 1 VAL HG22 H 5.158 5.762 6.299 1.00 . A A . 1 VAL HG22 1 1
16 2894 1 1 1 VAL HG23 H 3.887 4.650 5.748 1.00 . A A . 1 VAL HG23 1 1
16 2895 1 1 1 VAL N N 7.156 4.024 5.949 1.00 . A A . 1 VAL N 1 1
16 2896 1 1 1 VAL O O 5.614 2.951 4.098 1.00 . A A . 1 VAL O 1 1
16 2897 1 1 2 CYS C C 2.532 1.534 4.311 1.00 . A A . 2 CYS C 1 1
16 2898 1 1 2 CYS CA C 3.865 0.792 4.407 1.00 . A A . 2 CYS CA 1 1
16 2899 1 1 2 CYS CB C 3.646 -0.690 4.715 1.00 . A A . 2 CYS CB 1 1
16 2900 1 1 2 CYS H H 4.548 1.095 6.397 1.00 . A A . 2 CYS H 1 1
16 2901 1 1 2 CYS HA H 4.378 0.889 3.448 1.00 . A A . 2 CYS HA 1 1
16 2902 1 1 2 CYS HB3 H 2.875 -0.789 5.476 1.00 . A A . 2 CYS HB3 1 1
16 2903 1 1 2 CYS N N 4.686 1.401 5.447 1.00 . A A . 2 CYS N 1 1
16 2904 1 1 2 CYS O O 2.215 2.327 5.197 1.00 . A A . 2 CYS O 1 1
16 2905 1 1 2 CYS SG S 3.109 -1.609 3.270 1.00 . A A . 2 CYS SG 1 1
16 2906 1 1 3 CYS C C -0.599 1.107 3.670 1.00 . A A . 3 CYS C 1 1
16 2907 1 1 3 CYS CA C 0.485 1.999 3.069 1.00 . A A . 3 CYS CA 1 1
16 2908 1 1 3 CYS CB C 0.215 2.308 1.588 1.00 . A A . 3 CYS CB 1 1
16 2909 1 1 3 CYS H H 1.921 0.529 2.623 1.00 . A A . 3 CYS H 1 1
16 2910 1 1 3 CYS HA H 0.550 2.959 3.580 1.00 . A A . 3 CYS HA 1 1
16 2911 1 1 3 CYS HB3 H -0.181 3.317 1.540 1.00 . A A . 3 CYS HB3 1 1
16 2912 1 1 3 CYS N N 1.743 1.296 3.258 1.00 . A A . 3 CYS N 1 1
16 2913 1 1 3 CYS O O -0.582 -0.092 3.384 1.00 . A A . 3 CYS O 1 1
16 2914 1 1 3 CYS SG S 1.602 2.222 0.429 1.00 . A A . 3 CYS SG 1 1
16 2915 1 1 4 PRO C C -3.463 0.219 4.279 1.00 . A A . 4 PRO C 1 1
16 2916 1 1 4 PRO CA C -2.488 0.885 5.243 1.00 . A A . 4 PRO CA 1 1
16 2917 1 1 4 PRO CB C -3.224 1.892 6.132 1.00 . A A . 4 PRO CB 1 1
16 2918 1 1 4 PRO CD C -1.658 3.077 4.773 1.00 . A A . 4 PRO CD 1 1
16 2919 1 1 4 PRO CG C -3.046 3.219 5.397 1.00 . A A . 4 PRO CG 1 1
16 2920 1 1 4 PRO HA H -2.001 0.140 5.871 1.00 . A A . 4 PRO HA 1 1
16 2921 1 1 4 PRO HB3 H -2.731 1.946 7.104 1.00 . A A . 4 PRO HB3 1 1
16 2922 1 1 4 PRO HD3 H -0.898 3.403 5.485 1.00 . A A . 4 PRO HD3 1 1
16 2923 1 1 4 PRO HG3 H -3.118 4.079 6.064 1.00 . A A . 4 PRO HG3 1 1
16 2924 1 1 4 PRO N N -1.495 1.656 4.511 1.00 . A A . 4 PRO N 1 1
16 2925 1 1 4 PRO O O -3.679 0.729 3.184 1.00 . A A . 4 PRO O 1 1
16 2926 1 1 5 PHE C C -6.088 -0.701 3.292 1.00 . A A . 5 PHE C 1 1
16 2927 1 1 5 PHE CA C -5.051 -1.636 3.914 1.00 . A A . 5 PHE CA 1 1
16 2928 1 1 5 PHE CB C -5.689 -2.682 4.833 1.00 . A A . 5 PHE CB 1 1
16 2929 1 1 5 PHE CD1 C -6.208 -4.630 3.330 1.00 . A A . 5 PHE CD1 1 1
16 2930 1 1 5 PHE CD2 C -8.064 -3.354 4.258 1.00 . A A . 5 PHE CD2 1 1
16 2931 1 1 5 PHE CE1 C -7.118 -5.475 2.670 1.00 . A A . 5 PHE CE1 1 1
16 2932 1 1 5 PHE CE2 C -8.974 -4.196 3.595 1.00 . A A . 5 PHE CE2 1 1
16 2933 1 1 5 PHE CG C -6.682 -3.582 4.136 1.00 . A A . 5 PHE CG 1 1
16 2934 1 1 5 PHE CZ C -8.501 -5.262 2.807 1.00 . A A . 5 PHE CZ 1 1
16 2935 1 1 5 PHE H H -3.779 -1.319 5.572 1.00 . A A . 5 PHE H 1 1
16 2936 1 1 5 PHE HA H -4.522 -2.140 3.105 1.00 . A A . 5 PHE HA 1 1
16 2937 1 1 5 PHE HB3 H -6.174 -2.185 5.674 1.00 . A A . 5 PHE HB3 1 1
16 2938 1 1 5 PHE HD1 H -5.142 -4.770 3.222 1.00 . A A . 5 PHE HD1 1 1
16 2939 1 1 5 PHE HD2 H -8.424 -2.529 4.854 1.00 . A A . 5 PHE HD2 1 1
16 2940 1 1 5 PHE HE1 H -6.751 -6.283 2.054 1.00 . A A . 5 PHE HE1 1 1
16 2941 1 1 5 PHE HE2 H -10.036 -4.024 3.689 1.00 . A A . 5 PHE HE2 1 1
16 2942 1 1 5 PHE HZ H -9.200 -5.909 2.297 1.00 . A A . 5 PHE HZ 1 1
16 2943 1 1 5 PHE N N -4.081 -0.888 4.694 1.00 . A A . 5 PHE N 1 1
16 2944 1 1 5 PHE O O -6.310 -0.722 2.082 1.00 . A A . 5 PHE O 1 1
16 2945 1 1 6 GLY C C -6.691 2.386 3.033 1.00 . A A . 6 GLY C 1 1
16 2946 1 1 6 GLY CA C -7.529 1.256 3.636 1.00 . A A . 6 GLY CA 1 1
16 2947 1 1 6 GLY H H -6.397 0.176 5.078 1.00 . A A . 6 GLY H 1 1
16 2948 1 1 6 GLY HA2 H -8.232 0.884 2.889 1.00 . A A . 6 GLY HA2 1 1
16 2949 1 1 6 GLY HA3 H -8.098 1.645 4.481 1.00 . A A . 6 GLY HA3 1 1
16 2950 1 1 6 GLY N N -6.673 0.179 4.109 1.00 . A A . 6 GLY N 1 1
16 2951 1 1 6 GLY O O -6.686 3.499 3.554 1.00 . A A . 6 GLY O 1 1
16 2952 1 1 7 GLY C C -4.266 2.401 0.183 1.00 . A A . 7 GLY C 1 1
16 2953 1 1 7 GLY CA C -5.091 3.057 1.290 1.00 . A A . 7 GLY CA 1 1
16 2954 1 1 7 GLY H H -5.978 1.139 1.623 1.00 . A A . 7 GLY H 1 1
16 2955 1 1 7 GLY HA2 H -5.688 3.865 0.863 1.00 . A A . 7 GLY HA2 1 1
16 2956 1 1 7 GLY HA3 H -4.406 3.476 2.027 1.00 . A A . 7 GLY HA3 1 1
16 2957 1 1 7 GLY N N -5.976 2.101 1.942 1.00 . A A . 7 GLY N 1 1
16 2958 1 1 7 GLY O O -4.058 2.994 -0.871 1.00 . A A . 7 GLY O 1 1
16 2959 1 1 8 CYS C C -3.667 0.311 -1.870 1.00 . A A . 8 CYS C 1 1
16 2960 1 1 8 CYS CA C -2.977 0.415 -0.509 1.00 . A A . 8 CYS CA 1 1
16 2961 1 1 8 CYS CB C -2.684 -0.977 0.059 1.00 . A A . 8 CYS CB 1 1
16 2962 1 1 8 CYS H H -3.987 0.757 1.322 1.00 . A A . 8 CYS H 1 1
16 2963 1 1 8 CYS HA H -2.024 0.931 -0.637 1.00 . A A . 8 CYS HA 1 1
16 2964 1 1 8 CYS HB3 H -3.582 -1.388 0.520 1.00 . A A . 8 CYS HB3 1 1
16 2965 1 1 8 CYS N N -3.785 1.179 0.427 1.00 . A A . 8 CYS N 1 1
16 2966 1 1 8 CYS O O -4.825 -0.093 -1.958 1.00 . A A . 8 CYS O 1 1
16 2967 1 1 8 CYS SG S -2.169 -2.146 -1.218 1.00 . A A . 8 CYS SG 1 1
16 2968 1 1 9 HIS C C -2.136 -0.091 -5.026 1.00 . A A . 9 HIS C 1 1
16 2969 1 1 9 HIS CA C -3.339 0.542 -4.320 1.00 . A A . 9 HIS CA 1 1
16 2970 1 1 9 HIS CB C -3.676 1.925 -4.900 1.00 . A A . 9 HIS CB 1 1
16 2971 1 1 9 HIS CD2 C -5.295 3.885 -4.552 1.00 . A A . 9 HIS CD2 1 1
16 2972 1 1 9 HIS CE1 C -6.701 2.995 -3.124 1.00 . A A . 9 HIS CE1 1 1
16 2973 1 1 9 HIS CG C -4.885 2.603 -4.297 1.00 . A A . 9 HIS CG 1 1
16 2974 1 1 9 HIS H H -1.990 0.967 -2.810 1.00 . A A . 9 HIS H 1 1
16 2975 1 1 9 HIS HA H -4.195 -0.128 -4.426 1.00 . A A . 9 HIS HA 1 1
16 2976 1 1 9 HIS HB3 H -3.865 1.823 -5.966 1.00 . A A . 9 HIS HB3 1 1
16 2977 1 1 9 HIS HD1 H -5.728 1.135 -2.986 1.00 . A A . 9 HIS HD1 1 1
16 2978 1 1 9 HIS HD2 H -4.811 4.588 -5.213 1.00 . A A . 9 HIS HD2 1 1
16 2979 1 1 9 HIS HE1 H -7.523 2.861 -2.437 1.00 . A A . 9 HIS HE1 1 1
16 2980 1 1 9 HIS N N -2.954 0.695 -2.931 1.00 . A A . 9 HIS N 1 1
16 2981 1 1 9 HIS ND1 N -5.783 2.056 -3.407 1.00 . A A . 9 HIS ND1 1 1
16 2982 1 1 9 HIS NE2 N -6.453 4.125 -3.807 1.00 . A A . 9 HIS NE2 1 1
16 2983 1 1 9 HIS O O -1.162 -0.445 -4.364 1.00 . A A . 9 HIS O 1 1
16 2984 1 1 10 GLU C C 0.276 -0.239 -6.818 1.00 . A A . 10 GLU C 1 1
16 2985 1 1 10 GLU CA C -1.115 -0.782 -7.172 1.00 . A A . 10 GLU CA 1 1
16 2986 1 1 10 GLU CB C -1.460 -0.530 -8.648 1.00 . A A . 10 GLU CB 1 1
16 2987 1 1 10 GLU CD C -0.870 -0.881 -11.062 1.00 . A A . 10 GLU CD 1 1
16 2988 1 1 10 GLU CG C -0.494 -1.209 -9.625 1.00 . A A . 10 GLU CG 1 1
16 2989 1 1 10 GLU H H -3.007 0.113 -6.836 1.00 . A A . 10 GLU H 1 1
16 2990 1 1 10 GLU HA H -1.101 -1.853 -6.976 1.00 . A A . 10 GLU HA 1 1
16 2991 1 1 10 GLU HB3 H -1.450 0.543 -8.848 1.00 . A A . 10 GLU HB3 1 1
16 2992 1 1 10 GLU HG3 H -0.522 -2.289 -9.482 1.00 . A A . 10 GLU HG3 1 1
16 2993 1 1 10 GLU N N -2.174 -0.193 -6.357 1.00 . A A . 10 GLU N 1 1
16 2994 1 1 10 GLU O O 1.247 -0.988 -6.745 1.00 . A A . 10 GLU O 1 1
16 2995 1 1 10 GLU OE1 O -0.823 0.324 -11.390 1.00 . A A . 10 GLU OE1 1 1
16 2996 1 1 10 GLU OE2 O -1.217 -1.832 -11.793 1.00 . A A . 10 GLU OE2 1 1
16 2997 1 1 11 LEU C C 2.269 1.285 -5.009 1.00 . A A . 11 LEU C 1 1
16 2998 1 1 11 LEU CA C 1.634 1.746 -6.326 1.00 . A A . 11 LEU CA 1 1
16 2999 1 1 11 LEU CB C 1.362 3.257 -6.294 1.00 . A A . 11 LEU CB 1 1
16 3000 1 1 11 LEU CD1 C 0.198 3.388 -8.574 1.00 . A A . 11 LEU CD1 1 1
16 3001 1 1 11 LEU CD2 C 1.158 5.433 -7.506 1.00 . A A . 11 LEU CD2 1 1
16 3002 1 1 11 LEU CG C 1.326 3.919 -7.683 1.00 . A A . 11 LEU CG 1 1
16 3003 1 1 11 LEU H H -0.452 1.644 -6.590 1.00 . A A . 11 LEU H 1 1
16 3004 1 1 11 LEU HA H 2.339 1.526 -7.130 1.00 . A A . 11 LEU HA 1 1
16 3005 1 1 11 LEU HB3 H 2.167 3.717 -5.733 1.00 . A A . 11 LEU HB3 1 1
16 3006 1 1 11 LEU HD11 H -0.758 3.454 -8.056 1.00 . A A . 11 LEU HD11 1 1
16 3007 1 1 11 LEU HD12 H 0.146 3.977 -9.490 1.00 . A A . 11 LEU HD12 1 1
16 3008 1 1 11 LEU HD13 H 0.393 2.353 -8.855 1.00 . A A . 11 LEU HD13 1 1
16 3009 1 1 11 LEU HD21 H 0.208 5.648 -7.015 1.00 . A A . 11 LEU HD21 1 1
16 3010 1 1 11 LEU HD22 H 1.973 5.829 -6.900 1.00 . A A . 11 LEU HD22 1 1
16 3011 1 1 11 LEU HD23 H 1.175 5.923 -8.479 1.00 . A A . 11 LEU HD23 1 1
