NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | subtype | item_count |
|
|
469794 |
1aj1   |
cing | 4-filtered-FRED | STAR | entry | full | 120 |
data_FRED_restraints_with_modified_coordinates_PDB_code_1aj1
# This FRED archive file contains, for PDB entry <1aj1>:
#
# - Coordinates and sequence information from the PDB mmCIF file
# - NMR restraints from the PDB MR file
#
# In this file, the coordinates and NMR restraints share the same atom names,
# and in this way can differ from the data deposited at the wwPDB. To achieve
# this aim, the NMR restraints were parsed from their original format files, and
# the coordinates and NMR restraints information were subsequently harmonized.
#
# Due to the complexity of this harmonization process and the filtering process
# used in creating these files, the NMR restraints information in these files
# may differ significantly from that in the originally deposited file. Other
# modifications could have occurred to the NMR restraints information, or data
# could have been lost because of parsing or conversion errors. The PDB file
# remains the authoritative reference for the atomic coordinates and the
# originally deposited restraints files remain the primary reference for these
# data.
#
# This file is generated at the BioMagResBank (BMRB) in collaboration with the
# PDBe (formerly MSD) group at the European Bioinformatics Institute (EBI) and
# the CMBI/IMM group at the Radboud University of Nijmegen.
#
# Several software packages were used to produce this file:
#
# - Wattos (BMRB and CMBI/IMM).
# - FormatConverter and NMRStarExport (PDBe).
# - CCPN framework (http://www.ccpn.ac.uk/).
#
# More information about this process can be found in the references below.
# Please cite the original reference for this PDB entry.
#
# JF Doreleijers, A Nederveen, W Vranken, J Lin, AM Bonvin, R Kaptein, JL
# Markley, and EL Ulrich (2005). BioMagResBank databases DOCR and FRED
# containing converted and filtered sets of experimental NMR restraints and
# coordinates from over 500 protein PDB structures. J. Biomol. NMR 32, 1-12.
#
# WF Vranken, W Boucher, TJ Stevens, RH Fogh, A Pajon, M Llinas, EL Ulrich, JL
# Markley, J Ionides, ED Laue (2005). The CCPN data model for NMR spectroscopy:
# development of a software pipeline. Proteins 59, 687-696.
#
# JF Doreleijers, WF Vranken, C Schulte, J Lin, JR Wedell, CJ Penkett, GW Vuister,
# G Vriend, JL Markley, and EL Ulrich (2009). The NMR Restraints Grid at BMRB for
# 5,266 Protein and Nucleic Acid PDB Entries. J Biomol. NMR 45, 389?396.
save_Conversion_project_for_entry_Name_1
_Study_list.Sf_category study_list
_Study_list.Entry_ID 1
_Study_list.ID 1
loop_
_Study.ID
_Study.Name
_Study.Type
_Study.Details
_Study.Entry_ID
_Study.Study_list_ID
1 "Conversion project for entry 1" NMR . 1 1
stop_
save_
save_originalConstraints_1
_Entry.Sf_category entry_information
_Entry.ID 1
_Entry.Title "Data for entry 1"
_Entry.NMR_STAR_version 3.1.0.8
_Entry.Experimental_method NMR
_Entry.Details .
save_
save_assembly_1aj1
_Assembly.Sf_category assembly
_Assembly.Entry_ID 1
_Assembly.ID 1
_Assembly.Name 1aj1
_Assembly.Number_of_components 1
_Assembly.Organic_ligands .
_Assembly.Metal_ions .
_Assembly.Paramagnetic .
_Assembly.Thiol_state "all other bound"
_Assembly.Molecular_mass 1874.23
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 $LANTIBIOTIC_ACTAGARDINE A . 1 1
stop_
save_
save_LANTIBIOTIC_ACTAGARDINE
_Entity.Sf_category entity
_Entity.Entry_ID 1
_Entity.ID 1
_Entity.Name "LANTIBIOTIC ACTAGARDINE"
_Entity.Type polymer
_Entity.Polymer_type polypeptide(L)
_Entity.Polymer_seq_one_letter_code XSGWVCXLXIECGXVICAC
_Entity.Number_of_monomers 19
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 DAL $DAL 1 1
2 SER . 1 1
3 GLY . 1 1
4 TRP . 1 1
5 VAL . 1 1
6 CYS . 1 1
7 ABA $ABA 1 1
8 LEU . 1 1
9 ABA $ABA 1 1
10 ILE . 1 1
11 GLU . 1 1
12 CYS . 1 1
13 GLY . 1 1
14 ABA $ABA 1 1
15 VAL . 1 1
16 ILE . 1 1
17 CYS . 1 1
18 ALA . 1 1
19 CYS . 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
DAL 1 1 1 1
SER 2 2 1 1
GLY 3 3 1 1
TRP 4 4 1 1
VAL 5 5 1 1
CYS 6 6 1 1
ABA 7 7 1 1
LEU 8 8 1 1
ABA 9 9 1 1