16 3012 1 1 11 LEU HG H 2.278 3.741 -8.185 1.00 . A A . 11 LEU HG 1 1
16 3013 1 1 11 LEU N N 0.376 1.071 -6.584 1.00 . A A . 11 LEU N 1 1
16 3014 1 1 11 LEU O O 3.464 1.483 -4.791 1.00 . A A . 11 LEU O 1 1
16 3015 1 1 12 CYS C C 2.751 -0.905 -2.769 1.00 . A A . 12 CYS C 1 1
16 3016 1 1 12 CYS CA C 1.954 0.397 -2.763 1.00 . A A . 12 CYS CA 1 1
16 3017 1 1 12 CYS CB C 0.806 0.307 -1.767 1.00 . A A . 12 CYS CB 1 1
16 3018 1 1 12 CYS H H 0.542 0.433 -4.358 1.00 . A A . 12 CYS H 1 1
16 3019 1 1 12 CYS HA H 2.600 1.209 -2.423 1.00 . A A . 12 CYS HA 1 1
16 3020 1 1 12 CYS HB3 H 0.218 -0.590 -1.957 1.00 . A A . 12 CYS HB3 1 1
16 3021 1 1 12 CYS N N 1.478 0.715 -4.097 1.00 . A A . 12 CYS N 1 1
16 3022 1 1 12 CYS O O 2.195 -1.980 -2.571 1.00 . A A . 12 CYS O 1 1
16 3023 1 1 12 CYS SG S 1.506 0.226 -0.112 1.00 . A A . 12 CYS SG 1 1
16 3024 1 1 13 TYR C C 4.764 -3.030 -2.131 1.00 . A A . 13 TYR C 1 1
16 3025 1 1 13 TYR CA C 4.978 -1.919 -3.163 1.00 . A A . 13 TYR CA 1 1
16 3026 1 1 13 TYR CB C 6.416 -1.396 -3.074 1.00 . A A . 13 TYR CB 1 1
16 3027 1 1 13 TYR CD1 C 8.023 -3.356 -3.154 1.00 . A A . 13 TYR CD1 1 1
16 3028 1 1 13 TYR CD2 C 7.747 -1.981 -5.145 1.00 . A A . 13 TYR CD2 1 1
16 3029 1 1 13 TYR CE1 C 8.945 -4.164 -3.843 1.00 . A A . 13 TYR CE1 1 1
16 3030 1 1 13 TYR CE2 C 8.669 -2.790 -5.833 1.00 . A A . 13 TYR CE2 1 1
16 3031 1 1 13 TYR CG C 7.429 -2.257 -3.801 1.00 . A A . 13 TYR CG 1 1
16 3032 1 1 13 TYR CZ C 9.266 -3.882 -5.181 1.00 . A A . 13 TYR CZ 1 1
16 3033 1 1 13 TYR H H 4.403 0.128 -3.212 1.00 . A A . 13 TYR H 1 1
16 3034 1 1 13 TYR HA H 4.808 -2.327 -4.161 1.00 . A A . 13 TYR HA 1 1
16 3035 1 1 13 TYR HB3 H 6.715 -1.300 -2.028 1.00 . A A . 13 TYR HB3 1 1
16 3036 1 1 13 TYR HD1 H 7.769 -3.590 -2.131 1.00 . A A . 13 TYR HD1 1 1
16 3037 1 1 13 TYR HD2 H 7.280 -1.151 -5.654 1.00 . A A . 13 TYR HD2 1 1
16 3038 1 1 13 TYR HE1 H 9.397 -5.011 -3.349 1.00 . A A . 13 TYR HE1 1 1
16 3039 1 1 13 TYR HE2 H 8.906 -2.566 -6.862 1.00 . A A . 13 TYR HE2 1 1
16 3040 1 1 13 TYR HH H 10.299 -4.397 -6.752 1.00 . A A . 13 TYR HH 1 1
16 3041 1 1 13 TYR N N 4.061 -0.797 -2.991 1.00 . A A . 13 TYR N 1 1
16 3042 1 1 13 TYR O O 4.724 -4.210 -2.470 1.00 . A A . 13 TYR O 1 1
16 3043 1 1 13 TYR OH O 10.162 -4.669 -5.841 1.00 . A A . 13 TYR OH 1 1
16 3044 1 1 14 CYS C C 3.184 -3.978 0.571 1.00 . A A . 14 CYS C 1 1
16 3045 1 1 14 CYS CA C 4.624 -3.556 0.273 1.00 . A A . 14 CYS CA 1 1
16 3046 1 1 14 CYS CB C 5.284 -2.914 1.496 1.00 . A A . 14 CYS CB 1 1
16 3047 1 1 14 CYS H H 4.707 -1.632 -0.694 1.00 . A A . 14 CYS H 1 1
16 3048 1 1 14 CYS HA H 5.190 -4.459 0.038 1.00 . A A . 14 CYS HA 1 1
16 3049 1 1 14 CYS HB3 H 6.342 -2.806 1.273 1.00 . A A . 14 CYS HB3 1 1
16 3050 1 1 14 CYS N N 4.691 -2.633 -0.860 1.00 . A A . 14 CYS N 1 1
16 3051 1 1 14 CYS O O 2.907 -5.163 0.713 1.00 . A A . 14 CYS O 1 1
16 3052 1 1 14 CYS SG S 4.673 -1.278 1.941 1.00 . A A . 14 CYS SG 1 1
16 3053 1 1 15 CYS C C 0.473 -3.760 2.220 1.00 . A A . 15 CYS C 1 1
16 3054 1 1 15 CYS CA C 0.862 -3.062 0.910 1.00 . A A . 15 CYS CA 1 1
16 3055 1 1 15 CYS CB C 0.202 -3.776 -0.269 1.00 . A A . 15 CYS CB 1 1
16 3056 1 1 15 CYS H H 2.694 -2.080 0.479 1.00 . A A . 15 CYS H 1 1
16 3057 1 1 15 CYS HA H 0.501 -2.033 0.981 1.00 . A A . 15 CYS HA 1 1
16 3058 1 1 15 CYS HB3 H 0.574 -4.798 -0.291 1.00 . A A . 15 CYS HB3 1 1
16 3059 1 1 15 CYS N N 2.301 -2.984 0.667 1.00 . A A . 15 CYS N 1 1
16 3060 1 1 15 CYS O O 0.566 -4.979 2.336 1.00 . A A . 15 CYS O 1 1
16 3061 1 1 15 CYS SG S -1.598 -3.862 -0.196 1.00 . A A . 15 CYS SG 1 1
16 3062 1 1 16 ASP C C -1.726 -4.555 4.055 1.00 . A A . 16 ASP C 1 1
16 3063 1 1 16 ASP CA C -0.587 -3.598 4.416 1.00 . A A . 16 ASP CA 1 1
16 3064 1 1 16 ASP CB C -1.095 -2.484 5.333 1.00 . A A . 16 ASP CB 1 1
16 3065 1 1 16 ASP CG C -2.027 -2.995 6.422 1.00 . A A . 16 ASP CG 1 1
16 3066 1 1 16 ASP H H -0.126 -1.999 3.089 1.00 . A A . 16 ASP H 1 1
16 3067 1 1 16 ASP HA H 0.178 -4.168 4.945 1.00 . A A . 16 ASP HA 1 1
16 3068 1 1 16 ASP HB3 H -1.675 -1.813 4.712 1.00 . A A . 16 ASP HB3 1 1
16 3069 1 1 16 ASP N N -0.014 -3.002 3.211 1.00 . A A . 16 ASP N 1 1
16 3070 1 1 16 ASP O O -2.626 -4.196 3.291 1.00 . A A . 16 ASP O 1 1
16 3071 1 1 16 ASP OD1 O -1.812 -4.142 6.862 1.00 . A A . 16 ASP OD1 1 1
16 3072 1 1 16 ASP OD2 O -2.965 -2.236 6.753 1.00 . A A . 16 ASP OD2 1 1
17 3073 1 1 1 VAL C C 5.470 2.460 5.171 1.00 . A A . 1 VAL C 1 1
17 3074 1 1 1 VAL CA C 6.188 3.067 6.378 1.00 . A A . 1 VAL CA 1 1
17 3075 1 1 1 VAL CB C 5.213 3.775 7.336 1.00 . A A . 1 VAL CB 1 1
17 3076 1 1 1 VAL CG1 C 5.945 4.258 8.594 1.00 . A A . 1 VAL CG1 1 1
17 3077 1 1 1 VAL CG2 C 4.494 4.959 6.671 1.00 . A A . 1 VAL CG2 1 1
17 3078 1 1 1 VAL H1 H 7.152 4.165 4.897 1.00 . A A . 1 VAL H1 1 1
17 3079 1 1 1 VAL HA H 6.696 2.263 6.913 1.00 . A A . 1 VAL HA 1 1
17 3080 1 1 1 VAL HB H 4.455 3.055 7.651 1.00 . A A . 1 VAL HB 1 1
17 3081 1 1 1 VAL HG11 H 5.230 4.693 9.291 1.00 . A A . 1 VAL HG11 1 1
17 3082 1 1 1 VAL HG12 H 6.443 3.419 9.078 1.00 . A A . 1 VAL HG12 1 1
17 3083 1 1 1 VAL HG13 H 6.689 5.013 8.335 1.00 . A A . 1 VAL HG13 1 1
17 3084 1 1 1 VAL HG21 H 3.929 4.621 5.802 1.00 . A A . 1 VAL HG21 1 1
17 3085 1 1 1 VAL HG22 H 3.798 5.406 7.381 1.00 . A A . 1 VAL HG22 1 1
17 3086 1 1 1 VAL HG23 H 5.212 5.717 6.360 1.00 . A A . 1 VAL HG23 1 1
17 3087 1 1 1 VAL N N 7.197 3.993 5.896 1.00 . A A . 1 VAL N 1 1
17 3088 1 1 1 VAL O O 5.612 2.964 4.055 1.00 . A A . 1 VAL O 1 1
17 3089 1 1 2 CYS C C 2.552 1.557 4.269 1.00 . A A . 2 CYS C 1 1
17 3090 1 1 2 CYS CA C 3.874 0.795 4.350 1.00 . A A . 2 CYS CA 1 1
17 3091 1 1 2 CYS CB C 3.636 -0.687 4.647 1.00 . A A . 2 CYS CB 1 1
17 3092 1 1 2 CYS H H 4.599 1.050 6.332 1.00 . A A . 2 CYS H 1 1
17 3093 1 1 2 CYS HA H 4.382 0.892 3.388 1.00 . A A . 2 CYS HA 1 1
17 3094 1 1 2 CYS HB3 H 2.869 -0.781 5.413 1.00 . A A . 2 CYS HB3 1 1
17 3095 1 1 2 CYS N N 4.714 1.381 5.388 1.00 . A A . 2 CYS N 1 1
17 3096 1 1 2 CYS O O 2.251 2.345 5.164 1.00 . A A . 2 CYS O 1 1
17 3097 1 1 2 CYS SG S 3.075 -1.587 3.199 1.00 . A A . 2 CYS SG 1 1
17 3098 1 1 3 CYS C C -0.588 1.153 3.637 1.00 . A A . 3 CYS C 1 1
17 3099 1 1 3 CYS CA C 0.498 2.050 3.048 1.00 . A A . 3 CYS CA 1 1
17 3100 1 1 3 CYS CB C 0.225 2.386 1.574 1.00 . A A . 3 CYS CB 1 1
17 3101 1 1 3 CYS H H 1.918 0.575 2.577 1.00 . A A . 3 CYS H 1 1
17 3102 1 1 3 CYS HA H 0.565 3.000 3.576 1.00 . A A . 3 CYS HA 1 1
17 3103 1 1 3 CYS HB3 H -0.161 3.399 1.543 1.00 . A A . 3 CYS HB3 1 1
17 3104 1 1 3 CYS N N 1.752 1.340 3.220 1.00 . A A . 3 CYS N 1 1
17 3105 1 1 3 CYS O O -0.567 -0.045 3.343 1.00 . A A . 3 CYS O 1 1
17 3106 1 1 3 CYS SG S 1.606 2.304 0.407 1.00 . A A . 3 CYS SG 1 1
17 3107 1 1 4 PRO C C -3.438 0.226 4.269 1.00 . A A . 4 PRO C 1 1
17 3108 1 1 4 PRO CA C -2.466 0.915 5.221 1.00 . A A . 4 PRO CA 1 1
17 3109 1 1 4 PRO CB C -3.203 1.917 6.116 1.00 . A A . 4 PRO CB 1 1
17 3110 1 1 4 PRO CD C -1.663 3.113 4.741 1.00 . A A . 4 PRO CD 1 1
17 3111 1 1 4 PRO CG C -3.048 3.242 5.372 1.00 . A A . 4 PRO CG 1 1
17 3112 1 1 4 PRO HA H -1.962 0.181 5.851 1.00 . A A . 4 PRO HA 1 1
17 3113 1 1 4 PRO HB3 H -2.696 1.981 7.079 1.00 . A A . 4 PRO HB3 1 1
17 3114 1 1 4 PRO HD3 H -0.901 3.445 5.450 1.00 . A A . 4 PRO HD3 1 1
17 3115 1 1 4 PRO HG3 H -3.126 4.104 6.036 1.00 . A A . 4 PRO HG3 1 1
17 3116 1 1 4 PRO N N -1.487 1.694 4.478 1.00 . A A . 4 PRO N 1 1
17 3117 1 1 4 PRO O O -3.690 0.735 3.181 1.00 . A A . 4 PRO O 1 1
17 3118 1 1 5 PHE C C -6.059 -0.783 3.344 1.00 . A A . 5 PHE C 1 1
17 3119 1 1 5 PHE CA C -4.969 -1.682 3.926 1.00 . A A . 5 PHE CA 1 1
17 3120 1 1 5 PHE CB C -5.535 -2.762 4.854 1.00 . A A . 5 PHE CB 1 1
17 3121 1 1 5 PHE CD1 C -6.114 -4.693 3.349 1.00 . A A . 5 PHE CD1 1 1
17 3122 1 1 5 PHE CD2 C -7.927 -3.468 4.418 1.00 . A A . 5 PHE CD2 1 1
17 3123 1 1 5 PHE CE1 C -7.048 -5.548 2.740 1.00 . A A . 5 PHE CE1 1 1
17 3124 1 1 5 PHE CE2 C -8.863 -4.320 3.807 1.00 . A A . 5 PHE CE2 1 1
17 3125 1 1 5 PHE CG C -6.552 -3.665 4.200 1.00 . A A . 5 PHE CG 1 1
17 3126 1 1 5 PHE CZ C -8.423 -5.365 2.974 1.00 . A A . 5 PHE CZ 1 1
17 3127 1 1 5 PHE H H -3.689 -1.326 5.563 1.00 . A A . 5 PHE H 1 1
17 3128 1 1 5 PHE HA H -4.448 -2.152 3.092 1.00 . A A . 5 PHE HA 1 1
17 3129 1 1 5 PHE HB3 H -5.977 -2.293 5.733 1.00 . A A . 5 PHE HB3 1 1
17 3130 1 1 5 PHE HD1 H -5.054 -4.809 3.170 1.00 . A A . 5 PHE HD1 1 1
17 3131 1 1 5 PHE HD2 H -8.260 -2.660 5.053 1.00 . A A . 5 PHE HD2 1 1
17 3132 1 1 5 PHE HE1 H -6.707 -6.342 2.092 1.00 . A A . 5 PHE HE1 1 1
17 3133 1 1 5 PHE HE2 H -9.919 -4.173 3.977 1.00 . A A . 5 PHE HE2 1 1
17 3134 1 1 5 PHE HZ H -9.142 -6.023 2.505 1.00 . A A . 5 PHE HZ 1 1
17 3135 1 1 5 PHE N N -4.010 -0.904 4.690 1.00 . A A . 5 PHE N 1 1
17 3136 1 1 5 PHE O O -6.309 -0.795 2.140 1.00 . A A . 5 PHE O 1 1
17 3137 1 1 6 GLY C C -6.811 2.273 3.149 1.00 . A A . 6 GLY C 1 1
17 3138 1 1 6 GLY CA C -7.580 1.098 3.755 1.00 . A A . 6 GLY CA 1 1
17 3139 1 1 6 GLY H H -6.365 0.050 5.154 1.00 . A A . 6 GLY H 1 1
17 3140 1 1 6 GLY HA2 H -8.283 0.702 3.019 1.00 . A A . 6 GLY HA2 1 1
17 3141 1 1 6 GLY HA3 H -8.146 1.447 4.619 1.00 . A A . 6 GLY HA3 1 1
17 3142 1 1 6 GLY N N -6.663 0.056 4.190 1.00 . A A . 6 GLY N 1 1
17 3143 1 1 6 GLY O O -6.844 3.377 3.688 1.00 . A A . 6 GLY O 1 1
17 3144 1 1 7 GLY C C -4.479 2.461 0.231 1.00 . A A . 7 GLY C 1 1
17 3145 1 1 7 GLY CA C -5.295 3.051 1.380 1.00 . A A . 7 GLY CA 1 1
17 3146 1 1 7 GLY H H -6.083 1.086 1.693 1.00 . A A . 7 GLY H 1 1
17 3147 1 1 7 GLY HA2 H -5.941 3.841 0.995 1.00 . A A . 7 GLY HA2 1 1
17 3148 1 1 7 GLY HA3 H -4.603 3.482 2.104 1.00 . A A . 7 GLY HA3 1 1
17 3149 1 1 7 GLY N N -6.112 2.040 2.036 1.00 . A A . 7 GLY N 1 1
17 3150 1 1 7 GLY O O -4.344 3.085 -0.821 1.00 . A A . 7 GLY O 1 1
17 3151 1 1 8 CYS C C -3.811 0.458 -1.902 1.00 . A A . 8 CYS C 1 1
17 3152 1 1 8 CYS CA C -3.117 0.544 -0.539 1.00 . A A . 8 CYS CA 1 1
17 3153 1 1 8 CYS CB C -2.790 -0.853 0.001 1.00 . A A . 8 CYS CB 1 1
17 3154 1 1 8 CYS H H -4.075 0.822 1.330 1.00 . A A . 8 CYS H 1 1
17 3155 1 1 8 CYS HA H -2.178 1.085 -0.660 1.00 . A A . 8 CYS HA 1 1
17 3156 1 1 8 CYS HB3 H -3.679 -1.287 0.460 1.00 . A A . 8 CYS HB3 1 1
17 3157 1 1 8 CYS N N -3.928 1.263 0.433 1.00 . A A . 8 CYS N 1 1
17 3158 1 1 8 CYS O O -5.006 0.184 -1.984 1.00 . A A . 8 CYS O 1 1
17 3159 1 1 8 CYS SG S -2.258 -2.004 -1.284 1.00 . A A . 8 CYS SG 1 1
17 3160 1 1 9 HIS C C -2.189 -0.082 -5.035 1.00 . A A . 9 HIS C 1 1
17 3161 1 1 9 HIS CA C -3.419 0.534 -4.361 1.00 . A A . 9 HIS CA 1 1
17 3162 1 1 9 HIS CB C -3.782 1.897 -4.970 1.00 . A A . 9 HIS CB 1 1
17 3163 1 1 9 HIS CD2 C -6.245 2.469 -5.416 1.00 . A A . 9 HIS CD2 1 1
17 3164 1 1 9 HIS CE1 C -6.854 3.142 -3.421 1.00 . A A . 9 HIS CE1 1 1
17 3165 1 1 9 HIS CG C -5.156 2.387 -4.588 1.00 . A A . 9 HIS CG 1 1
17 3166 1 1 9 HIS H H -2.056 0.853 -2.846 1.00 . A A . 9 HIS H 1 1
17 3167 1 1 9 HIS HA H -4.256 -0.160 -4.461 1.00 . A A . 9 HIS HA 1 1
17 3168 1 1 9 HIS HB3 H -3.754 1.827 -6.056 1.00 . A A . 9 HIS HB3 1 1
17 3169 1 1 9 HIS HD1 H -4.986 2.850 -2.504 1.00 . A A . 9 HIS HD1 1 1
17 3170 1 1 9 HIS HD2 H -6.271 2.202 -6.463 1.00 . A A . 9 HIS HD2 1 1
17 3171 1 1 9 HIS HE1 H -7.447 3.501 -2.591 1.00 . A A . 9 HIS HE1 1 1
17 3172 1 1 9 HIS N N -3.049 0.713 -2.969 1.00 . A A . 9 HIS N 1 1
17 3173 1 1 9 HIS ND1 N -5.554 2.817 -3.342 1.00 . A A . 9 HIS ND1 1 1
17 3174 1 1 9 HIS NE2 N -7.320 2.955 -4.667 1.00 . A A . 9 HIS NE2 1 1
17 3175 1 1 9 HIS O O -1.210 -0.373 -4.350 1.00 . A A . 9 HIS O 1 1
17 3176 1 1 10 GLU C C 0.240 -0.229 -6.814 1.00 . A A . 10 GLU C 1 1
17 3177 1 1 10 GLU CA C -1.132 -0.830 -7.147 1.00 . A A . 10 GLU CA 1 1
17 3178 1 1 10 GLU CB C -1.479 -0.653 -8.633 1.00 . A A . 10 GLU CB 1 1
17 3179 1 1 10 GLU CD C -0.901 -1.149 -11.028 1.00 . A A . 10 GLU CD 1 1
17 3180 1 1 10 GLU CG C -0.508 -1.374 -9.574 1.00 . A A . 10 GLU CG 1 1
17 3181 1 1 10 GLU H H -3.057 0.006 -6.854 1.00 . A A . 10 GLU H 1 1
17 3182 1 1 10 GLU HA H -1.086 -1.891 -6.907 1.00 . A A . 10 GLU HA 1 1
17 3183 1 1 10 GLU HB3 H -1.477 0.410 -8.887 1.00 . A A . 10 GLU HB3 1 1
17 3184 1 1 10 GLU HG3 H -0.515 -2.444 -9.363 1.00 . A A . 10 GLU HG3 1 1
17 3185 1 1 10 GLU N N -2.216 -0.245 -6.360 1.00 . A A . 10 GLU N 1 1
17 3186 1 1 10 GLU O O 1.236 -0.942 -6.726 1.00 . A A . 10 GLU O 1 1
17 3187 1 1 10 GLU OE1 O -0.933 0.037 -11.420 1.00 . A A . 10 GLU OE1 1 1
17 3188 1 1 10 GLU OE2 O -1.179 -2.159 -11.708 1.00 . A A . 10 GLU OE2 1 1
17 3189 1 1 11 LEU C C 2.194 1.357 -5.040 1.00 . A A . 11 LEU C 1 1
17 3190 1 1 11 LEU CA C 1.530 1.809 -6.346 1.00 . A A . 11 LEU CA 1 1
17 3191 1 1 11 LEU CB C 1.189 3.301 -6.285 1.00 . A A . 11 LEU CB 1 1
17 3192 1 1 11 LEU CD1 C 0.172 5.204 -7.562 1.00 . A A . 11 LEU CD1 1 1
17 3193 1 1 11 LEU CD2 C 2.309 4.200 -8.376 1.00 . A A . 11 LEU CD2 1 1
17 3194 1 1 11 LEU CG C 0.973 3.902 -7.681 1.00 . A A . 11 LEU CG 1 1
17 3195 1 1 11 LEU H H -0.548 1.636 -6.622 1.00 . A A . 11 LEU H 1 1
17 3196 1 1 11 LEU HA H 2.225 1.627 -7.164 1.00 . A A . 11 LEU HA 1 1
17 3197 1 1 11 LEU HB3 H 1.996 3.828 -5.791 1.00 . A A . 11 LEU HB3 1 1
17 3198 1 1 11 LEU HD11 H -0.802 5.001 -7.117 1.00 . A A . 11 LEU HD11 1 1
17 3199 1 1 11 LEU HD12 H 0.709 5.917 -6.937 1.00 . A A . 11 LEU HD12 1 1
17 3200 1 1 11 LEU HD13 H 0.021 5.638 -8.551 1.00 . A A . 11 LEU HD13 1 1
17 3201 1 1 11 LEU HD21 H 2.895 4.901 -7.780 1.00 . A A . 11 LEU HD21 1 1
17 3202 1 1 11 LEU HD22 H 2.885 3.286 -8.516 1.00 . A A . 11 LEU HD22 1 1
17 3203 1 1 11 LEU HD23 H 2.121 4.642 -9.355 1.00 . A A . 11 LEU HD23 1 1
17 3204 1 1 11 LEU HG H 0.410 3.197 -8.293 1.00 . A A . 11 LEU HG 1 1
17 3205 1 1 11 LEU N N 0.297 1.090 -6.611 1.00 . A A . 11 LEU N 1 1
17 3206 1 1 11 LEU O O 3.394 1.553 -4.850 1.00 . A A . 11 LEU O 1 1
17 3207 1 1 12 CYS C C 2.699 -0.837 -2.818 1.00 . A A . 12 CYS C 1 1
17 3208 1 1 12 CYS CA C 1.914 0.473 -2.789 1.00 . A A . 12 CYS CA 1 1
17 3209 1 1 12 CYS CB C 0.782 0.387 -1.773 1.00 . A A . 12 CYS CB 1 1
17 3210 1 1 12 CYS H H 0.475 0.523 -4.356 1.00 . A A . 12 CYS H 1 1
17 3211 1 1 12 CYS HA H 2.573 1.278 -2.458 1.00 . A A . 12 CYS HA 1 1
17 3212 1 1 12 CYS HB3 H 0.189 -0.508 -1.951 1.00 . A A . 12 CYS HB3 1 1
17 3213 1 1 12 CYS N N 1.416 0.799 -4.110 1.00 . A A . 12 CYS N 1 1
17 3214 1 1 12 CYS O O 2.134 -1.908 -2.619 1.00 . A A . 12 CYS O 1 1
17 3215 1 1 12 CYS SG S 1.511 0.307 -0.132 1.00 . A A . 12 CYS SG 1 1
17 3216 1 1 13 TYR C C 4.686 -2.986 -2.220 1.00 . A A . 13 TYR C 1 1
17 3217 1 1 13 TYR CA C 4.917 -1.865 -3.235 1.00 . A A . 13 TYR CA 1 1
17 3218 1 1 13 TYR CB C 6.356 -1.350 -3.115 1.00 . A A . 13 TYR CB 1 1
17 3219 1 1 13 TYR CD1 C 7.972 -3.301 -3.017 1.00 . A A . 13 TYR CD1 1 1
17 3220 1 1 13 TYR CD2 C 7.735 -2.076 -5.107 1.00 . A A . 13 TYR CD2 1 1
17 3221 1 1 13 TYR CE1 C 8.911 -4.154 -3.623 1.00 . A A . 13 TYR CE1 1 1
17 3222 1 1 13 TYR CE2 C 8.677 -2.927 -5.711 1.00 . A A . 13 TYR CE2 1 1
17 3223 1 1 13 TYR CG C 7.388 -2.255 -3.755 1.00 . A A . 13 TYR CG 1 1
17 3224 1 1 13 TYR CZ C 9.262 -3.966 -4.972 1.00 . A A . 13 TYR CZ 1 1
17 3225 1 1 13 TYR H H 4.354 0.185 -3.273 1.00 . A A . 13 TYR H 1 1
17 3226 1 1 13 TYR HA H 4.760 -2.258 -4.242 1.00 . A A . 13 TYR HA 1 1
17 3227 1 1 13 TYR HB3 H 6.613 -1.205 -2.064 1.00 . A A . 13 TYR HB3 1 1
17 3228 1 1 13 TYR HD1 H 7.695 -3.460 -1.984 1.00 . A A . 13 TYR HD1 1 1
17 3229 1 1 13 TYR HD2 H 7.276 -1.288 -5.687 1.00 . A A . 13 TYR HD2 1 1
17 3230 1 1 13 TYR HE1 H 9.349 -4.956 -3.049 1.00 . A A . 13 TYR HE1 1 1
17 3231 1 1 13 TYR HE2 H 8.943 -2.788 -6.749 1.00 . A A . 13 TYR HE2 1 1
17 3232 1 1 13 TYR HH H 10.499 -5.473 -4.979 1.00 . A A . 13 TYR HH 1 1
17 3233 1 1 13 TYR N N 4.006 -0.738 -3.055 1.00 . A A . 13 TYR N 1 1
17 3234 1 1 13 TYR O O 4.627 -4.161 -2.574 1.00 . A A . 13 TYR O 1 1
17 3235 1 1 13 TYR OH O 10.174 -4.787 -5.565 1.00 . A A . 13 TYR OH 1 1
17 3236 1 1 14 CYS C C 3.097 -3.935 0.473 1.00 . A A . 14 CYS C 1 1
17 3237 1 1 14 CYS CA C 4.542 -3.535 0.178 1.00 . A A . 14 CYS CA 1 1
17 3238 1 1 14 CYS CB C 5.215 -2.916 1.406 1.00 . A A . 14 CYS CB 1 1
17 3239 1 1 14 CYS H H 4.658 -1.602 -0.772 1.00 . A A . 14 CYS H 1 1
17 3240 1 1 14 CYS HA H 5.093 -4.444 -0.067 1.00 . A A . 14 CYS HA 1 1
17 3241 1 1 14 CYS HB3 H 6.275 -2.825 1.182 1.00 . A A . 14 CYS HB3 1 1
17 3242 1 1 14 CYS N N 4.623 -2.602 -0.945 1.00 . A A . 14 CYS N 1 1
17 3243 1 1 14 CYS O O 2.800 -5.118 0.601 1.00 . A A . 14 CYS O 1 1
17 3244 1 1 14 CYS SG S 4.637 -1.272 1.864 1.00 . A A . 14 CYS SG 1 1
17 3245 1 1 15 CYS C C 0.414 -3.704 2.138 1.00 . A A . 15 CYS C 1 1
17 3246 1 1 15 CYS CA C 0.791 -2.987 0.836 1.00 . A A . 15 CYS CA 1 1
17 3247 1 1 15 CYS CB C 0.107 -3.665 -0.350 1.00 . A A . 15 CYS CB 1 1
17 3248 1 1 15 CYS H H 2.637 -2.029 0.404 1.00 . A A . 15 CYS H 1 1