ILE 10 10 1 1
GLU 11 11 1 1
CYS 12 12 1 1
GLY 13 13 1 1
ABA 14 14 1 1
VAL 15 15 1 1
ILE 16 16 1 1
CYS 17 17 1 1
ALA 18 18 1 1
CYS 19 19 1 1
stop_
save_
save_ABA
_Chem_comp.Sf_category chem_comp
_Chem_comp.Entry_ID 1
_Chem_comp.ID ABA
_Chem_comp.Type non-polymer
save_
save_DAL
_Chem_comp.Sf_category chem_comp
_Chem_comp.Entry_ID 1
_Chem_comp.ID DAL
_Chem_comp.Type non-polymer
save_
save_Discover_distance_constraints_3_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
70 1 . . . 1 1
71 1 . . . 1 1
72 1 . . . 1 1
73 1 . . . 1 1
74 1 . . . 1 1
75 1 . . . 1 1
76 1 . . . 1 1
77 1 . . . 1 1
78 1 . . . 1 1
79 1 . . . 1 1
80 1 . . . 1 1
81 1 . . . 1 1
82 1 . . . 1 1
83 1 . . . 1 1
84 1 . . . 1 1
85 1 . . . 1 1
86 1 . . . 1 1
87 1 . . . 1 1
88 1 . . . 1 1
89 1 . . . 1 1
90 1 . . . 1 1
91 1 . . . 1 1
92 1 . . . 1 1
93 1 . . . 1 1
94 1 . . . 1 1
95 1 . . . 1 1
96 1 . . . 1 1
97 1 . . . 1 1
98 1 . . . 1 1
99 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 DAL HA 1 1 LAN HA 1 1
1 1 2 1 1 6 CYS HA 1 6 LAS HA 1 1
2 1 1 1 1 1 DAL HA 1 1 LAN HA 1 1
2 1 2 1 1 6 CYS QB 1 6 LAS HBR 1 1
3 1 1 1 1 1 DAL HB1 1 1 LAN HB* 1 1
3 1 2 1 1 2 SER H 1 2 SER HN 1 1
4 1 1 1 1 1 DAL HB1 1 1 LAN HB* 1 1
4 1 2 1 1 6 CYS HA 1 6 LAS HA 1 1
5 1 1 1 1 1 DAL HB1 1 1 LAN HB* 1 1
5 1 2 1 1 6 CYS QB 1 6 LAS HBR 1 1
6 1 1 1 1 2 SER H 1 2 SER HN 1 1
6 1 2 1 1 3 GLY H 1 3 GLY HN 1 1
7 1 1 1 1 2 SER H 1 2 SER HN 1 1
7 1 2 1 1 5 VAL H 1 5 VAL HN 1 1
8 1 1 1 1 2 SER H 1 2 SER HN 1 1
8 1 2 1 1 5 VAL QG 1 5 VAL HG* 1 1
9 1 1 1 1 2 SER H 1 2 SER HN 1 1
9 1 2 1 1 6 CYS H 1 6 LAS HN 1 1
10 1 1 1 1 2 SER HA 1 2 SER HA 1 1
10 1 2 1 1 3 GLY H 1 3 GLY HN 1 1
11 1 1 1 1 3 GLY QA 1 3 GLY HA* 1 1
11 1 2 1 1 4 TRP H 1 4 TRP HN 1 1
12 1 1 1 1 4 TRP H 1 4 TRP HN 1 1
12 1 2 1 1 4 TRP HB2 1 4 TRP HBR 1 1
13 1 1 1 1 4 TRP H 1 4 TRP HN 1 1
13 1 2 1 1 4 TRP HB3 1 4 TRP HBS 1 1
14 1 1 1 1 4 TRP H 1 4 TRP HN 1 1
14 1 2 1 1 5 VAL H 1 5 VAL HN 1 1
15 1 1 1 1 4 TRP HA 1 4 TRP HA 1 1
15 1 2 1 1 4 TRP HB2 1 4 TRP HBR 1 1
16 1 1 1 1 4 TRP HA 1 4 TRP HA 1 1
16 1 2 1 1 4 TRP HB3 1 4 TRP HBS 1 1
17 1 1 1 1 4 TRP HB2 1 4 TRP HBR 1 1
17 1 2 1 1 5 VAL H 1 5 VAL HN 1 1
18 1 1 1 1 4 TRP HB2 1 4 TRP HBR 1 1
18 1 2 1 1 5 VAL QG 1 5 VAL HG* 1 1
19 1 1 1 1 4 TRP HB2 1 4 TRP HBR 1 1
19 1 2 1 1 6 CYS QB 1 6 LAS HBR 1 1
20 1 1 1 1 4 TRP HB3 1 4 TRP HBS 1 1
20 1 2 1 1 5 VAL H 1 5 VAL HN 1 1
21 1 1 1 1 5 VAL H 1 5 VAL HN 1 1
21 1 2 1 1 5 VAL HA 1 5 VAL HA 1 1
22 1 1 1 1 5 VAL H 1 5 VAL HN 1 1
22 1 2 1 1 5 VAL HB 1 5 VAL HB 1 1
23 1 1 1 1 5 VAL H 1 5 VAL HN 1 1
23 1 2 1 1 5 VAL QG 1 5 VAL HG* 1 1
24 1 1 1 1 5 VAL H 1 5 VAL HN 1 1
24 1 2 1 1 6 CYS H 1 6 LAS HN 1 1
25 1 1 1 1 5 VAL HA 1 5 VAL HA 1 1
25 1 2 1 1 5 VAL HB 1 5 VAL HB 1 1
26 1 1 1 1 5 VAL HA 1 5 VAL HA 1 1
26 1 2 1 1 5 VAL QG 1 5 VAL HG* 1 1
27 1 1 1 1 5 VAL HA 1 5 VAL HA 1 1
27 1 2 1 1 6 CYS H 1 6 LAS HN 1 1
28 1 1 1 1 5 VAL HB 1 5 VAL HB 1 1
28 1 2 1 1 6 CYS H 1 6 LAS HN 1 1
29 1 1 1 1 5 VAL HB 1 5 VAL HB 1 1
29 1 2 1 1 6 CYS HA 1 6 LAS HA 1 1
30 1 1 1 1 5 VAL HB 1 5 VAL HB 1 1
30 1 2 1 1 6 CYS QB 1 6 LAS HBS 1 1
31 1 1 1 1 5 VAL QG 1 5 VAL HG* 1 1
31 1 2 1 1 6 CYS HA 1 6 LAS HA 1 1
32 1 1 1 1 6 CYS H 1 6 LAS HN 1 1
32 1 2 1 1 6 CYS HA 1 6 LAS HA 1 1
33 1 1 1 1 6 CYS H 1 6 LAS HN 1 1
33 1 2 1 1 6 CYS QB 1 6 LAS HBR 1 1
34 1 1 1 1 6 CYS H 1 6 LAS HN 1 1
34 1 2 1 1 12 CYS H 1 12 LAS HN 1 1
35 1 1 1 1 6 CYS HA 1 6 LAS HA 1 1
35 1 2 1 1 7 ABA HG1 1 7 MLA HG2* 1 1
36 1 1 1 1 6 CYS QB 1 6 LAS HBR 1 1
36 1 2 1 1 7 ABA HG1 1 7 MLA HG2* 1 1
37 1 1 1 1 7 ABA HG1 1 7 MLA HG2* 1 1
37 1 2 1 1 12 CYS HA 1 12 LAS HA 1 1
38 1 1 1 1 8 LEU H 1 8 LEU HN 1 1
38 1 2 1 1 8 LEU QB 1 8 LEU HB* 1 1
39 1 1 1 1 8 LEU H 1 8 LEU HN 1 1
39 1 2 1 1 10 ILE H 1 10 ILE HN 1 1
40 1 1 1 1 8 LEU HA 1 8 LEU HA 1 1
40 1 2 1 1 8 LEU QB 1 8 LEU HB* 1 1
41 1 1 1 1 8 LEU HA 1 8 LEU HA 1 1
41 1 2 1 1 8 LEU QD 1 8 LEU HD* 1 1
42 1 1 1 1 8 LEU HA 1 8 LEU HA 1 1
42 1 2 1 1 9 ABA HG1 1 9 MLA HG2* 1 1
43 1 1 1 1 9 ABA HG1 1 9 MLA HG2* 1 1
43 1 2 1 1 17 CYS HA 1 17 LAS HA 1 1
44 1 1 1 1 9 ABA HG1 1 9 MLA HG2* 1 1
44 1 2 1 1 17 CYS QB 1 17 LAS HB* 1 1
45 1 1 1 1 10 ILE H 1 10 ILE HN 1 1
45 1 2 1 1 10 ILE HA 1 10 ILE HA 1 1