17 3249 1 1 15 CYS HA H 0.447 -1.953 0.932 1.00 . A A . 15 CYS HA 1 1
17 3250 1 1 15 CYS HB3 H 0.463 -4.691 -0.396 1.00 . A A . 15 CYS HB3 1 1
17 3251 1 1 15 CYS N N 2.230 -2.927 0.581 1.00 . A A . 15 CYS N 1 1
17 3252 1 1 15 CYS O O 0.470 -4.929 2.222 1.00 . A A . 15 CYS O 1 1
17 3253 1 1 15 CYS SG S -1.694 -3.728 -0.268 1.00 . A A . 15 CYS SG 1 1
17 3254 1 1 16 ASP C C -1.703 -4.502 4.066 1.00 . A A . 16 ASP C 1 1
17 3255 1 1 16 ASP CA C -0.538 -3.559 4.386 1.00 . A A . 16 ASP CA 1 1
17 3256 1 1 16 ASP CB C -0.991 -2.451 5.339 1.00 . A A . 16 ASP CB 1 1
17 3257 1 1 16 ASP CG C -1.913 -2.960 6.435 1.00 . A A . 16 ASP CG 1 1
17 3258 1 1 16 ASP H H -0.104 -1.947 3.064 1.00 . A A . 16 ASP H 1 1
17 3259 1 1 16 ASP HA H 0.242 -4.145 4.872 1.00 . A A . 16 ASP HA 1 1
17 3260 1 1 16 ASP HB3 H -1.566 -1.749 4.748 1.00 . A A . 16 ASP HB3 1 1
17 3261 1 1 16 ASP N N -0.012 -2.954 3.163 1.00 . A A . 16 ASP N 1 1
17 3262 1 1 16 ASP O O -2.604 -4.146 3.304 1.00 . A A . 16 ASP O 1 1
17 3263 1 1 16 ASP OD1 O -1.684 -4.102 6.885 1.00 . A A . 16 ASP OD1 1 1
17 3264 1 1 16 ASP OD2 O -2.861 -2.210 6.759 1.00 . A A . 16 ASP OD2 1 1
18 3265 1 1 1 VAL C C 5.165 2.697 5.262 1.00 . A A . 1 VAL C 1 1
18 3266 1 1 1 VAL CA C 5.916 3.268 6.469 1.00 . A A . 1 VAL CA 1 1
18 3267 1 1 1 VAL CB C 4.981 3.967 7.477 1.00 . A A . 1 VAL CB 1 1
18 3268 1 1 1 VAL CG1 C 4.055 2.979 8.202 1.00 . A A . 1 VAL CG1 1 1
18 3269 1 1 1 VAL CG2 C 5.787 4.728 8.540 1.00 . A A . 1 VAL CG2 1 1
18 3270 1 1 1 VAL H1 H 6.780 4.418 4.966 1.00 . A A . 1 VAL H1 1 1
18 3271 1 1 1 VAL HA H 6.460 2.465 6.969 1.00 . A A . 1 VAL HA 1 1
18 3272 1 1 1 VAL HB H 4.357 4.676 6.935 1.00 . A A . 1 VAL HB 1 1
18 3273 1 1 1 VAL HG11 H 4.639 2.175 8.653 1.00 . A A . 1 VAL HG11 1 1
18 3274 1 1 1 VAL HG12 H 3.507 3.499 8.988 1.00 . A A . 1 VAL HG12 1 1
18 3275 1 1 1 VAL HG13 H 3.322 2.560 7.515 1.00 . A A . 1 VAL HG13 1 1
18 3276 1 1 1 VAL HG21 H 5.112 5.178 9.268 1.00 . A A . 1 VAL HG21 1 1
18 3277 1 1 1 VAL HG22 H 6.461 4.043 9.057 1.00 . A A . 1 VAL HG22 1 1
18 3278 1 1 1 VAL HG23 H 6.371 5.527 8.083 1.00 . A A . 1 VAL HG23 1 1
18 3279 1 1 1 VAL N N 6.892 4.210 5.952 1.00 . A A . 1 VAL N 1 1
18 3280 1 1 1 VAL O O 5.218 3.275 4.175 1.00 . A A . 1 VAL O 1 1
18 3281 1 1 2 CYS C C 2.389 1.700 4.213 1.00 . A A . 2 CYS C 1 1
18 3282 1 1 2 CYS CA C 3.707 0.943 4.377 1.00 . A A . 2 CYS CA 1 1
18 3283 1 1 2 CYS CB C 3.455 -0.533 4.694 1.00 . A A . 2 CYS CB 1 1
18 3284 1 1 2 CYS H H 4.451 1.169 6.365 1.00 . A A . 2 CYS H 1 1
18 3285 1 1 2 CYS HA H 4.265 1.021 3.442 1.00 . A A . 2 CYS HA 1 1
18 3286 1 1 2 CYS HB3 H 2.649 -0.610 5.420 1.00 . A A . 2 CYS HB3 1 1
18 3287 1 1 2 CYS N N 4.505 1.551 5.436 1.00 . A A . 2 CYS N 1 1
18 3288 1 1 2 CYS O O 2.027 2.492 5.081 1.00 . A A . 2 CYS O 1 1
18 3289 1 1 2 CYS SG S 2.973 -1.466 3.238 1.00 . A A . 2 CYS SG 1 1
18 3290 1 1 3 CYS C C -0.691 1.320 3.495 1.00 . A A . 3 CYS C 1 1
18 3291 1 1 3 CYS CA C 0.410 2.173 2.872 1.00 . A A . 3 CYS CA 1 1
18 3292 1 1 3 CYS CB C 0.162 2.416 1.376 1.00 . A A . 3 CYS CB 1 1
18 3293 1 1 3 CYS H H 1.865 0.690 2.507 1.00 . A A . 3 CYS H 1 1
18 3294 1 1 3 CYS HA H 0.480 3.156 3.338 1.00 . A A . 3 CYS HA 1 1
18 3295 1 1 3 CYS HB3 H -0.327 3.379 1.293 1.00 . A A . 3 CYS HB3 1 1
18 3296 1 1 3 CYS N N 1.657 1.468 3.118 1.00 . A A . 3 CYS N 1 1
18 3297 1 1 3 CYS O O -0.696 0.114 3.234 1.00 . A A . 3 CYS O 1 1
18 3298 1 1 3 CYS SG S 1.600 2.450 0.280 1.00 . A A . 3 CYS SG 1 1
18 3299 1 1 4 PRO C C -3.551 0.447 4.251 1.00 . A A . 4 PRO C 1 1
18 3300 1 1 4 PRO CA C -2.532 1.161 5.133 1.00 . A A . 4 PRO CA 1 1
18 3301 1 1 4 PRO CB C -3.220 2.200 6.024 1.00 . A A . 4 PRO CB 1 1
18 3302 1 1 4 PRO CD C -1.708 3.329 4.563 1.00 . A A . 4 PRO CD 1 1
18 3303 1 1 4 PRO CG C -3.068 3.501 5.238 1.00 . A A . 4 PRO CG 1 1
18 3304 1 1 4 PRO HA H -2.010 0.439 5.763 1.00 . A A . 4 PRO HA 1 1
18 3305 1 1 4 PRO HB3 H -2.679 2.282 6.967 1.00 . A A . 4 PRO HB3 1 1
18 3306 1 1 4 PRO HD3 H -0.917 3.664 5.237 1.00 . A A . 4 PRO HD3 1 1
18 3307 1 1 4 PRO HG3 H -3.106 4.383 5.879 1.00 . A A . 4 PRO HG3 1 1
18 3308 1 1 4 PRO N N -1.570 1.901 4.330 1.00 . A A . 4 PRO N 1 1
18 3309 1 1 4 PRO O O -3.780 0.861 3.119 1.00 . A A . 4 PRO O 1 1
18 3310 1 1 5 PHE C C -6.158 -0.597 3.328 1.00 . A A . 5 PHE C 1 1
18 3311 1 1 5 PHE CA C -5.124 -1.450 4.063 1.00 . A A . 5 PHE CA 1 1
18 3312 1 1 5 PHE CB C -5.780 -2.438 5.044 1.00 . A A . 5 PHE CB 1 1
18 3313 1 1 5 PHE CD1 C -7.358 -3.795 3.592 1.00 . A A . 5 PHE CD1 1 1
18 3314 1 1 5 PHE CD2 C -5.493 -4.924 4.680 1.00 . A A . 5 PHE CD2 1 1
18 3315 1 1 5 PHE CE1 C -7.767 -5.018 3.030 1.00 . A A . 5 PHE CE1 1 1
18 3316 1 1 5 PHE CE2 C -5.903 -6.144 4.117 1.00 . A A . 5 PHE CE2 1 1
18 3317 1 1 5 PHE CG C -6.221 -3.747 4.421 1.00 . A A . 5 PHE CG 1 1
18 3318 1 1 5 PHE CZ C -7.041 -6.193 3.293 1.00 . A A . 5 PHE CZ 1 1
18 3319 1 1 5 PHE H H -3.831 -0.949 5.683 1.00 . A A . 5 PHE H 1 1
18 3320 1 1 5 PHE HA H -4.558 -2.010 3.320 1.00 . A A . 5 PHE HA 1 1
18 3321 1 1 5 PHE HB3 H -6.634 -1.972 5.534 1.00 . A A . 5 PHE HB3 1 1
18 3322 1 1 5 PHE HD1 H -7.917 -2.898 3.375 1.00 . A A . 5 PHE HD1 1 1
18 3323 1 1 5 PHE HD2 H -4.615 -4.897 5.313 1.00 . A A . 5 PHE HD2 1 1
18 3324 1 1 5 PHE HE1 H -8.634 -5.051 2.386 1.00 . A A . 5 PHE HE1 1 1
18 3325 1 1 5 PHE HE2 H -5.337 -7.043 4.315 1.00 . A A . 5 PHE HE2 1 1
18 3326 1 1 5 PHE HZ H -7.351 -7.130 2.857 1.00 . A A . 5 PHE HZ 1 1
18 3327 1 1 5 PHE N N -4.178 -0.606 4.783 1.00 . A A . 5 PHE N 1 1
18 3328 1 1 5 PHE O O -6.323 -0.703 2.114 1.00 . A A . 5 PHE O 1 1
18 3329 1 1 6 GLY C C -6.933 2.443 2.870 1.00 . A A . 6 GLY C 1 1
18 3330 1 1 6 GLY CA C -7.724 1.287 3.481 1.00 . A A . 6 GLY CA 1 1
18 3331 1 1 6 GLY H H -6.592 0.380 5.039 1.00 . A A . 6 GLY H 1 1
18 3332 1 1 6 GLY HA2 H -8.351 0.828 2.716 1.00 . A A . 6 GLY HA2 1 1
18 3333 1 1 6 GLY HA3 H -8.371 1.672 4.271 1.00 . A A . 6 GLY HA3 1 1
18 3334 1 1 6 GLY N N -6.822 0.302 4.059 1.00 . A A . 6 GLY N 1 1
18 3335 1 1 6 GLY O O -7.070 3.584 3.302 1.00 . A A . 6 GLY O 1 1
18 3336 1 1 7 GLY C C -4.385 2.537 0.128 1.00 . A A . 7 GLY C 1 1
18 3337 1 1 7 GLY CA C -5.219 3.138 1.258 1.00 . A A . 7 GLY CA 1 1
18 3338 1 1 7 GLY H H -5.987 1.171 1.624 1.00 . A A . 7 GLY H 1 1
18 3339 1 1 7 GLY HA2 H -5.823 3.955 0.860 1.00 . A A . 7 GLY HA2 1 1
18 3340 1 1 7 GLY HA3 H -4.542 3.537 2.013 1.00 . A A . 7 GLY HA3 1 1
18 3341 1 1 7 GLY N N -6.093 2.149 1.875 1.00 . A A . 7 GLY N 1 1
18 3342 1 1 7 GLY O O -4.216 3.163 -0.916 1.00 . A A . 7 GLY O 1 1
18 3343 1 1 8 CYS C C -3.727 0.552 -2.009 1.00 . A A . 8 CYS C 1 1
18 3344 1 1 8 CYS CA C -3.043 0.614 -0.638 1.00 . A A . 8 CYS CA 1 1
18 3345 1 1 8 CYS CB C -2.729 -0.795 -0.124 1.00 . A A . 8 CYS CB 1 1
18 3346 1 1 8 CYS H H -4.010 0.885 1.231 1.00 . A A . 8 CYS H 1 1
18 3347 1 1 8 CYS HA H -2.100 1.148 -0.750 1.00 . A A . 8 CYS HA 1 1
18 3348 1 1 8 CYS HB3 H -3.630 -1.246 0.293 1.00 . A A . 8 CYS HB3 1 1
18 3349 1 1 8 CYS N N -3.851 1.331 0.337 1.00 . A A . 8 CYS N 1 1
18 3350 1 1 8 CYS O O -4.925 0.303 -2.104 1.00 . A A . 8 CYS O 1 1
18 3351 1 1 8 CYS SG S -2.146 -1.893 -1.434 1.00 . A A . 8 CYS SG 1 1
18 3352 1 1 9 HIS C C -2.078 -0.074 -5.094 1.00 . A A . 9 HIS C 1 1
18 3353 1 1 9 HIS CA C -3.295 0.603 -4.460 1.00 . A A . 9 HIS CA 1 1
18 3354 1 1 9 HIS CB C -3.587 1.966 -5.106 1.00 . A A . 9 HIS CB 1 1
18 3355 1 1 9 HIS CD2 C -6.002 2.703 -5.577 1.00 . A A . 9 HIS CD2 1 1
18 3356 1 1 9 HIS CE1 C -6.591 3.397 -3.582 1.00 . A A . 9 HIS CE1 1 1
18 3357 1 1 9 HIS CG C -4.933 2.540 -4.735 1.00 . A A . 9 HIS CG 1 1
18 3358 1 1 9 HIS H H -1.952 0.914 -2.926 1.00 . A A . 9 HIS H 1 1
18 3359 1 1 9 HIS HA H -4.158 -0.057 -4.565 1.00 . A A . 9 HIS HA 1 1
18 3360 1 1 9 HIS HB3 H -3.564 1.860 -6.188 1.00 . A A . 9 HIS HB3 1 1
18 3361 1 1 9 HIS HD1 H -4.761 2.973 -2.643 1.00 . A A . 9 HIS HD1 1 1
18 3362 1 1 9 HIS HD2 H -6.031 2.449 -6.626 1.00 . A A . 9 HIS HD2 1 1
18 3363 1 1 9 HIS HE1 H -7.169 3.790 -2.758 1.00 . A A . 9 HIS HE1 1 1
18 3364 1 1 9 HIS N N -2.947 0.798 -3.065 1.00 . A A . 9 HIS N 1 1
18 3365 1 1 9 HIS ND1 N -5.316 2.984 -3.490 1.00 . A A . 9 HIS ND1 1 1
18 3366 1 1 9 HIS NE2 N -7.051 3.253 -4.836 1.00 . A A . 9 HIS NE2 1 1
18 3367 1 1 9 HIS O O -1.108 -0.353 -4.390 1.00 . A A . 9 HIS O 1 1
18 3368 1 1 10 GLU C C 0.349 -0.385 -6.863 1.00 . A A . 10 GLU C 1 1
18 3369 1 1 10 GLU CA C -1.037 -0.968 -7.155 1.00 . A A . 10 GLU CA 1 1
18 3370 1 1 10 GLU CB C -1.323 -0.864 -8.658 1.00 . A A . 10 GLU CB 1 1
18 3371 1 1 10 GLU CD C -2.906 -1.313 -10.554 1.00 . A A . 10 GLU CD 1 1
18 3372 1 1 10 GLU CG C -2.748 -1.285 -9.040 1.00 . A A . 10 GLU CG 1 1
18 3373 1 1 10 GLU H H -2.930 -0.053 -6.923 1.00 . A A . 10 GLU H 1 1
18 3374 1 1 10 GLU HA H -1.024 -2.016 -6.854 1.00 . A A . 10 GLU HA 1 1
18 3375 1 1 10 GLU HB3 H -0.618 -1.506 -9.190 1.00 . A A . 10 GLU HB3 1 1
18 3376 1 1 10 GLU HG3 H -3.479 -0.572 -8.664 1.00 . A A . 10 GLU HG3 1 1
18 3377 1 1 10 GLU N N -2.100 -0.300 -6.410 1.00 . A A . 10 GLU N 1 1
18 3378 1 1 10 GLU O O 1.340 -1.107 -6.799 1.00 . A A . 10 GLU O 1 1
18 3379 1 1 10 GLU OE1 O -2.729 -0.229 -11.151 1.00 . A A . 10 GLU OE1 1 1
18 3380 1 1 10 GLU OE2 O -3.188 -2.409 -11.079 1.00 . A A . 10 GLU OE2 1 1
18 3381 1 1 11 LEU C C 2.333 1.252 -5.168 1.00 . A A . 11 LEU C 1 1
18 3382 1 1 11 LEU CA C 1.643 1.671 -6.471 1.00 . A A . 11 LEU CA 1 1
18 3383 1 1 11 LEU CB C 1.285 3.158 -6.433 1.00 . A A . 11 LEU CB 1 1
18 3384 1 1 11 LEU CD1 C 0.178 5.007 -7.722 1.00 . A A . 11 LEU CD1 1 1
18 3385 1 1 11 LEU CD2 C 2.317 4.037 -8.577 1.00 . A A . 11 LEU CD2 1 1
18 3386 1 1 11 LEU CG C 1.011 3.724 -7.835 1.00 . A A . 11 LEU CG 1 1
18 3387 1 1 11 LEU H H -0.437 1.475 -6.731 1.00 . A A . 11 LEU H 1 1
18 3388 1 1 11 LEU HA H 2.326 1.483 -7.298 1.00 . A A . 11 LEU HA 1 1
18 3389 1 1 11 LEU HB3 H 2.099 3.709 -5.981 1.00 . A A . 11 LEU HB3 1 1
18 3390 1 1 11 LEU HD11 H -0.776 4.788 -7.243 1.00 . A A . 11 LEU HD11 1 1
18 3391 1 1 11 LEU HD12 H 0.715 5.748 -7.129 1.00 . A A . 11 LEU HD12 1 1
18 3392 1 1 11 LEU HD13 H -0.013 5.412 -8.715 1.00 . A A . 11 LEU HD13 1 1
18 3393 1 1 11 LEU HD21 H 2.900 4.769 -8.019 1.00 . A A . 11 LEU HD21 1 1
18 3394 1 1 11 LEU HD22 H 2.912 3.134 -8.708 1.00 . A A . 11 LEU HD22 1 1
18 3395 1 1 11 LEU HD23 H 2.089 4.444 -9.562 1.00 . A A . 11 LEU HD23 1 1
18 3396 1 1 11 LEU HG H 0.447 2.990 -8.413 1.00 . A A . 11 LEU HG 1 1
18 3397 1 1 11 LEU N N 0.414 0.937 -6.703 1.00 . A A . 11 LEU N 1 1
18 3398 1 1 11 LEU O O 3.535 1.458 -5.008 1.00 . A A . 11 LEU O 1 1
18 3399 1 1 12 CYS C C 2.901 -0.845 -2.864 1.00 . A A . 12 CYS C 1 1
18 3400 1 1 12 CYS CA C 2.101 0.455 -2.880 1.00 . A A . 12 CYS CA 1 1
18 3401 1 1 12 CYS CB C 0.990 0.394 -1.839 1.00 . A A . 12 CYS CB 1 1
18 3402 1 1 12 CYS H H 0.627 0.446 -4.415 1.00 . A A . 12 CYS H 1 1
18 3403 1 1 12 CYS HA H 2.751 1.284 -2.594 1.00 . A A . 12 CYS HA 1 1
18 3404 1 1 12 CYS HB3 H 0.421 -0.527 -1.951 1.00 . A A . 12 CYS HB3 1 1
18 3405 1 1 12 CYS N N 1.577 0.721 -4.205 1.00 . A A . 12 CYS N 1 1
18 3406 1 1 12 CYS O O 2.333 -1.924 -2.738 1.00 . A A . 12 CYS O 1 1
18 3407 1 1 12 CYS SG S 1.747 0.440 -0.206 1.00 . A A . 12 CYS SG 1 1
18 3408 1 1 13 TYR C C 4.864 -2.969 -2.071 1.00 . A A . 13 TYR C 1 1
18 3409 1 1 13 TYR CA C 5.136 -1.870 -3.103 1.00 . A A . 13 TYR CA 1 1
18 3410 1 1 13 TYR CB C 6.578 -1.365 -2.964 1.00 . A A . 13 TYR CB 1 1
18 3411 1 1 13 TYR CD1 C 8.160 -3.344 -3.048 1.00 . A A . 13 TYR CD1 1 1
18 3412 1 1 13 TYR CD2 C 7.940 -1.932 -5.019 1.00 . A A . 13 TYR CD2 1 1
18 3413 1 1 13 TYR CE1 C 9.078 -4.159 -3.734 1.00 . A A . 13 TYR CE1 1 1
18 3414 1 1 13 TYR CE2 C 8.860 -2.744 -5.703 1.00 . A A . 13 TYR CE2 1 1
18 3415 1 1 13 TYR CG C 7.596 -2.224 -3.685 1.00 . A A . 13 TYR CG 1 1
18 3416 1 1 13 TYR CZ C 9.427 -3.858 -5.063 1.00 . A A . 13 TYR CZ 1 1
18 3417 1 1 13 TYR H H 4.592 0.188 -3.153 1.00 . A A . 13 TYR H 1 1
18 3418 1 1 13 TYR HA H 5.001 -2.286 -4.103 1.00 . A A . 13 TYR HA 1 1
18 3419 1 1 13 TYR HB3 H 6.850 -1.295 -1.910 1.00 . A A . 13 TYR HB3 1 1
18 3420 1 1 13 TYR HD1 H 7.881 -3.591 -2.034 1.00 . A A . 13 TYR HD1 1 1
18 3421 1 1 13 TYR HD2 H 7.493 -1.088 -5.524 1.00 . A A . 13 TYR HD2 1 1
18 3422 1 1 13 TYR HE1 H 9.501 -5.018 -3.237 1.00 . A A . 13 TYR HE1 1 1
18 3423 1 1 13 TYR HE2 H 9.123 -2.520 -6.726 1.00 . A A . 13 TYR HE2 1 1
18 3424 1 1 13 TYR HH H 10.631 -5.383 -5.214 1.00 . A A . 13 TYR HH 1 1
18 3425 1 1 13 TYR N N 4.224 -0.737 -2.981 1.00 . A A . 13 TYR N 1 1
18 3426 1 1 13 TYR O O 4.828 -4.151 -2.402 1.00 . A A . 13 TYR O 1 1
18 3427 1 1 13 TYR OH O 10.317 -4.642 -5.735 1.00 . A A . 13 TYR OH 1 1
18 3428 1 1 14 CYS C C 3.117 -3.854 0.550 1.00 . A A . 14 CYS C 1 1
18 3429 1 1 14 CYS CA C 4.581 -3.476 0.328 1.00 . A A . 14 CYS CA 1 1
18 3430 1 1 14 CYS CB C 5.196 -2.845 1.580 1.00 . A A . 14 CYS CB 1 1
18 3431 1 1 14 CYS H H 4.762 -1.562 -0.640 1.00 . A A . 14 CYS H 1 1
18 3432 1 1 14 CYS HA H 5.134 -4.395 0.126 1.00 . A A . 14 CYS HA 1 1
18 3433 1 1 14 CYS HB3 H 6.267 -2.768 1.412 1.00 . A A . 14 CYS HB3 1 1
18 3434 1 1 14 CYS N N 4.733 -2.563 -0.806 1.00 . A A . 14 CYS N 1 1
18 3435 1 1 14 CYS O O 2.800 -5.030 0.679 1.00 . A A . 14 CYS O 1 1
18 3436 1 1 14 CYS SG S 4.612 -1.188 1.988 1.00 . A A . 14 CYS SG 1 1
18 3437 1 1 15 CYS C C 0.327 -3.573 2.033 1.00 . A A . 15 CYS C 1 1
18 3438 1 1 15 CYS CA C 0.804 -2.875 0.752 1.00 . A A . 15 CYS CA 1 1
18 3439 1 1 15 CYS CB C 0.195 -3.569 -0.467 1.00 . A A . 15 CYS CB 1 1
18 3440 1 1 15 CYS H H 2.685 -1.941 0.440 1.00 . A A . 15 CYS H 1 1
18 3441 1 1 15 CYS HA H 0.469 -1.834 0.805 1.00 . A A . 15 CYS HA 1 1
18 3442 1 1 15 CYS HB3 H 0.560 -4.593 -0.488 1.00 . A A . 15 CYS HB3 1 1
18 3443 1 1 15 CYS N N 2.258 -2.835 0.596 1.00 . A A . 15 CYS N 1 1
18 3444 1 1 15 CYS O O 0.349 -4.799 2.124 1.00 . A A . 15 CYS O 1 1
18 3445 1 1 15 CYS SG S -1.606 -3.656 -0.478 1.00 . A A . 15 CYS SG 1 1
18 3446 1 1 16 ASP C C -2.072 -4.188 3.704 1.00 . A A . 16 ASP C 1 1
18 3447 1 1 16 ASP CA C -0.832 -3.419 4.171 1.00 . A A . 16 ASP CA 1 1
18 3448 1 1 16 ASP CB C -1.211 -2.328 5.177 1.00 . A A . 16 ASP CB 1 1
18 3449 1 1 16 ASP CG C -2.200 -2.790 6.237 1.00 . A A . 16 ASP CG 1 1
18 3450 1 1 16 ASP H H -0.224 -1.805 2.923 1.00 . A A . 16 ASP H 1 1
18 3451 1 1 16 ASP HA H -0.163 -4.127 4.663 1.00 . A A . 16 ASP HA 1 1
18 3452 1 1 16 ASP HB3 H -1.712 -1.547 4.620 1.00 . A A . 16 ASP HB3 1 1
18 3453 1 1 16 ASP N N -0.155 -2.814 3.026 1.00 . A A . 16 ASP N 1 1
18 3454 1 1 16 ASP O O -2.759 -3.762 2.775 1.00 . A A . 16 ASP O 1 1
18 3455 1 1 16 ASP OD1 O -2.293 -4.016 6.451 1.00 . A A . 16 ASP OD1 1 1
18 3456 1 1 16 ASP OD2 O -2.892 -1.894 6.770 1.00 . A A . 16 ASP OD2 1 1
19 3457 1 1 1 VAL C C 4.984 2.329 5.350 1.00 . A A . 1 VAL C 1 1
19 3458 1 1 1 VAL CA C 5.696 2.862 6.594 1.00 . A A . 1 VAL CA 1 1
19 3459 1 1 1 VAL CB C 4.708 3.365 7.663 1.00 . A A . 1 VAL CB 1 1
19 3460 1 1 1 VAL CG1 C 5.453 3.752 8.948 1.00 . A A . 1 VAL CG1 1 1
19 3461 1 1 1 VAL CG2 C 3.871 4.557 7.177 1.00 . A A . 1 VAL CG2 1 1
19 3462 1 1 1 VAL H1 H 6.505 4.191 5.214 1.00 . A A . 1 VAL H1 1 1
19 3463 1 1 1 VAL HA H 6.296 2.053 7.015 1.00 . A A . 1 VAL HA 1 1
19 3464 1 1 1 VAL HB H 4.024 2.552 7.912 1.00 . A A . 1 VAL HB 1 1
19 3465 1 1 1 VAL HG11 H 4.735 4.038 9.717 1.00 . A A . 1 VAL HG11 1 1
19 3466 1 1 1 VAL HG12 H 6.034 2.902 9.308 1.00 . A A . 1 VAL HG12 1 1
19 3467 1 1 1 VAL HG13 H 6.125 4.590 8.761 1.00 . A A . 1 VAL HG13 1 1
19 3468 1 1 1 VAL HG21 H 4.513 5.409 6.952 1.00 . A A . 1 VAL HG21 1 1
19 3469 1 1 1 VAL HG22 H 3.310 4.287 6.282 1.00 . A A . 1 VAL HG22 1 1
19 3470 1 1 1 VAL HG23 H 3.163 4.845 7.953 1.00 . A A . 1 VAL HG23 1 1
19 3471 1 1 1 VAL N N 6.597 3.925 6.190 1.00 . A A . 1 VAL N 1 1
19 3472 1 1 1 VAL O O 5.074 2.935 4.282 1.00 . A A . 1 VAL O 1 1
19 3473 1 1 2 CYS C C 2.190 1.445 4.261 1.00 . A A . 2 CYS C 1 1
19 3474 1 1 2 CYS CA C 3.487 0.647 4.394 1.00 . A A . 2 CYS CA 1 1
19 3475 1 1 2 CYS CB C 3.192 -0.830 4.655 1.00 . A A . 2 CYS CB 1 1
19 3476 1 1 2 CYS H H 4.221 0.766 6.390 1.00 . A A . 2 CYS H 1 1
19 3477 1 1 2 CYS HA H 4.048 0.746 3.462 1.00 . A A . 2 CYS HA 1 1
19 3478 1 1 2 CYS HB3 H 2.383 -0.912 5.377 1.00 . A A . 2 CYS HB3 1 1
19 3479 1 1 2 CYS N N 4.294 1.192 5.479 1.00 . A A . 2 CYS N 1 1
19 3480 1 1 2 CYS O O 1.851 2.212 5.161 1.00 . A A . 2 CYS O 1 1
19 3481 1 1 2 CYS SG S 2.680 -1.689 3.165 1.00 . A A . 2 CYS SG 1 1
19 3482 1 1 3 CYS C C -0.904 1.172 3.473 1.00 . A A . 3 CYS C 1 1
19 3483 1 1 3 CYS CA C 0.232 2.038 2.934 1.00 . A A . 3 CYS CA 1 1
19 3484 1 1 3 CYS CB C 0.033 2.383 1.450 1.00 . A A . 3 CYS CB 1 1
19 3485 1 1 3 CYS H H 1.628 0.519 2.514 1.00 . A A . 3 CYS H 1 1
19 3486 1 1 3 CYS HA H 0.314 2.985 3.466 1.00 . A A . 3 CYS HA 1 1