46 1 1 1 1 10 ILE H 1 10 ILE HN 1 1
46 1 2 1 1 10 ILE HB 1 10 ILE HB 1 1
47 1 1 1 1 10 ILE H 1 10 ILE HN 1 1
47 1 2 1 1 10 ILE QG 1 10 ILE HG1* 1 1
48 1 1 1 1 10 ILE H 1 10 ILE HN 1 1
48 1 2 1 1 10 ILE MG 1 10 ILE HG2* 1 1
49 1 1 1 1 10 ILE H 1 10 ILE HN 1 1
49 1 2 1 1 11 GLU H 1 11 GLU HN 1 1
50 1 1 1 1 10 ILE HA 1 10 ILE HA 1 1
50 1 2 1 1 10 ILE QG 1 10 ILE HG1* 1 1
51 1 1 1 1 10 ILE HB 1 10 ILE HB 1 1
51 1 2 1 1 11 GLU H 1 11 GLU HN 1 1
52 1 1 1 1 10 ILE QG 1 10 ILE HG1* 1 1
52 1 2 1 1 11 GLU H 1 11 GLU HN 1 1
53 1 1 1 1 10 ILE MG 1 10 ILE HG2* 1 1
53 1 2 1 1 11 GLU H 1 11 GLU HN 1 1
54 1 1 1 1 10 ILE MG 1 10 ILE HG2* 1 1
54 1 2 1 1 17 CYS QB 1 17 LAS HB* 1 1
55 1 1 1 1 11 GLU H 1 11 GLU HN 1 1
55 1 2 1 1 11 GLU HB2 1 11 GLU HBR 1 1
56 1 1 1 1 11 GLU H 1 11 GLU HN 1 1
56 1 2 1 1 11 GLU HB3 1 11 GLU HBS 1 1
57 1 1 1 1 11 GLU H 1 11 GLU HN 1 1
57 1 2 1 1 11 GLU QG 1 11 GLU HG* 1 1
58 1 1 1 1 11 GLU H 1 11 GLU HN 1 1
58 1 2 1 1 12 CYS H 1 12 LAS HN 1 1
59 1 1 1 1 11 GLU H 1 11 GLU HN 1 1
59 1 2 1 1 19 CYS HA 1 19 LAS HA 1 1
60 1 1 1 1 11 GLU HA 1 11 GLU HA 1 1
60 1 2 1 1 11 GLU HB2 1 11 GLU HBR 1 1
61 1 1 1 1 11 GLU HA 1 11 GLU HA 1 1
61 1 2 1 1 11 GLU HB3 1 11 GLU HBS 1 1
62 1 1 1 1 11 GLU HA 1 11 GLU HA 1 1
62 1 2 1 1 11 GLU QG 1 11 GLU HG* 1 1
63 1 1 1 1 11 GLU HA 1 11 GLU HA 1 1
63 1 2 1 1 12 CYS H 1 12 LAS HN 1 1
64 1 1 1 1 11 GLU QG 1 11 GLU HG* 1 1
64 1 2 1 1 19 CYS HA 1 19 LAS HA 1 1
65 1 1 1 1 12 CYS H 1 12 LAS HN 1 1
65 1 2 1 1 12 CYS HA 1 12 LAS HA 1 1
66 1 1 1 1 12 CYS H 1 12 LAS HN 1 1
66 1 2 1 1 12 CYS QB 1 12 LAS HBR 1 1
67 1 1 1 1 12 CYS H 1 12 LAS HN 1 1
67 1 2 1 1 13 GLY H 1 13 GLY HN 1 1
68 1 1 1 1 12 CYS HA 1 12 LAS HA 1 1
68 1 2 1 1 12 CYS QB 1 12 LAS HBR 1 1
69 1 1 1 1 12 CYS QB 1 12 LAS HBS 1 1
69 1 2 1 1 13 GLY H 1 13 GLY HN 1 1
70 1 1 1 1 12 CYS QB 1 12 LAS HBR 1 1
70 1 2 1 1 16 ILE HB 1 16 ILE HB 1 1
71 1 1 1 1 12 CYS QB 1 12 LAS HBR 1 1
71 1 2 1 1 16 ILE MG 1 16 ILE HG2* 1 1
72 1 1 1 1 13 GLY H 1 13 GLY HN 1 1
72 1 2 1 1 14 ABA HG1 1 14 MLA HG2* 1 1
73 1 1 1 1 14 ABA HA 1 14 MLA HA 1 1
73 1 2 1 1 14 ABA HG1 1 14 MLA HG2* 1 1
74 1 1 1 1 14 ABA HA 1 14 MLA HA 1 1
74 1 2 1 1 15 VAL H 1 15 VAL HN 1 1
75 1 1 1 1 14 ABA HA 1 14 MLA HA 1 1
75 1 2 1 1 15 VAL QG 1 15 VAL HG* 1 1
76 1 1 1 1 14 ABA HG1 1 14 MLA HG2* 1 1
76 1 2 1 1 15 VAL H 1 15 VAL HN 1 1
77 1 1 1 1 14 ABA HG1 1 14 MLA HG2* 1 1
77 1 2 1 1 19 CYS HB2 1 19 LAS HBS 1 1
78 1 1 1 1 14 ABA HG1 1 14 MLA HG2* 1 1
78 1 2 1 1 19 CYS HB3 1 19 LAS HBR 1 1
79 1 1 1 1 15 VAL H 1 15 VAL HN 1 1
79 1 2 1 1 15 VAL HA 1 15 VAL HA 1 1
80 1 1 1 1 15 VAL H 1 15 VAL HN 1 1
80 1 2 1 1 15 VAL HB 1 15 VAL HB 1 1
81 1 1 1 1 15 VAL HA 1 15 VAL HA 1 1
81 1 2 1 1 15 VAL HB 1 15 VAL HB 1 1
82 1 1 1 1 15 VAL HA 1 15 VAL HA 1 1
82 1 2 1 1 16 ILE H 1 16 ILE HN 1 1
83 1 1 1 1 16 ILE H 1 16 ILE HN 1 1
83 1 2 1 1 16 ILE HB 1 16 ILE HB 1 1
84 1 1 1 1 16 ILE H 1 16 ILE HN 1 1
84 1 2 1 1 16 ILE QG 1 16 ILE HG1* 1 1
85 1 1 1 1 16 ILE H 1 16 ILE HN 1 1
85 1 2 1 1 17 CYS H 1 17 LAS HN 1 1
86 1 1 1 1 16 ILE HB 1 16 ILE HB 1 1
86 1 2 1 1 17 CYS H 1 17 LAS HN 1 1
87 1 1 1 1 16 ILE MG 1 16 ILE HG2* 1 1
87 1 2 1 1 17 CYS H 1 17 LAS HN 1 1
88 1 1 1 1 16 ILE MG 1 16 ILE HG2* 1 1
88 1 2 1 1 17 CYS HA 1 17 LAS HA 1 1
89 1 1 1 1 17 CYS H 1 17 LAS HN 1 1
89 1 2 1 1 17 CYS HA 1 17 LAS HA 1 1
90 1 1 1 1 17 CYS H 1 17 LAS HN 1 1
90 1 2 1 1 17 CYS QB 1 17 LAS HB* 1 1
91 1 1 1 1 17 CYS HA 1 17 LAS HA 1 1
91 1 2 1 1 18 ALA H 1 18 ALA HN 1 1
92 1 1 1 1 17 CYS HA 1 17 LAS HA 1 1
92 1 2 1 1 18 ALA MB 1 18 ALA HB* 1 1
93 1 1 1 1 17 CYS QB 1 17 LAS HB* 1 1
93 1 2 1 1 18 ALA H 1 18 ALA HN 1 1
94 1 1 1 1 17 CYS QB 1 17 LAS HB* 1 1
94 1 2 1 1 18 ALA MB 1 18 ALA HB* 1 1
95 1 1 1 1 18 ALA H 1 18 ALA HN 1 1
95 1 2 1 1 18 ALA HA 1 18 ALA HA 1 1
96 1 1 1 1 18 ALA H 1 18 ALA HN 1 1
96 1 2 1 1 18 ALA MB 1 18 ALA HB* 1 1
97 1 1 1 1 18 ALA HA 1 18 ALA HA 1 1
97 1 2 1 1 18 ALA MB 1 18 ALA HB* 1 1
98 1 1 1 1 18 ALA HA 1 18 ALA HA 1 1
98 1 2 1 1 19 CYS HA 1 19 LAS HA 1 1
99 1 1 1 1 19 CYS HA 1 19 LAS HA 1 1
99 1 2 1 1 19 CYS HB2 1 19 LAS HBS 1 1
stop_
loop_
_Dist_constraint_value.Constraint_ID
_Dist_constraint_value.Tree_node_ID