19 3487 1 1 3 CYS HB3 H -0.346 3.398 1.409 1.00 . A A . 3 CYS HB3 1 1
19 3488 1 1 3 CYS N N 1.451 1.281 3.158 1.00 . A A . 3 CYS N 1 1
19 3489 1 1 3 CYS O O -0.939 -0.005 3.109 1.00 . A A . 3 CYS O 1 1
19 3490 1 1 3 CYS SG S 1.472 2.304 0.355 1.00 . A A . 3 CYS SG 1 1
19 3491 1 1 4 PRO C C -3.782 0.316 4.092 1.00 . A A . 4 PRO C 1 1
19 3492 1 1 4 PRO CA C -2.784 0.942 5.066 1.00 . A A . 4 PRO CA 1 1
19 3493 1 1 4 PRO CB C -3.479 1.941 5.997 1.00 . A A . 4 PRO CB 1 1
19 3494 1 1 4 PRO CD C -1.889 3.123 4.670 1.00 . A A . 4 PRO CD 1 1
19 3495 1 1 4 PRO CG C -3.269 3.285 5.305 1.00 . A A . 4 PRO CG 1 1
19 3496 1 1 4 PRO HA H -2.295 0.190 5.679 1.00 . A A . 4 PRO HA 1 1
19 3497 1 1 4 PRO HB3 H -2.968 1.948 6.961 1.00 . A A . 4 PRO HB3 1 1
19 3498 1 1 4 PRO HD3 H -1.116 3.389 5.393 1.00 . A A . 4 PRO HD3 1 1
19 3499 1 1 4 PRO HG3 H -3.313 4.125 6.001 1.00 . A A . 4 PRO HG3 1 1
19 3500 1 1 4 PRO N N -1.776 1.711 4.344 1.00 . A A . 4 PRO N 1 1
19 3501 1 1 4 PRO O O -3.936 0.829 2.988 1.00 . A A . 4 PRO O 1 1
19 3502 1 1 5 PHE C C -6.429 -0.291 3.036 1.00 . A A . 5 PHE C 1 1
19 3503 1 1 5 PHE CA C -5.545 -1.361 3.681 1.00 . A A . 5 PHE CA 1 1
19 3504 1 1 5 PHE CB C -6.419 -2.311 4.517 1.00 . A A . 5 PHE CB 1 1
19 3505 1 1 5 PHE CD1 C -5.796 -4.661 3.809 1.00 . A A . 5 PHE CD1 1 1
19 3506 1 1 5 PHE CD2 C -5.346 -3.979 6.099 1.00 . A A . 5 PHE CD2 1 1
19 3507 1 1 5 PHE CE1 C -5.261 -5.933 4.083 1.00 . A A . 5 PHE CE1 1 1
19 3508 1 1 5 PHE CE2 C -4.778 -5.236 6.362 1.00 . A A . 5 PHE CE2 1 1
19 3509 1 1 5 PHE CG C -5.818 -3.672 4.810 1.00 . A A . 5 PHE CG 1 1
19 3510 1 1 5 PHE CZ C -4.739 -6.216 5.357 1.00 . A A . 5 PHE CZ 1 1
19 3511 1 1 5 PHE H H -4.204 -1.208 5.368 1.00 . A A . 5 PHE H 1 1
19 3512 1 1 5 PHE HA H -5.074 -1.917 2.868 1.00 . A A . 5 PHE HA 1 1
19 3513 1 1 5 PHE HB3 H -7.342 -2.493 3.964 1.00 . A A . 5 PHE HB3 1 1
19 3514 1 1 5 PHE HD1 H -6.131 -4.430 2.808 1.00 . A A . 5 PHE HD1 1 1
19 3515 1 1 5 PHE HD2 H -5.313 -3.218 6.867 1.00 . A A . 5 PHE HD2 1 1
19 3516 1 1 5 PHE HE1 H -5.200 -6.672 3.298 1.00 . A A . 5 PHE HE1 1 1
19 3517 1 1 5 PHE HE2 H -4.287 -5.407 7.311 1.00 . A A . 5 PHE HE2 1 1
19 3518 1 1 5 PHE HZ H -4.270 -7.169 5.554 1.00 . A A . 5 PHE HZ 1 1
19 3519 1 1 5 PHE N N -4.491 -0.748 4.496 1.00 . A A . 5 PHE N 1 1
19 3520 1 1 5 PHE O O -6.613 -0.274 1.821 1.00 . A A . 5 PHE O 1 1
19 3521 1 1 6 GLY C C -6.734 2.846 2.818 1.00 . A A . 6 GLY C 1 1
19 3522 1 1 6 GLY CA C -7.691 1.786 3.366 1.00 . A A . 6 GLY CA 1 1
19 3523 1 1 6 GLY H H -6.715 0.588 4.830 1.00 . A A . 6 GLY H 1 1
19 3524 1 1 6 GLY HA2 H -8.393 1.489 2.585 1.00 . A A . 6 GLY HA2 1 1
19 3525 1 1 6 GLY HA3 H -8.257 2.210 4.195 1.00 . A A . 6 GLY HA3 1 1
19 3526 1 1 6 GLY N N -6.950 0.632 3.850 1.00 . A A . 6 GLY N 1 1
19 3527 1 1 6 GLY O O -6.664 3.950 3.353 1.00 . A A . 6 GLY O 1 1
19 3528 1 1 7 GLY C C -4.209 2.740 0.060 1.00 . A A . 7 GLY C 1 1
19 3529 1 1 7 GLY CA C -4.991 3.407 1.190 1.00 . A A . 7 GLY CA 1 1
19 3530 1 1 7 GLY H H -6.052 1.560 1.422 1.00 . A A . 7 GLY H 1 1
19 3531 1 1 7 GLY HA2 H -5.486 4.300 0.805 1.00 . A A . 7 GLY HA2 1 1
19 3532 1 1 7 GLY HA3 H -4.284 3.703 1.967 1.00 . A A . 7 GLY HA3 1 1
19 3533 1 1 7 GLY N N -5.989 2.514 1.762 1.00 . A A . 7 GLY N 1 1
19 3534 1 1 7 GLY O O -3.936 3.369 -0.961 1.00 . A A . 7 GLY O 1 1
19 3535 1 1 8 CYS C C -3.770 0.697 -2.102 1.00 . A A . 8 CYS C 1 1
19 3536 1 1 8 CYS CA C -3.087 0.693 -0.730 1.00 . A A . 8 CYS CA 1 1
19 3537 1 1 8 CYS CB C -2.894 -0.737 -0.217 1.00 . A A . 8 CYS CB 1 1
19 3538 1 1 8 CYS H H -4.084 1.022 1.112 1.00 . A A . 8 CYS H 1 1
19 3539 1 1 8 CYS HA H -2.101 1.144 -0.836 1.00 . A A . 8 CYS HA 1 1
19 3540 1 1 8 CYS HB3 H -3.828 -1.111 0.204 1.00 . A A . 8 CYS HB3 1 1
19 3541 1 1 8 CYS N N -3.837 1.472 0.242 1.00 . A A . 8 CYS N 1 1
19 3542 1 1 8 CYS O O -4.983 0.536 -2.202 1.00 . A A . 8 CYS O 1 1
19 3543 1 1 8 CYS SG S -2.408 -1.887 -1.521 1.00 . A A . 8 CYS SG 1 1
19 3544 1 1 9 HIS C C -2.145 0.045 -5.205 1.00 . A A . 9 HIS C 1 1
19 3545 1 1 9 HIS CA C -3.328 0.764 -4.552 1.00 . A A . 9 HIS CA 1 1
19 3546 1 1 9 HIS CB C -3.544 2.161 -5.153 1.00 . A A . 9 HIS CB 1 1
19 3547 1 1 9 HIS CD2 C -5.950 2.981 -5.519 1.00 . A A . 9 HIS CD2 1 1
19 3548 1 1 9 HIS CE1 C -6.390 3.790 -3.529 1.00 . A A . 9 HIS CE1 1 1
19 3549 1 1 9 HIS CG C -4.840 2.810 -4.734 1.00 . A A . 9 HIS CG 1 1
19 3550 1 1 9 HIS H H -1.971 0.946 -3.013 1.00 . A A . 9 HIS H 1 1
19 3551 1 1 9 HIS HA H -4.225 0.155 -4.675 1.00 . A A . 9 HIS HA 1 1
19 3552 1 1 9 HIS HB3 H -3.550 2.087 -6.238 1.00 . A A . 9 HIS HB3 1 1
19 3553 1 1 9 HIS HD1 H -4.524 3.326 -2.679 1.00 . A A . 9 HIS HD1 1 1
19 3554 1 1 9 HIS HD2 H -6.053 2.680 -6.551 1.00 . A A . 9 HIS HD2 1 1
19 3555 1 1 9 HIS HE1 H -6.900 4.244 -2.692 1.00 . A A . 9 HIS HE1 1 1
19 3556 1 1 9 HIS N N -2.971 0.899 -3.153 1.00 . A A . 9 HIS N 1 1
19 3557 1 1 9 HIS ND1 N -5.130 3.327 -3.492 1.00 . A A . 9 HIS ND1 1 1
19 3558 1 1 9 HIS NE2 N -6.930 3.610 -4.745 1.00 . A A . 9 HIS NE2 1 1
19 3559 1 1 9 HIS O O -1.205 -0.326 -4.505 1.00 . A A . 9 HIS O 1 1
19 3560 1 1 10 GLU C C 0.298 -0.217 -6.933 1.00 . A A . 10 GLU C 1 1
19 3561 1 1 10 GLU CA C -1.093 -0.753 -7.297 1.00 . A A . 10 GLU CA 1 1
19 3562 1 1 10 GLU CB C -1.401 -0.555 -8.789 1.00 . A A . 10 GLU CB 1 1
19 3563 1 1 10 GLU CD C -0.791 -1.064 -11.174 1.00 . A A . 10 GLU CD 1 1
19 3564 1 1 10 GLU CG C -0.445 -1.321 -9.713 1.00 . A A . 10 GLU CG 1 1
19 3565 1 1 10 GLU H H -2.967 0.208 -7.043 1.00 . A A . 10 GLU H 1 1
19 3566 1 1 10 GLU HA H -1.106 -1.815 -7.057 1.00 . A A . 10 GLU HA 1 1
19 3567 1 1 10 GLU HB3 H -1.342 0.505 -9.040 1.00 . A A . 10 GLU HB3 1 1
19 3568 1 1 10 GLU HG3 H -0.513 -2.390 -9.511 1.00 . A A . 10 GLU HG3 1 1
19 3569 1 1 10 GLU N N -2.158 -0.111 -6.532 1.00 . A A . 10 GLU N 1 1
19 3570 1 1 10 GLU O O 1.258 -0.975 -6.819 1.00 . A A . 10 GLU O 1 1
19 3571 1 1 10 GLU OE1 O -0.729 0.122 -11.562 1.00 . A A . 10 GLU OE1 1 1
19 3572 1 1 10 GLU OE2 O -1.130 -2.049 -11.862 1.00 . A A . 10 GLU OE2 1 1
19 3573 1 1 11 LEU C C 2.270 1.306 -5.108 1.00 . A A . 11 LEU C 1 1
19 3574 1 1 11 LEU CA C 1.659 1.768 -6.437 1.00 . A A . 11 LEU CA 1 1
19 3575 1 1 11 LEU CB C 1.374 3.272 -6.401 1.00 . A A . 11 LEU CB 1 1
19 3576 1 1 11 LEU CD1 C 0.385 5.168 -7.714 1.00 . A A . 11 LEU CD1 1 1
19 3577 1 1 11 LEU CD2 C 2.505 4.112 -8.509 1.00 . A A . 11 LEU CD2 1 1
19 3578 1 1 11 LEU CG C 1.165 3.853 -7.808 1.00 . A A . 11 LEU CG 1 1
19 3579 1 1 11 LEU H H -0.411 1.681 -6.773 1.00 . A A . 11 LEU H 1 1
19 3580 1 1 11 LEU HA H 2.367 1.554 -7.236 1.00 . A A . 11 LEU HA 1 1
19 3581 1 1 11 LEU HB3 H 2.202 3.779 -5.923 1.00 . A A . 11 LEU HB3 1 1
19 3582 1 1 11 LEU HD11 H 0.240 5.585 -8.712 1.00 . A A . 11 LEU HD11 1 1
19 3583 1 1 11 LEU HD12 H -0.593 4.989 -7.265 1.00 . A A . 11 LEU HD12 1 1
19 3584 1 1 11 LEU HD13 H 0.933 5.886 -7.103 1.00 . A A . 11 LEU HD13 1 1
19 3585 1 1 11 LEU HD21 H 2.324 4.531 -9.500 1.00 . A A . 11 LEU HD21 1 1
19 3586 1 1 11 LEU HD22 H 3.102 4.818 -7.931 1.00 . A A . 11 LEU HD22 1 1
19 3587 1 1 11 LEU HD23 H 3.065 3.185 -8.626 1.00 . A A . 11 LEU HD23 1 1
19 3588 1 1 11 LEU HG H 0.591 3.145 -8.407 1.00 . A A . 11 LEU HG 1 1
19 3589 1 1 11 LEU N N 0.407 1.097 -6.729 1.00 . A A . 11 LEU N 1 1
19 3590 1 1 11 LEU O O 3.468 1.472 -4.882 1.00 . A A . 11 LEU O 1 1
19 3591 1 1 12 CYS C C 2.642 -0.885 -2.850 1.00 . A A . 12 CYS C 1 1
19 3592 1 1 12 CYS CA C 1.899 0.448 -2.858 1.00 . A A . 12 CYS CA 1 1
19 3593 1 1 12 CYS CB C 0.735 0.406 -1.876 1.00 . A A . 12 CYS CB 1 1
19 3594 1 1 12 CYS H H 0.511 0.519 -4.470 1.00 . A A . 12 CYS H 1 1
19 3595 1 1 12 CYS HA H 2.572 1.236 -2.514 1.00 . A A . 12 CYS HA 1 1
19 3596 1 1 12 CYS HB3 H 0.118 -0.470 -2.068 1.00 . A A . 12 CYS HB3 1 1
19 3597 1 1 12 CYS N N 1.451 0.775 -4.198 1.00 . A A . 12 CYS N 1 1
19 3598 1 1 12 CYS O O 2.033 -1.938 -2.689 1.00 . A A . 12 CYS O 1 1
19 3599 1 1 12 CYS SG S 1.404 0.310 -0.209 1.00 . A A . 12 CYS SG 1 1
19 3600 1 1 13 TYR C C 4.530 -3.107 -2.168 1.00 . A A . 13 TYR C 1 1
19 3601 1 1 13 TYR CA C 4.833 -1.993 -3.173 1.00 . A A . 13 TYR CA 1 1
19 3602 1 1 13 TYR CB C 6.292 -1.540 -3.028 1.00 . A A . 13 TYR CB 1 1
19 3603 1 1 13 TYR CD1 C 7.755 -3.606 -3.187 1.00 . A A . 13 TYR CD1 1 1
19 3604 1 1 13 TYR CD2 C 7.692 -2.065 -5.070 1.00 . A A . 13 TYR CD2 1 1