_Dist_constraint_value.Source_experiment_ID
_Dist_constraint_value.Spectral_peak_ID
_Dist_constraint_value.Intensity_val
_Dist_constraint_value.Intensity_lower_val_err
_Dist_constraint_value.Intensity_upper_val_err
_Dist_constraint_value.Distance_val
_Dist_constraint_value.Distance_lower_bound_val
_Dist_constraint_value.Distance_upper_bound_val
_Dist_constraint_value.Entry_ID
_Dist_constraint_value.Distance_constraint_list_ID
1 1 . . . . . 5.0 3.079 5.0 1 1
2 1 . . . . . 4.043 2.652 4.343 1 1
3 1 . . . . . 3.114 2.618 4.014 1 1
4 1 . . . . . 3.411 2.622 3.911 1 1
5 1 . . . . . 5.0 3.1 5.0 1 1
6 1 . . . . . 3.246 2.833 3.246 1 1
7 1 . . . . . 3.433 3.306 3.433 1 1
8 1 . . . . . 7.286 4.453 9.686 1 1
9 1 . . . . . 3.54 2.765 3.54 1 1
10 1 . . . . . 2.674 2.407 2.674 1 1
11 1 . . . . . 3.07 2.983 3.07 1 1
12 1 . . . . . 3.07 2.717 3.07 1 1
13 1 . . . . . . 3.131 4.605 1 1
14 1 . . . . . 2.778 2.453 2.778 1 1
15 1 . . . . . 2.682 2.44 2.882 1 1
16 1 . . . . . 2.642 2.571 2.642 1 1
17 1 . . . . . 4.211 3.487 4.211 1 1
18 1 . . . . . 4.95 2.384 7.35 1 1
19 1 . . . . . . 1.869 5.001 1 1
20 1 . . . . . 4.131 3.519 4.131 1 1
21 1 . . . . . 3.496 2.23 3.496 1 1
22 1 . . . . . 3.586 2.909 3.586 1 1
23 1 . . . . . 4.045 1.504 6.445 1 1
24 1 . . . . . 3.395 2.821 3.395 1 1
25 1 . . . . . 3.088 2.587 3.088 1 1
26 1 . . . . . 4.553 1.975 6.953 1 1
27 1 . . . . . 2.468 1.657 3.268 1 1
28 1 . . . . . 2.923 2.289 3.123 1 1
29 1 . . . . . 5.705 4.388 5.705 1 1
30 1 . . . . . 4.303 4.083 4.303 1 1
31 1 . . . . . 4.8 2.308 7.2 1 1
32 1 . . . . . 2.831 2.391 2.831 1 1
33 1 . . . . . . 3.111 3.249 1 1
34 1 . . . . . . 1.8 5.0 1 1
35 1 . . . . . 4.108 3.045 4.808 1 1
36 1 . . . . . . 3.938 4.022 1 1
37 1 . . . . . 2.895 1.7 3.395 1 1
38 1 . . . . . 8.655 3.4 6.0 1 1
39 1 . . . . . 3.196 3.147 3.196 1 1
40 1 . . . . . 2.635 2.026 3.135 1 1
41 1 . . . . . 3.927 2.323 5.827 1 1
42 1 . . . . . 4.045 2.784 4.545 1 1
43 1 . . . . . 4.022 2.717 4.522 1 1
44 1 . . . . . 5.0 3.2 5.5 1 1
45 1 . . . . . . 2.838 4.023 1 1
46 1 . . . . . 3.151 2.752 3.151 1 1
47 1 . . . . . 3.983 3.072 4.483 1 1
48 1 . . . . . 4.516 3.175 5.316 1 1
49 1 . . . . . 3.746 3.578 3.746 1 1
50 1 . . . . . 4.603 3.412 4.903 1 1
51 1 . . . . . 4.294 3.613 4.294 1 1
52 1 . . . . . 5.062 3.762 6.062 1 1
53 1 . . . . . 4.356 2.832 5.356 1 1
54 1 . . . . . 4.476 1.656 6.876 1 1
55 1 . . . . . 3.862 3.457 3.862 1 1
56 1 . . . . . 3.295 2.893 3.295 1 1
57 1 . . . . . 4.117 2.8 5.117 1 1
58 1 . . . . . 2.894 2.736 2.894 1 1
59 1 . . . . . 4.177 3.288 4.177 1 1
60 1 . . . . . 3.414 2.185 3.414 1 1
61 1 . . . . . 3.495 2.686 3.495 1 1
62 1 . . . . . 4.03 2.741 5.03 1 1
63 1 . . . . . 3.039 2.525 3.039 1 1
64 1 . . . . . 5.93 3.48 6.93 1 1
65 1 . . . . . 3.087 2.418 3.087 1 1
66 1 . . . . . . 2.472 2.635 1 1
67 1 . . . . . 2.269 2.192 2.269 1 1
68 1 . . . . . 2.765 2.453 2.765 1 1
69 1 . . . . . 5.0 3.012 5.0 1 1
70 1 . . . . . 3.457 3.404 4.429 1 1
71 1 . . . . . . 4.322 4.818 1 1
72 1 . . . . . 4.557 3.569 5.057 1 1
73 1 . . . . . . 2.2 4.2 1 1
74 1 . . . . . 3.068 2.602 3.068 1 1
75 1 . . . . . 5.409 2.367 7.809 1 1
76 1 . . . . . 5.56 3.768 6.06 1 1
77 1 . . . . . 2.786 2.068 3.286 1 1
78 1 . . . . . 3.275 2.47 3.775 1 1
79 1 . . . . . 3.397 2.875 3.397 1 1
80 1 . . . . . 2.979 2.591 2.979 1 1
81 1 . . . . . 3.426 2.29 3.326 1 1
82 1 . . . . . 3.439 2.977 3.439 1 1
83 1 . . . . . 2.631 2.28 2.631 1 1
84 1 . . . . . 3.024 2.624 3.924 1 1
85 1 . . . . . 2.879 2.783 2.879 1 1
86 1 . . . . . 3.035 2.62 3.035 1 1
87 1 . . . . . 4.57 2.798 5.57 1 1
88 1 . . . . . 5.951 4.027 6.951 1 1
89 1 . . . . . 3.229 2.827 3.229 1 1
90 1 . . . . . 3.06 2.592 3.06 1 1
91 1 . . . . . 2.532 2.145 2.532 1 1
92 1 . . . . . 5.0 3.821 6.0 1 1
93 1 . . . . . 2.737 2.414 2.737 1 1
94 1 . . . . . 5.0 3.52 6.0 1 1
95 1 . . . . . . 2.53 3.539 1 1
96 1 . . . . . 3.114 1.626 4.114 1 1
97 1 . . . . . 2.965 1.9 3.965 1 1
98 1 . . . . . 2.842 2.734 2.842 1 1
99 1 . . . . . 3.676 2.9 3.676 1 1
stop_
save_
save_Discover_dihedral_5
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID 1
_Torsion_angle_constraint_list.ID 1
_Torsion_angle_constraint_list.Constraint_file_ID .
_Torsion_angle_constraint_list.Block_ID .
loop_
_Torsion_angle_constraint.ID
_Torsion_angle_constraint.Torsion_angle_name
_Torsion_angle_constraint.Entity_assembly_ID_1
_Torsion_angle_constraint.Entity_ID_1
_Torsion_angle_constraint.Comp_index_ID_1
_Torsion_angle_constraint.Comp_ID_1
_Torsion_angle_constraint.Atom_ID_1
_Torsion_angle_constraint.Entity_assembly_ID_2
_Torsion_angle_constraint.Entity_ID_2
_Torsion_angle_constraint.Comp_index_ID_2
_Torsion_angle_constraint.Comp_ID_2
_Torsion_angle_constraint.Atom_ID_2
_Torsion_angle_constraint.Entity_assembly_ID_3
_Torsion_angle_constraint.Entity_ID_3
_Torsion_angle_constraint.Comp_index_ID_3
_Torsion_angle_constraint.Comp_ID_3
_Torsion_angle_constraint.Atom_ID_3
_Torsion_angle_constraint.Entity_assembly_ID_4
_Torsion_angle_constraint.Entity_ID_4
_Torsion_angle_constraint.Comp_index_ID_4
_Torsion_angle_constraint.Comp_ID_4
_Torsion_angle_constraint.Atom_ID_4
_Torsion_angle_constraint.Angle_lower_bound_val
_Torsion_angle_constraint.Angle_upper_bound_val
_Torsion_angle_constraint.Auth_asym_ID_1
_Torsion_angle_constraint.Auth_seq_ID_1
_Torsion_angle_constraint.Auth_comp_ID_1
_Torsion_angle_constraint.Auth_atom_ID_1
_Torsion_angle_constraint.Auth_asym_ID_2
_Torsion_angle_constraint.Auth_seq_ID_2
_Torsion_angle_constraint.Auth_comp_ID_2
_Torsion_angle_constraint.Auth_atom_ID_2
_Torsion_angle_constraint.Auth_asym_ID_3
_Torsion_angle_constraint.Auth_seq_ID_3
_Torsion_angle_constraint.Auth_comp_ID_3
_Torsion_angle_constraint.Auth_atom_ID_3
_Torsion_angle_constraint.Auth_asym_ID_4
_Torsion_angle_constraint.Auth_seq_ID_4
_Torsion_angle_constraint.Auth_comp_ID_4
_Torsion_angle_constraint.Auth_atom_ID_4
_Torsion_angle_constraint.Entry_ID
_Torsion_angle_constraint.Torsion_angle_constraint_list_ID
1 . 1 1 1 DAL C 1 1 2 SER N 1 1 2 SER CA 1 1 2 SER C -160.0 -80.0 1 1 LAN C 1 2 SER N 1 2 SER CA 1 2 SER C 1 1
2 . 1 1 3 GLY C 1 1 4 TRP N 1 1 4 TRP CA 1 1 4 TRP C -160.0 -80.0 1 3 GLY C 1 4 TRP N 1 4 TRP CA 1 4 TRP C 1 1
3 . 1 1 4 TRP C 1 1 5 VAL N 1 1 5 VAL CA 1 1 5 VAL C -160.0 -80.0 1 4 TRP C 1 5 VAL N 1 5 VAL CA 1 5 VAL C 1 1
4 . 1 1 6 CYS C 1 1 7 ABA N 1 1 7 ABA CA 1 1 7 ABA C 80.0 160.0 1 6 LAS C 1 7 MLA N 1 7 MLA CA 1 7 MLA C 1 1
5 . 1 1 7 ABA C 1 1 8 LEU N 1 1 8 LEU CA 1 1 8 LEU C -160.0 -80.0 1 7 MLA C 1 8 LEU N 1 8 LEU CA 1 8 LEU C 1 1
6 . 1 1 8 LEU C 1 1 9 ABA N 1 1 9 ABA CA 1 1 9 ABA C 80.0 160.0 1 8 LEU C 1 9 MLA N 1 9 MLA CA 1 9 MLA C 1 1
7 . 1 1 9 ABA C 1 1 10 ILE N 1 1 10 ILE CA 1 1 10 ILE C -160.0 -80.0 1 9 MLA C 1 10 ILE N 1 10 ILE CA 1 10 ILE C 1 1
8 . 1 1 11 GLU C 1 1 12 CYS N 1 1 12 CYS CA 1 1 12 CYS C -160.0 -80.0 1 11 GLU C 1 12 LAS N 1 12 LAS CA 1 12 LAS C 1 1
9 . 1 1 13 GLY C 1 1 14 ABA N 1 1 14 ABA CA 1 1 14 ABA C 80.0 160.0 1 13 GLY C 1 14 MLA N 1 14 MLA CA 1 14 MLA C 1 1
10 . 1 1 14 ABA C 1 1 15 VAL N 1 1 15 VAL CA 1 1 15 VAL C -160.0 -80.0 1 14 MLA C 1 15 VAL N 1 15 VAL CA 1 15 VAL C 1 1
11 . 1 1 15 VAL C 1 1 16 ILE N 1 1 16 ILE CA 1 1 16 ILE C -89.99999 -40.0 1 15 VAL C 1 16 ILE N 1 16 ILE CA 1 16 ILE C 1 1
12 . 1 1 16 ILE C 1 1 17 CYS N 1 1 17 CYS CA 1 1 17 CYS C -160.0 -80.0 1 16 ILE C 1 17 LAS N 1 17 LAS CA 1 17 LAS C 1 1
13 . 1 1 17 CYS C 1 1 18 ALA N 1 1 18 ALA CA 1 1 18 ALA C -89.99999 -40.0 1 17 LAS C 1 18 ALA N 1 18 ALA CA 1 18 ALA C 1 1
14 . 1 1 18 ALA C 1 1 19 CYS N 1 1 19 CYS CA 1 1 19 CYS C -160.0 -80.0 1 18 ALA C 1 19 LAS N 1 19 LAS CA 1 19 LAS C 1 1
15 . 1 1 4 TRP HA 1 1 4 TRP CA 1 1 4 TRP CB 1 1 4 TRP HB2 149.6 210.4 1 4 TRP HA 1 4 TRP CA 1 4 TRP CB 1 4 TRP HBR 1 1
16 . 1 1 12 CYS HA 1 1 12 CYS CA 1 1 12 CYS CB 1 1 12 CYS HB2 143.1 216.9 1 12 LAS HA 1 12 LAS CA 1 12 LAS CB 1 12 LAS HBS 1 1
17 . 1 1 19 CYS HA 1 1 19 CYS CA 1 1 19 CYS CB 1 1 19 CYS HB3 149.6 210.4 1 19 LAS HA 1 19 LAS CA 1 19 LAS CB 1 19 LAS HBR 1 1
18 . 1 1 6 CYS HA 1 1 6 CYS CA 1 1 6 CYS CB 1 1 6 CYS HB3 143.1 216.9 1 6 LAS HA 1 6 LAS CA 1 6 LAS CB 1 6 LAS HBR 1 1
19 . 1 1 7 ABA HA 1 1 7 ABA CA 1 1 7 ABA CB 1 1 7 ABA HB2 -120.0 120.0 1 7 MLA HA 1 7 MLA CA 1 7 MLA CB 1 7 MLA HB 1 1