19 3605 1 1 13 TYR CE1 C 8.644 -4.434 -3.895 1.00 . A A . 13 TYR CE1 1 1
19 3606 1 1 13 TYR CE2 C 8.587 -2.890 -5.774 1.00 . A A . 13 TYR CE2 1 1
19 3607 1 1 13 TYR CG C 7.281 -2.417 -3.771 1.00 . A A . 13 TYR CG 1 1
19 3608 1 1 13 TYR CZ C 9.058 -4.076 -5.189 1.00 . A A . 13 TYR CZ 1 1
19 3609 1 1 13 TYR H H 4.355 0.079 -3.206 1.00 . A A . 13 TYR H 1 1
19 3610 1 1 13 TYR HA H 4.679 -2.378 -4.184 1.00 . A A . 13 TYR HA 1 1
19 3611 1 1 13 TYR HB3 H 6.570 -1.507 -1.974 1.00 . A A . 13 TYR HB3 1 1
19 3612 1 1 13 TYR HD1 H 7.428 -3.895 -2.199 1.00 . A A . 13 TYR HD1 1 1
19 3613 1 1 13 TYR HD2 H 7.318 -1.165 -5.535 1.00 . A A . 13 TYR HD2 1 1
19 3614 1 1 13 TYR HE1 H 8.994 -5.349 -3.439 1.00 . A A . 13 TYR HE1 1 1
19 3615 1 1 13 TYR HE2 H 8.902 -2.619 -6.771 1.00 . A A . 13 TYR HE2 1 1
19 3616 1 1 13 TYR HH H 10.165 -5.666 -5.402 1.00 . A A . 13 TYR HH 1 1
19 3617 1 1 13 TYR N N 3.964 -0.832 -3.016 1.00 . A A . 13 TYR N 1 1
19 3618 1 1 13 TYR O O 4.463 -4.279 -2.525 1.00 . A A . 13 TYR O 1 1
19 3619 1 1 13 TYR OH O 9.921 -4.872 -5.881 1.00 . A A . 13 TYR OH 1 1
19 3620 1 1 14 CYS C C 2.780 -4.019 0.439 1.00 . A A . 14 CYS C 1 1
19 3621 1 1 14 CYS CA C 4.249 -3.660 0.218 1.00 . A A . 14 CYS CA 1 1
19 3622 1 1 14 CYS CB C 4.877 -3.065 1.480 1.00 . A A . 14 CYS CB 1 1
19 3623 1 1 14 CYS H H 4.459 -1.728 -0.708 1.00 . A A . 14 CYS H 1 1
19 3624 1 1 14 CYS HA H 4.786 -4.584 -0.004 1.00 . A A . 14 CYS HA 1 1
19 3625 1 1 14 CYS HB3 H 5.949 -3.002 1.311 1.00 . A A . 14 CYS HB3 1 1
19 3626 1 1 14 CYS N N 4.413 -2.725 -0.895 1.00 . A A . 14 CYS N 1 1
19 3627 1 1 14 CYS O O 2.442 -5.192 0.553 1.00 . A A . 14 CYS O 1 1
19 3628 1 1 14 CYS SG S 4.321 -1.407 1.920 1.00 . A A . 14 CYS SG 1 1
19 3629 1 1 15 CYS C C 0.018 -3.689 1.971 1.00 . A A . 15 CYS C 1 1
19 3630 1 1 15 CYS CA C 0.489 -2.998 0.682 1.00 . A A . 15 CYS CA 1 1
19 3631 1 1 15 CYS CB C -0.155 -3.665 -0.533 1.00 . A A . 15 CYS CB 1 1
19 3632 1 1 15 CYS H H 2.383 -2.100 0.345 1.00 . A A . 15 CYS H 1 1
19 3633 1 1 15 CYS HA H 0.180 -1.950 0.751 1.00 . A A . 15 CYS HA 1 1
19 3634 1 1 15 CYS HB3 H 0.168 -4.703 -0.550 1.00 . A A . 15 CYS HB3 1 1
19 3635 1 1 15 CYS N N 1.939 -2.985 0.502 1.00 . A A . 15 CYS N 1 1
19 3636 1 1 15 CYS O O 0.031 -4.913 2.071 1.00 . A A . 15 CYS O 1 1
19 3637 1 1 15 CYS SG S -1.958 -3.664 -0.543 1.00 . A A . 15 CYS SG 1 1
19 3638 1 1 16 ASP C C -2.343 -4.221 3.799 1.00 . A A . 16 ASP C 1 1
19 3639 1 1 16 ASP CA C -1.059 -3.466 4.158 1.00 . A A . 16 ASP CA 1 1
19 3640 1 1 16 ASP CB C -1.382 -2.319 5.111 1.00 . A A . 16 ASP CB 1 1
19 3641 1 1 16 ASP CG C -2.268 -2.736 6.272 1.00 . A A . 16 ASP CG 1 1
19 3642 1 1 16 ASP H H -0.490 -1.903 2.837 1.00 . A A . 16 ASP H 1 1
19 3643 1 1 16 ASP HA H -0.375 -4.160 4.649 1.00 . A A . 16 ASP HA 1 1
19 3644 1 1 16 ASP HB3 H -1.956 -1.615 4.527 1.00 . A A . 16 ASP HB3 1 1
19 3645 1 1 16 ASP N N -0.433 -2.910 2.960 1.00 . A A . 16 ASP N 1 1
19 3646 1 1 16 ASP O O -2.974 -3.924 2.781 1.00 . A A . 16 ASP O 1 1
19 3647 1 1 16 ASP OD1 O -2.022 -3.836 6.806 1.00 . A A . 16 ASP OD1 1 1
19 3648 1 1 16 ASP OD2 O -3.192 -1.945 6.575 1.00 . A A . 16 ASP OD2 1 1
20 3649 1 1 1 VAL C C 5.464 1.677 5.568 1.00 . A A . 1 VAL C 1 1
20 3650 1 1 1 VAL CA C 6.295 2.334 6.673 1.00 . A A . 1 VAL CA 1 1
20 3651 1 1 1 VAL CB C 5.456 3.284 7.548 1.00 . A A . 1 VAL CB 1 1
20 3652 1 1 1 VAL CG1 C 6.287 3.805 8.728 1.00 . A A . 1 VAL CG1 1 1
20 3653 1 1 1 VAL CG2 C 4.891 4.470 6.753 1.00 . A A . 1 VAL CG2 1 1
20 3654 1 1 1 VAL H1 H 7.363 3.067 5.044 1.00 . A A . 1 VAL H1 1 1
20 3655 1 1 1 VAL HA H 6.709 1.544 7.300 1.00 . A A . 1 VAL HA 1 1
20 3656 1 1 1 VAL HB H 4.616 2.724 7.961 1.00 . A A . 1 VAL HB 1 1
20 3657 1 1 1 VAL HG11 H 6.674 2.966 9.307 1.00 . A A . 1 VAL HG11 1 1
20 3658 1 1 1 VAL HG12 H 7.122 4.407 8.369 1.00 . A A . 1 VAL HG12 1 1
20 3659 1 1 1 VAL HG13 H 5.661 4.419 9.376 1.00 . A A . 1 VAL HG13 1 1
20 3660 1 1 1 VAL HG21 H 5.699 5.081 6.351 1.00 . A A . 1 VAL HG21 1 1
20 3661 1 1 1 VAL HG22 H 4.269 4.114 5.931 1.00 . A A . 1 VAL HG22 1 1
20 3662 1 1 1 VAL HG23 H 4.276 5.088 7.408 1.00 . A A . 1 VAL HG23 1 1
20 3663 1 1 1 VAL N N 7.400 3.046 6.057 1.00 . A A . 1 VAL N 1 1
20 3664 1 1 1 VAL O O 5.678 1.955 4.388 1.00 . A A . 1 VAL O 1 1
20 3665 1 1 2 CYS C C 2.487 1.144 4.660 1.00 . A A . 2 CYS C 1 1
20 3666 1 1 2 CYS CA C 3.618 0.174 4.998 1.00 . A A . 2 CYS CA 1 1
20 3667 1 1 2 CYS CB C 3.060 -1.122 5.588 1.00 . A A . 2 CYS CB 1 1
20 3668 1 1 2 CYS H H 4.373 0.651 6.930 1.00 . A A . 2 CYS H 1 1
20 3669 1 1 2 CYS HA H 4.173 -0.054 4.091 1.00 . A A . 2 CYS HA 1 1
20 3670 1 1 2 CYS HB3 H 2.147 -0.913 6.147 1.00 . A A . 2 CYS HB3 1 1
20 3671 1 1 2 CYS N N 4.533 0.798 5.946 1.00 . A A . 2 CYS N 1 1
20 3672 1 1 2 CYS O O 2.325 2.149 5.349 1.00 . A A . 2 CYS O 1 1
20 3673 1 1 2 CYS SG S 2.715 -2.403 4.369 1.00 . A A . 2 CYS SG 1 1
20 3674 1 1 3 CYS C C -0.713 0.857 3.772 1.00 . A A . 3 CYS C 1 1
20 3675 1 1 3 CYS CA C 0.509 1.649 3.311 1.00 . A A . 3 CYS CA 1 1
20 3676 1 1 3 CYS CB C 0.457 1.901 1.808 1.00 . A A . 3 CYS CB 1 1
20 3677 1 1 3 CYS H H 1.733 -0.038 3.146 1.00 . A A . 3 CYS H 1 1
20 3678 1 1 3 CYS HA H 0.565 2.620 3.803 1.00 . A A . 3 CYS HA 1 1
20 3679 1 1 3 CYS HB3 H 1.363 2.420 1.494 1.00 . A A . 3 CYS HB3 1 1
20 3680 1 1 3 CYS N N 1.684 0.852 3.631 1.00 . A A . 3 CYS N 1 1
20 3681 1 1 3 CYS O O -0.714 -0.360 3.596 1.00 . A A . 3 CYS O 1 1
20 3682 1 1 3 CYS SG S 0.268 0.405 0.823 1.00 . A A . 3 CYS SG 1 1
20 3683 1 1 4 PRO C C -3.756 0.257 3.766 1.00 . A A . 4 PRO C 1 1
20 3684 1 1 4 PRO CA C -2.904 0.824 4.904 1.00 . A A . 4 PRO CA 1 1
20 3685 1 1 4 PRO CB C -3.682 1.900 5.670 1.00 . A A . 4 PRO CB 1 1
20 3686 1 1 4 PRO CD C -1.808 2.936 4.604 1.00 . A A . 4 PRO CD 1 1
20 3687 1 1 4 PRO CG C -3.259 3.203 4.996 1.00 . A A . 4 PRO CG 1 1
20 3688 1 1 4 PRO HA H -2.615 0.039 5.596 1.00 . A A . 4 PRO HA 1 1
20 3689 1 1 4 PRO HB3 H -3.356 1.906 6.711 1.00 . A A . 4 PRO HB3 1 1
20 3690 1 1 4 PRO HD3 H -1.149 3.215 5.426 1.00 . A A . 4 PRO HD3 1 1
20 3691 1 1 4 PRO HG3 H -3.362 4.066 5.655 1.00 . A A . 4 PRO HG3 1 1
20 3692 1 1 4 PRO N N -1.722 1.501 4.384 1.00 . A A . 4 PRO N 1 1
20 3693 1 1 4 PRO O O -3.543 0.617 2.609 1.00 . A A . 4 PRO O 1 1
20 3694 1 1 5 PHE C C -6.245 0.243 2.285 1.00 . A A . 5 PHE C 1 1
20 3695 1 1 5 PHE CA C -5.824 -0.949 3.151 1.00 . A A . 5 PHE CA 1 1
20 3696 1 1 5 PHE CB C -7.068 -1.475 3.890 1.00 . A A . 5 PHE CB 1 1
20 3697 1 1 5 PHE CD1 C -5.874 -3.653 4.519 1.00 . A A . 5 PHE CD1 1 1
20 3698 1 1 5 PHE CD2 C -8.065 -3.171 5.460 1.00 . A A . 5 PHE CD2 1 1
20 3699 1 1 5 PHE CE1 C -5.824 -4.848 5.258 1.00 . A A . 5 PHE CE1 1 1
20 3700 1 1 5 PHE CE2 C -8.027 -4.380 6.175 1.00 . A A . 5 PHE CE2 1 1
20 3701 1 1 5 PHE CG C -6.980 -2.790 4.646 1.00 . A A . 5 PHE CG 1 1
20 3702 1 1 5 PHE CZ C -6.900 -5.214 6.084 1.00 . A A . 5 PHE CZ 1 1
20 3703 1 1 5 PHE H H -4.735 -1.008 5.018 1.00 . A A . 5 PHE H 1 1
20 3704 1 1 5 PHE HA H -5.441 -1.712 2.473 1.00 . A A . 5 PHE HA 1 1
20 3705 1 1 5 PHE HB3 H -7.856 -1.603 3.146 1.00 . A A . 5 PHE HB3 1 1
20 3706 1 1 5 PHE HD1 H -5.008 -3.371 3.942 1.00 . A A . 5 PHE HD1 1 1
20 3707 1 1 5 PHE HD2 H -8.926 -2.528 5.553 1.00 . A A . 5 PHE HD2 1 1
20 3708 1 1 5 PHE HE1 H -4.921 -5.441 5.251 1.00 . A A . 5 PHE HE1 1 1
20 3709 1 1 5 PHE HE2 H -8.849 -4.653 6.821 1.00 . A A . 5 PHE HE2 1 1
20 3710 1 1 5 PHE HZ H -6.839 -6.114 6.679 1.00 . A A . 5 PHE HZ 1 1
20 3711 1 1 5 PHE N N -4.765 -0.565 4.091 1.00 . A A . 5 PHE N 1 1
20 3712 1 1 5 PHE O O -6.258 0.152 1.059 1.00 . A A . 5 PHE O 1 1
20 3713 1 1 6 GLY C C -5.589 3.307 1.755 1.00 . A A . 6 GLY C 1 1
20 3714 1 1 6 GLY CA C -6.870 2.628 2.244 1.00 . A A . 6 GLY CA 1 1
20 3715 1 1 6 GLY H H -6.482 1.388 3.928 1.00 . A A . 6 GLY H 1 1
20 3716 1 1 6 GLY HA2 H -7.532 2.446 1.395 1.00 . A A . 6 GLY HA2 1 1
20 3717 1 1 6 GLY HA3 H -7.380 3.288 2.944 1.00 . A A . 6 GLY HA3 1 1
20 3718 1 1 6 GLY N N -6.562 1.375 2.923 1.00 . A A . 6 GLY N 1 1
20 3719 1 1 6 GLY O O -5.275 4.420 2.170 1.00 . A A . 6 GLY O 1 1
20 3720 1 1 7 GLY C C -2.933 1.981 -0.504 1.00 . A A . 7 GLY C 1 1
20 3721 1 1 7 GLY CA C -3.532 3.041 0.420 1.00 . A A . 7 GLY CA 1 1
20 3722 1 1 7 GLY H H -5.165 1.696 0.646 1.00 . A A . 7 GLY H 1 1
20 3723 1 1 7 GLY HA2 H -3.619 3.986 -0.117 1.00 . A A . 7 GLY HA2 1 1
20 3724 1 1 7 GLY HA3 H -2.870 3.175 1.276 1.00 . A A . 7 GLY HA3 1 1