20 . 1 1 9 ABA HA 1 1 9 ABA CA 1 1 9 ABA CB 1 1 9 ABA HB2 -120.0 120.0 1 9 MLA HA 1 9 MLA CA 1 9 MLA CB 1 9 MLA HB 1 1
21 . 1 1 14 ABA HA 1 1 14 ABA CA 1 1 14 ABA CB 1 1 14 ABA HB2 -120.0 120.0 1 14 MLA HA 1 14 MLA CA 1 14 MLA CB 1 14 MLA HB 1 1
stop_
save_
save_conformer_family_coord_set_1
_Conformer_family_coord_set.Sf_category conformer_family_coord_set
_Conformer_family_coord_set.Entry_ID 1
_Conformer_family_coord_set.ID 1
loop_
_Atom_site.Model_ID
_Atom_site.ID
_Atom_site.Label_entity_assembly_ID
_Atom_site.Label_entity_ID
_Atom_site.Label_comp_index_ID
_Atom_site.Label_comp_ID
_Atom_site.Label_atom_ID
_Atom_site.Type_symbol
_Atom_site.Cartn_x
_Atom_site.Cartn_y
_Atom_site.Cartn_z
_Atom_site.Occupancy
_Atom_site.Uncertainty
_Atom_site.PDBX_label_asym_ID
_Atom_site.PDB_strand_ID
_Atom_site.PDB_ins_code
_Atom_site.PDB_residue_no
_Atom_site.PDB_residue_name
_Atom_site.PDB_atom_name
_Atom_site.Entry_ID
_Atom_site.Conformer_family_coord_set_ID
1 1 1 1 1 DAL C C -6.112 0.108 1.483 1.00 . A A . 1 DAL C 1 1
1 2 1 1 1 DAL CA C -5.229 -1.130 1.844 1.00 . A A . 1 DAL CA 1 1
1 3 1 1 1 DAL CB C -3.708 -0.916 1.681 1.00 . A A . 1 DAL CB 1 1
1 4 1 1 1 DAL H1 H -5.244 -0.895 3.900 1.00 . A A . 1 DAL H1 1 1
1 5 1 1 1 DAL H2 H -6.479 -1.812 3.346 1.00 . A A . 1 DAL H2 1 1
1 6 1 1 1 DAL HA H -5.523 -1.944 1.155 1.00 . A A . 1 DAL HA 1 1
1 7 1 1 1 DAL HB1 H -3.332 -0.155 2.390 1.00 . A A . 1 DAL HB1 1 1
1 8 1 1 1 DAL HB2 H -3.493 -0.528 0.674 1.00 . A A . 1 DAL HB2 1 1
1 9 1 1 1 DAL N N -5.479 -1.624 3.217 1.00 . A A . 1 DAL N 1 1
1 10 1 1 1 DAL O O -6.973 0.547 2.255 1.00 . A A . 1 DAL O 1 1
1 11 1 1 2 SER C C -7.845 0.365 -1.352 1.00 . A A . 2 SER C 1 1
1 12 1 1 2 SER CA C -7.021 1.368 -0.478 1.00 . A A . 2 SER CA 1 1
1 13 1 1 2 SER CB C -6.344 2.499 -1.285 1.00 . A A . 2 SER CB 1 1
1 14 1 1 2 SER H H -5.187 0.189 -0.282 1.00 . A A . 2 SER H 1 1
1 15 1 1 2 SER HA H -7.695 1.871 0.245 1.00 . A A . 2 SER HA 1 1
1 16 1 1 2 SER HB2 H -5.722 3.133 -0.625 1.00 . A A . 2 SER HB2 1 1
1 17 1 1 2 SER HB3 H -5.660 2.092 -2.054 1.00 . A A . 2 SER HB3 1 1
1 18 1 1 2 SER HG H -6.826 4.000 -2.386 1.00 . A A . 2 SER HG 1 1
1 19 1 1 2 SER N N -5.963 0.601 0.235 1.00 . A A . 2 SER N 1 1
1 20 1 1 2 SER O O -7.699 0.286 -2.577 1.00 . A A . 2 SER O 1 1
1 21 1 1 2 SER OG O -7.317 3.323 -1.914 1.00 . A A . 2 SER OG 1 1
1 22 1 1 3 GLY C C -8.308 -2.869 -0.829 1.00 . A A . 3 GLY C 1 1
1 23 1 1 3 GLY CA C -9.240 -1.692 -1.211 1.00 . A A . 3 GLY CA 1 1
1 24 1 1 3 GLY H H -8.437 -0.384 0.343 1.00 . A A . 3 GLY H 1 1
1 25 1 1 3 GLY HA2 H -10.236 -1.839 -0.743 1.00 . A A . 3 GLY HA2 1 1
1 26 1 1 3 GLY HA3 H -9.446 -1.611 -2.295 1.00 . A A . 3 GLY HA3 1 1
1 27 1 1 3 GLY N N -8.665 -0.442 -0.657 1.00 . A A . 3 GLY N 1 1
1 28 1 1 3 GLY O O -8.118 -3.098 0.371 1.00 . A A . 3 GLY O 1 1
1 29 1 1 4 TRP C C -5.496 -4.117 -2.825 1.00 . A A . 4 TRP C 1 1
1 30 1 1 4 TRP CA C -6.374 -4.259 -1.544 1.00 . A A . 4 TRP CA 1 1
1 31 1 1 4 TRP CB C -6.490 -5.740 -1.111 1.00 . A A . 4 TRP CB 1 1
1 32 1 1 4 TRP CD1 C -8.557 -6.538 0.291 1.00 . A A . 4 TRP CD1 1 1
1 33 1 1 4 TRP CD2 C -6.813 -5.859 1.496 1.00 . A A . 4 TRP CD2 1 1
1 34 1 1 4 TRP CE2 C -7.873 -6.226 2.363 1.00 . A A . 4 TRP CE2 1 1
1 35 1 1 4 TRP CE3 C -5.594 -5.365 2.022 1.00 . A A . 4 TRP CE3 1 1
1 36 1 1 4 TRP CG C -7.238 -6.046 0.192 1.00 . A A . 4 TRP CG 1 1
1 37 1 1 4 TRP CH2 C -6.507 -5.612 4.265 1.00 . A A . 4 TRP CH2 1 1
1 38 1 1 4 TRP CZ2 C -7.717 -6.099 3.767 1.00 . A A . 4 TRP CZ2 1 1
1 39 1 1 4 TRP CZ3 C -5.461 -5.253 3.406 1.00 . A A . 4 TRP CZ3 1 1
1 40 1 1 4 TRP H H -7.895 -3.370 -2.781 1.00 . A A . 4 TRP H 1 1
1 41 1 1 4 TRP HA H -5.855 -3.748 -0.715 1.00 . A A . 4 TRP HA 1 1
1 42 1 1 4 TRP HB2 H -6.961 -6.234 -1.955 1.00 . A A . 4 TRP HB2 1 1
1 43 1 1 4 TRP HB3 H -5.486 -6.209 -1.045 1.00 . A A . 4 TRP HB3 1 1
1 44 1 1 4 TRP HD1 H -9.188 -6.770 -0.554 1.00 . A A . 4 TRP HD1 1 1
1 45 1 1 4 TRP HE1 H -9.885 -6.971 1.975 1.00 . A A . 4 TRP HE1 1 1
1 46 1 1 4 TRP HE3 H -4.786 -5.078 1.369 1.00 . A A . 4 TRP HE3 1 1
1 47 1 1 4 TRP HH2 H -6.376 -5.509 5.332 1.00 . A A . 4 TRP HH2 1 1
1 48 1 1 4 TRP HZ2 H -8.513 -6.366 4.447 1.00 . A A . 4 TRP HZ2 1 1
1 49 1 1 4 TRP HZ3 H -4.538 -4.875 3.820 1.00 . A A . 4 TRP HZ3 1 1
1 50 1 1 4 TRP N N -7.666 -3.563 -1.800 1.00 . A A . 4 TRP N 1 1
1 51 1 1 4 TRP NE1 N -8.971 -6.657 1.631 1.00 . A A . 4 TRP NE1 1 1
1 52 1 1 4 TRP O O -5.273 -5.055 -3.598 1.00 . A A . 4 TRP O 1 1
1 53 1 1 5 VAL C C -2.506 -3.134 -2.989 1.00 . A A . 5 VAL C 1 1
1 54 1 1 5 VAL CA C -3.730 -2.637 -3.815 1.00 . A A . 5 VAL CA 1 1
1 55 1 1 5 VAL CB C -3.688 -1.185 -4.427 1.00 . A A . 5 VAL CB 1 1
1 56 1 1 5 VAL CG1 C -2.437 -0.958 -5.308 1.00 . A A . 5 VAL CG1 1 1
1 57 1 1 5 VAL CG2 C -4.938 -0.850 -5.275 1.00 . A A . 5 VAL CG2 1 1
1 58 1 1 5 VAL H H -5.356 -2.269 -2.300 1.00 . A A . 5 VAL H 1 1
1 59 1 1 5 VAL HA H -3.756 -3.301 -4.682 1.00 . A A . 5 VAL HA 1 1
1 60 1 1 5 VAL HB H -3.648 -0.422 -3.628 1.00 . A A . 5 VAL HB 1 1
1 61 1 1 5 VAL HG11 H -1.503 -1.101 -4.736 1.00 . A A . 5 VAL HG11 1 1
1 62 1 1 5 VAL HG12 H -2.400 -1.652 -6.168 1.00 . A A . 5 VAL HG12 1 1
1 63 1 1 5 VAL HG13 H -2.398 0.071 -5.712 1.00 . A A . 5 VAL HG13 1 1
1 64 1 1 5 VAL HG21 H -5.065 -1.548 -6.124 1.00 . A A . 5 VAL HG21 1 1
1 65 1 1 5 VAL HG22 H -5.865 -0.896 -4.673 1.00 . A A . 5 VAL HG22 1 1
1 66 1 1 5 VAL HG23 H -4.891 0.173 -5.693 1.00 . A A . 5 VAL HG23 1 1
1 67 1 1 5 VAL N N -4.935 -2.910 -2.969 1.00 . A A . 5 VAL N 1 1
1 68 1 1 5 VAL O O -2.035 -4.249 -3.227 1.00 . A A . 5 VAL O 1 1
1 69 1 1 6 CYS C C -0.555 -3.984 -0.604 1.00 . A A . 6 CYS C 1 1
1 70 1 1 6 CYS CA C -1.662 -2.884 -0.648 1.00 . A A . 6 CYS CA 1 1
1 71 1 1 6 CYS CB C -2.844 -3.251 0.276 1.00 . A A . 6 CYS CB 1 1
1 72 1 1 6 CYS H H -2.510 -1.431 -2.035 1.00 . A A . 6 CYS H 1 1
1 73 1 1 6 CYS HA H -1.296 -1.961 -0.169 1.00 . A A . 6 CYS HA 1 1
1 74 1 1 6 CYS HB2 H -3.815 -3.014 -0.179 1.00 . A A . 6 CYS HB2 1 1
1 75 1 1 6 CYS HB3 H -2.841 -4.334 0.431 1.00 . A A . 6 CYS HB3 1 1
1 76 1 1 6 CYS N N -2.101 -2.365 -1.969 1.00 . A A . 6 CYS N 1 1
1 77 1 1 6 CYS O O -0.710 -5.139 -1.009 1.00 . A A . 6 CYS O 1 1
1 78 1 1 6 CYS SG S -2.770 -2.453 1.904 1.00 . A A . 6 CYS SG 1 1
1 79 1 1 7 ABA C C 2.688 -4.993 0.220 1.00 . A A . 7 ABA C 1 1
1 80 1 1 7 ABA CA C 1.376 -4.454 0.879 1.00 . A A . 7 ABA CA 1 1
1 81 1 1 7 ABA CB C 1.654 -3.558 2.132 1.00 . A A . 7 ABA CB 1 1
1 82 1 1 7 ABA CG C 0.409 -3.428 3.048 1.00 . A A . 7 ABA CG 1 1
1 83 1 1 7 ABA H H 0.203 -2.704 0.503 1.00 . A A . 7 ABA H 1 1
1 84 1 1 7 ABA HA H 0.809 -5.349 1.205 1.00 . A A . 7 ABA HA 1 1
1 85 1 1 7 ABA HB2 H 2.444 -4.014 2.759 1.00 . A A . 7 ABA HB2 1 1
1 86 1 1 7 ABA HG1 H 0.614 -2.867 3.973 1.00 . A A . 7 ABA HG1 1 1
1 87 1 1 7 ABA HG2 H -0.422 -2.918 2.534 1.00 . A A . 7 ABA HG2 1 1
1 88 1 1 7 ABA HG3 H 0.014 -4.421 3.338 1.00 . A A . 7 ABA HG3 1 1
1 89 1 1 7 ABA N N 0.509 -3.571 0.056 1.00 . A A . 7 ABA N 1 1
1 90 1 1 7 ABA O O 3.618 -5.345 0.954 1.00 . A A . 7 ABA O 1 1
1 91 1 1 8 LEU C C 4.592 -4.270 -2.615 1.00 . A A . 8 LEU C 1 1
1 92 1 1 8 LEU CA C 4.037 -5.490 -1.825 1.00 . A A . 8 LEU CA 1 1
1 93 1 1 8 LEU CB C 3.844 -6.767 -2.702 1.00 . A A . 8 LEU CB 1 1
1 94 1 1 8 LEU CD1 C 3.095 -9.183 -3.006 1.00 . A A . 8 LEU CD1 1 1
1 95 1 1 8 LEU CD2 C 4.494 -8.594 -0.988 1.00 . A A . 8 LEU CD2 1 1
1 96 1 1 8 LEU CG C 3.428 -8.082 -1.980 1.00 . A A . 8 LEU CG 1 1
1 97 1 1 8 LEU H H 1.981 -4.675 -1.620 1.00 . A A . 8 LEU H 1 1
1 98 1 1 8 LEU HA H 4.837 -5.734 -1.095 1.00 . A A . 8 LEU HA 1 1
1 99 1 1 8 LEU HB2 H 3.104 -6.542 -3.496 1.00 . A A . 8 LEU HB2 1 1
1 100 1 1 8 LEU HB3 H 4.784 -6.963 -3.257 1.00 . A A . 8 LEU HB3 1 1
1 101 1 1 8 LEU HD11 H 2.287 -8.868 -3.693 1.00 . A A . 8 LEU HD11 1 1
1 102 1 1 8 LEU HD12 H 3.969 -9.451 -3.629 1.00 . A A . 8 LEU HD12 1 1
1 103 1 1 8 LEU HD13 H 2.746 -10.110 -2.513 1.00 . A A . 8 LEU HD13 1 1
1 104 1 1 8 LEU HD21 H 5.463 -8.793 -1.485 1.00 . A A . 8 LEU HD21 1 1
1 105 1 1 8 LEU HD22 H 4.684 -7.866 -0.179 1.00 . A A . 8 LEU HD22 1 1
1 106 1 1 8 LEU HD23 H 4.177 -9.532 -0.496 1.00 . A A . 8 LEU HD23 1 1