20 3725 1 1 7 GLY N N -4.844 2.623 0.889 1.00 . A A . 7 GLY N 1 1
20 3726 1 1 7 GLY O O -2.299 2.311 -1.506 1.00 . A A . 7 GLY O 1 1
20 3727 1 1 8 CYS C C -3.414 -0.468 -2.329 1.00 . A A . 8 CYS C 1 1
20 3728 1 1 8 CYS CA C -2.679 -0.409 -0.993 1.00 . A A . 8 CYS CA 1 1
20 3729 1 1 8 CYS CB C -2.768 -1.729 -0.229 1.00 . A A . 8 CYS CB 1 1
20 3730 1 1 8 CYS H H -3.615 0.491 0.690 1.00 . A A . 8 CYS H 1 1
20 3731 1 1 8 CYS HA H -1.624 -0.260 -1.215 1.00 . A A . 8 CYS HA 1 1
20 3732 1 1 8 CYS HB3 H -3.780 -1.911 0.133 1.00 . A A . 8 CYS HB3 1 1
20 3733 1 1 8 CYS N N -3.145 0.702 -0.181 1.00 . A A . 8 CYS N 1 1
20 3734 1 1 8 CYS O O -4.412 -1.169 -2.490 1.00 . A A . 8 CYS O 1 1
20 3735 1 1 8 CYS SG S -2.277 -3.111 -1.285 1.00 . A A . 8 CYS SG 1 1
20 3736 1 1 9 HIS C C -1.755 -0.172 -5.346 1.00 . A A . 9 HIS C 1 1
20 3737 1 1 9 HIS CA C -3.130 0.079 -4.722 1.00 . A A . 9 HIS CA 1 1
20 3738 1 1 9 HIS CB C -3.827 1.317 -5.301 1.00 . A A . 9 HIS CB 1 1
20 3739 1 1 9 HIS CD2 C -6.047 2.589 -5.098 1.00 . A A . 9 HIS CD2 1 1
20 3740 1 1 9 HIS CE1 C -7.133 1.272 -3.718 1.00 . A A . 9 HIS CE1 1 1
20 3741 1 1 9 HIS CG C -5.228 1.538 -4.780 1.00 . A A . 9 HIS CG 1 1
20 3742 1 1 9 HIS H H -2.140 0.905 -3.070 1.00 . A A . 9 HIS H 1 1
20 3743 1 1 9 HIS HA H -3.745 -0.804 -4.903 1.00 . A A . 9 HIS HA 1 1
20 3744 1 1 9 HIS HB3 H -3.890 1.214 -6.382 1.00 . A A . 9 HIS HB3 1 1
20 3745 1 1 9 HIS HD1 H -5.580 -0.133 -3.485 1.00 . A A . 9 HIS HD1 1 1
20 3746 1 1 9 HIS HD2 H -5.804 3.407 -5.759 1.00 . A A . 9 HIS HD2 1 1
20 3747 1 1 9 HIS HE1 H -7.898 0.859 -3.077 1.00 . A A . 9 HIS HE1 1 1
20 3748 1 1 9 HIS N N -2.904 0.280 -3.304 1.00 . A A . 9 HIS N 1 1
20 3749 1 1 9 HIS ND1 N -5.925 0.718 -3.918 1.00 . A A . 9 HIS ND1 1 1
20 3750 1 1 9 HIS NE2 N -7.255 2.412 -4.417 1.00 . A A . 9 HIS NE2 1 1
20 3751 1 1 9 HIS O O -0.755 -0.184 -4.632 1.00 . A A . 9 HIS O 1 1
20 3752 1 1 10 GLU C C 0.732 0.125 -7.061 1.00 . A A . 10 GLU C 1 1
20 3753 1 1 10 GLU CA C -0.495 -0.731 -7.408 1.00 . A A . 10 GLU CA 1 1
20 3754 1 1 10 GLU CB C -0.828 -0.667 -8.905 1.00 . A A . 10 GLU CB 1 1
20 3755 1 1 10 GLU CD C -0.118 -1.176 -11.268 1.00 . A A . 10 GLU CD 1 1
20 3756 1 1 10 GLU CG C 0.295 -1.198 -9.803 1.00 . A A . 10 GLU CG 1 1
20 3757 1 1 10 GLU H H -2.562 -0.327 -7.186 1.00 . A A . 10 GLU H 1 1
20 3758 1 1 10 GLU HA H -0.249 -1.758 -7.135 1.00 . A A . 10 GLU HA 1 1
20 3759 1 1 10 GLU HB3 H -1.037 0.366 -9.191 1.00 . A A . 10 GLU HB3 1 1
20 3760 1 1 10 GLU HG3 H 0.540 -2.222 -9.517 1.00 . A A . 10 GLU HG3 1 1
20 3761 1 1 10 GLU N N -1.698 -0.357 -6.667 1.00 . A A . 10 GLU N 1 1
20 3762 1 1 10 GLU O O 1.857 -0.366 -7.041 1.00 . A A . 10 GLU O 1 1
20 3763 1 1 10 GLU OE1 O -0.632 -0.118 -11.691 1.00 . A A . 10 GLU OE1 1 1
20 3764 1 1 10 GLU OE2 O 0.074 -2.218 -11.930 1.00 . A A . 10 GLU OE2 1 1
20 3765 1 1 11 LEU C C 2.401 1.923 -5.243 1.00 . A A . 11 LEU C 1 1
20 3766 1 1 11 LEU CA C 1.565 2.360 -6.455 1.00 . A A . 11 LEU CA 1 1
20 3767 1 1 11 LEU CB C 0.888 3.708 -6.194 1.00 . A A . 11 LEU CB 1 1
20 3768 1 1 11 LEU CD1 C -0.741 5.357 -7.165 1.00 . A A . 11 LEU CD1 1 1
20 3769 1 1 11 LEU CD2 C 1.494 5.069 -8.248 1.00 . A A . 11 LEU CD2 1 1
20 3770 1 1 11 LEU CG C 0.369 4.351 -7.489 1.00 . A A . 11 LEU CG 1 1
20 3771 1 1 11 LEU H H -0.427 1.760 -6.735 1.00 . A A . 11 LEU H 1 1
20 3772 1 1 11 LEU HA H 2.223 2.451 -7.318 1.00 . A A . 11 LEU HA 1 1
20 3773 1 1 11 LEU HB3 H 1.597 4.376 -5.721 1.00 . A A . 11 LEU HB3 1 1
20 3774 1 1 11 LEU HD11 H -0.358 6.136 -6.505 1.00 . A A . 11 LEU HD11 1 1
20 3775 1 1 11 LEU HD12 H -1.107 5.814 -8.084 1.00 . A A . 11 LEU HD12 1 1
20 3776 1 1 11 LEU HD13 H -1.571 4.848 -6.673 1.00 . A A . 11 LEU HD13 1 1
20 3777 1 1 11 LEU HD21 H 1.093 5.513 -9.160 1.00 . A A . 11 LEU HD21 1 1
20 3778 1 1 11 LEU HD22 H 1.921 5.858 -7.629 1.00 . A A . 11 LEU HD22 1 1
20 3779 1 1 11 LEU HD23 H 2.280 4.367 -8.524 1.00 . A A . 11 LEU HD23 1 1
20 3780 1 1 11 LEU HG H -0.042 3.576 -8.137 1.00 . A A . 11 LEU HG 1 1
20 3781 1 1 11 LEU N N 0.517 1.411 -6.774 1.00 . A A . 11 LEU N 1 1
20 3782 1 1 11 LEU O O 3.565 2.301 -5.127 1.00 . A A . 11 LEU O 1 1
20 3783 1 1 12 CYS C C 2.947 -0.614 -3.073 1.00 . A A . 12 CYS C 1 1
20 3784 1 1 12 CYS CA C 2.393 0.809 -3.042 1.00 . A A . 12 CYS CA 1 1
20 3785 1 1 12 CYS CB C 1.328 0.902 -1.962 1.00 . A A . 12 CYS CB 1 1
20 3786 1 1 12 CYS H H 0.876 0.811 -4.509 1.00 . A A . 12 CYS H 1 1
20 3787 1 1 12 CYS HA H 3.191 1.502 -2.773 1.00 . A A . 12 CYS HA 1 1
20 3788 1 1 12 CYS HB3 H 0.503 0.237 -2.219 1.00 . A A . 12 CYS HB3 1 1
20 3789 1 1 12 CYS N N 1.798 1.176 -4.316 1.00 . A A . 12 CYS N 1 1
20 3790 1 1 12 CYS O O 2.217 -1.564 -3.338 1.00 . A A . 12 CYS O 1 1
20 3791 1 1 12 CYS SG S 1.962 0.381 -0.361 1.00 . A A . 12 CYS SG 1 1
20 3792 1 1 13 TYR C C 4.489 -2.867 -1.498 1.00 . A A . 13 TYR C 1 1
20 3793 1 1 13 TYR CA C 4.916 -2.038 -2.716 1.00 . A A . 13 TYR CA 1 1
20 3794 1 1 13 TYR CB C 6.425 -1.748 -2.691 1.00 . A A . 13 TYR CB 1 1
20 3795 1 1 13 TYR CD1 C 6.774 -1.008 -5.090 1.00 . A A . 13 TYR CD1 1 1
20 3796 1 1 13 TYR CD2 C 8.093 -2.868 -4.235 1.00 . A A . 13 TYR CD2 1 1
20 3797 1 1 13 TYR CE1 C 7.411 -1.129 -6.337 1.00 . A A . 13 TYR CE1 1 1
20 3798 1 1 13 TYR CE2 C 8.733 -2.984 -5.481 1.00 . A A . 13 TYR CE2 1 1
20 3799 1 1 13 TYR CG C 7.113 -1.877 -4.036 1.00 . A A . 13 TYR CG 1 1
20 3800 1 1 13 TYR CZ C 8.390 -2.119 -6.532 1.00 . A A . 13 TYR CZ 1 1
20 3801 1 1 13 TYR H H 4.808 0.038 -2.555 1.00 . A A . 13 TYR H 1 1
20 3802 1 1 13 TYR HA H 4.675 -2.614 -3.613 1.00 . A A . 13 TYR HA 1 1
20 3803 1 1 13 TYR HB3 H 6.877 -2.427 -1.983 1.00 . A A . 13 TYR HB3 1 1
20 3804 1 1 13 TYR HD1 H 6.018 -0.248 -4.948 1.00 . A A . 13 TYR HD1 1 1
20 3805 1 1 13 TYR HD2 H 8.358 -3.544 -3.436 1.00 . A A . 13 TYR HD2 1 1
20 3806 1 1 13 TYR HE1 H 7.136 -0.462 -7.140 1.00 . A A . 13 TYR HE1 1 1
20 3807 1 1 13 TYR HE2 H 9.485 -3.744 -5.633 1.00 . A A . 13 TYR HE2 1 1
20 3808 1 1 13 TYR HH H 8.688 -1.622 -8.392 1.00 . A A . 13 TYR HH 1 1
20 3809 1 1 13 TYR N N 4.235 -0.763 -2.758 1.00 . A A . 13 TYR N 1 1
20 3810 1 1 13 TYR O O 4.207 -4.054 -1.625 1.00 . A A . 13 TYR O 1 1
20 3811 1 1 13 TYR OH O 9.015 -2.241 -7.737 1.00 . A A . 13 TYR OH 1 1
20 3812 1 1 14 CYS C C 3.100 -3.669 1.185 1.00 . A A . 14 CYS C 1 1
20 3813 1 1 14 CYS CA C 4.459 -3.011 0.950 1.00 . A A . 14 CYS CA 1 1
20 3814 1 1 14 CYS CB C 4.842 -2.112 2.128 1.00 . A A . 14 CYS CB 1 1
20 3815 1 1 14 CYS H H 4.724 -1.274 -0.283 1.00 . A A . 14 CYS H 1 1
20 3816 1 1 14 CYS HA H 5.201 -3.811 0.905 1.00 . A A . 14 CYS HA 1 1
20 3817 1 1 14 CYS HB3 H 4.253 -1.196 2.120 1.00 . A A . 14 CYS HB3 1 1
20 3818 1 1 14 CYS N N 4.517 -2.261 -0.306 1.00 . A A . 14 CYS N 1 1
20 3819 1 1 14 CYS O O 3.016 -4.879 1.367 1.00 . A A . 14 CYS O 1 1
20 3820 1 1 14 CYS SG S 4.628 -2.937 3.726 1.00 . A A . 14 CYS SG 1 1
20 3821 1 1 15 CYS C C 0.219 -3.925 2.559 1.00 . A A . 15 CYS C 1 1
20 3822 1 1 15 CYS CA C 0.646 -3.222 1.264 1.00 . A A . 15 CYS CA 1 1
20 3823 1 1 15 CYS CB C 0.267 -4.071 0.051 1.00 . A A . 15 CYS CB 1 1
20 3824 1 1 15 CYS H H 2.240 -1.879 0.997 1.00 . A A . 15 CYS H 1 1
20 3825 1 1 15 CYS HA H 0.112 -2.274 1.233 1.00 . A A . 15 CYS HA 1 1
20 3826 1 1 15 CYS HB3 H 0.839 -4.994 0.092 1.00 . A A . 15 CYS HB3 1 1
20 3827 1 1 15 CYS N N 2.051 -2.845 1.188 1.00 . A A . 15 CYS N 1 1
20 3828 1 1 15 CYS O O 0.384 -5.132 2.719 1.00 . A A . 15 CYS O 1 1
20 3829 1 1 15 CYS SG S -1.480 -4.526 0.006 1.00 . A A . 15 CYS SG 1 1
20 3830 1 1 16 ASP C C -2.131 -4.788 4.145 1.00 . A A . 16 ASP C 1 1
20 3831 1 1 16 ASP CA C -1.169 -3.685 4.594 1.00 . A A . 16 ASP CA 1 1
20 3832 1 1 16 ASP CB C -1.939 -2.504 5.190 1.00 . A A . 16 ASP CB 1 1
20 3833 1 1 16 ASP CG C -3.059 -2.873 6.146 1.00 . A A . 16 ASP CG 1 1
20 3834 1 1 16 ASP H H -0.489 -2.169 3.294 1.00 . A A . 16 ASP H 1 1
20 3835 1 1 16 ASP HA H -0.496 -4.099 5.345 1.00 . A A . 16 ASP HA 1 1
20 3836 1 1 16 ASP HB3 H -2.418 -1.991 4.360 1.00 . A A . 16 ASP HB3 1 1
20 3837 1 1 16 ASP N N -0.402 -3.165 3.465 1.00 . A A . 16 ASP N 1 1
20 3838 1 1 16 ASP O O -2.870 -4.616 3.174 1.00 . A A . 16 ASP O 1 1
20 3839 1 1 16 ASP OD1 O -2.996 -3.993 6.696 1.00 . A A . 16 ASP OD1 1 1
20 3840 1 1 16 ASP OD2 O -3.959 -2.012 6.279 1.00 . A A . 16 ASP OD2 1 1
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