1 107 1 1 8 LEU HG H 2.503 -7.888 -1.407 1.00 . A A . 8 LEU HG 1 1
1 108 1 1 8 LEU N N 2.768 -5.110 -1.124 1.00 . A A . 8 LEU N 1 1
1 109 1 1 8 LEU O O 4.700 -4.274 -3.846 1.00 . A A . 8 LEU O 1 1
1 110 1 1 9 ABA C C 4.806 -0.965 -3.147 1.00 . A A . 9 ABA C 1 1
1 111 1 1 9 ABA CA C 5.670 -2.024 -2.385 1.00 . A A . 9 ABA CA 1 1
1 112 1 1 9 ABA CB C 6.472 -1.389 -1.202 1.00 . A A . 9 ABA CB 1 1
1 113 1 1 9 ABA CG C 7.700 -2.224 -0.792 1.00 . A A . 9 ABA CG 1 1
1 114 1 1 9 ABA H H 4.768 -3.330 -0.857 1.00 . A A . 9 ABA H 1 1
1 115 1 1 9 ABA HA H 6.415 -2.367 -3.130 1.00 . A A . 9 ABA HA 1 1
1 116 1 1 9 ABA HB2 H 6.851 -0.393 -1.497 1.00 . A A . 9 ABA HB2 1 1
1 117 1 1 9 ABA HG1 H 7.408 -3.228 -0.427 1.00 . A A . 9 ABA HG1 1 1
1 118 1 1 9 ABA HG2 H 8.262 -1.735 0.024 1.00 . A A . 9 ABA HG2 1 1
1 119 1 1 9 ABA HG3 H 8.397 -2.373 -1.637 1.00 . A A . 9 ABA HG3 1 1
1 120 1 1 9 ABA N N 4.965 -3.222 -1.857 1.00 . A A . 9 ABA N 1 1
1 121 1 1 9 ABA O O 5.407 -0.057 -3.726 1.00 . A A . 9 ABA O 1 1
1 122 1 1 10 ILE C C 1.322 0.048 -3.046 1.00 . A A . 10 ILE C 1 1
1 123 1 1 10 ILE CA C 2.579 -0.135 -3.949 1.00 . A A . 10 ILE CA 1 1
1 124 1 1 10 ILE CB C 2.182 -0.646 -5.385 1.00 . A A . 10 ILE CB 1 1
1 125 1 1 10 ILE CD1 C 4.277 0.028 -6.868 1.00 . A A . 10 ILE CD1 1 1
1 126 1 1 10 ILE CG1 C 3.349 -1.075 -6.327 1.00 . A A . 10 ILE CG1 1 1
1 127 1 1 10 ILE CG2 C 1.243 0.342 -6.127 1.00 . A A . 10 ILE CG2 1 1
1 128 1 1 10 ILE H H 3.064 -1.811 -2.602 1.00 . A A . 10 ILE H 1 1
1 129 1 1 10 ILE HA H 3.096 0.839 -4.073 1.00 . A A . 10 ILE HA 1 1
1 130 1 1 10 ILE HB H 1.587 -1.563 -5.225 1.00 . A A . 10 ILE HB 1 1
1 131 1 1 10 ILE HD11 H 4.736 0.621 -6.060 1.00 . A A . 10 ILE HD11 1 1
1 132 1 1 10 ILE HD12 H 5.100 -0.404 -7.465 1.00 . A A . 10 ILE HD12 1 1
1 133 1 1 10 ILE HD13 H 3.737 0.733 -7.527 1.00 . A A . 10 ILE HD13 1 1
1 134 1 1 10 ILE HG12 H 3.969 -1.837 -5.821 1.00 . A A . 10 ILE HG12 1 1
1 135 1 1 10 ILE HG13 H 2.925 -1.614 -7.195 1.00 . A A . 10 ILE HG13 1 1
1 136 1 1 10 ILE HG21 H 0.304 0.517 -5.570 1.00 . A A . 10 ILE HG21 1 1
1 137 1 1 10 ILE HG22 H 1.717 1.331 -6.272 1.00 . A A . 10 ILE HG22 1 1
1 138 1 1 10 ILE HG23 H 0.948 -0.037 -7.123 1.00 . A A . 10 ILE HG23 1 1
1 139 1 1 10 ILE N N 3.458 -1.071 -3.193 1.00 . A A . 10 ILE N 1 1
1 140 1 1 10 ILE O O 0.497 -0.863 -2.914 1.00 . A A . 10 ILE O 1 1
1 141 1 1 11 GLU C C -0.423 0.811 -0.519 1.00 . A A . 11 GLU C 1 1
1 142 1 1 11 GLU CA C -0.053 1.714 -1.750 1.00 . A A . 11 GLU CA 1 1
1 143 1 1 11 GLU CB C -1.184 2.056 -2.789 1.00 . A A . 11 GLU CB 1 1
1 144 1 1 11 GLU CD C -2.713 3.497 -1.268 1.00 . A A . 11 GLU CD 1 1
1 145 1 1 11 GLU CG C -2.614 2.369 -2.302 1.00 . A A . 11 GLU CG 1 1
1 146 1 1 11 GLU H H 2.015 1.832 -2.545 1.00 . A A . 11 GLU H 1 1
1 147 1 1 11 GLU HA H 0.206 2.698 -1.314 1.00 . A A . 11 GLU HA 1 1
1 148 1 1 11 GLU HB2 H -0.923 2.930 -3.422 1.00 . A A . 11 GLU HB2 1 1
1 149 1 1 11 GLU HB3 H -1.228 1.219 -3.504 1.00 . A A . 11 GLU HB3 1 1
1 150 1 1 11 GLU HE2 H -2.777 5.441 -1.201 1.00 . A A . 11 GLU HE2 1 1
1 151 1 1 11 GLU HG2 H -3.229 2.631 -3.181 1.00 . A A . 11 GLU HG2 1 1
1 152 1 1 11 GLU HG3 H -3.088 1.457 -1.901 1.00 . A A . 11 GLU HG3 1 1
1 153 1 1 11 GLU N N 1.170 1.259 -2.480 1.00 . A A . 11 GLU N 1 1
1 154 1 1 11 GLU O O -1.563 0.376 -0.380 1.00 . A A . 11 GLU O 1 1
1 155 1 1 11 GLU OE1 O -2.781 3.298 -0.055 1.00 . A A . 11 GLU OE1 1 1
1 156 1 1 11 GLU OE2 O -2.716 4.737 -1.852 1.00 . A A . 11 GLU OE2 1 1
1 157 1 1 12 CYS C C -0.409 0.890 2.782 1.00 . A A . 12 CYS C 1 1
1 158 1 1 12 CYS CA C 0.278 -0.042 1.735 1.00 . A A . 12 CYS CA 1 1
1 159 1 1 12 CYS CB C 1.611 -0.545 2.356 1.00 . A A . 12 CYS CB 1 1
1 160 1 1 12 CYS H H 1.375 1.132 0.224 1.00 . A A . 12 CYS H 1 1
1 161 1 1 12 CYS HA H -0.377 -0.918 1.590 1.00 . A A . 12 CYS HA 1 1
1 162 1 1 12 CYS HB2 H 2.362 0.264 2.302 1.00 . A A . 12 CYS HB2 1 1
1 163 1 1 12 CYS HB3 H 1.514 -0.793 3.430 1.00 . A A . 12 CYS HB3 1 1
1 164 1 1 12 CYS N N 0.531 0.597 0.407 1.00 . A A . 12 CYS N 1 1
1 165 1 1 12 CYS O O -1.098 0.372 3.667 1.00 . A A . 12 CYS O 1 1
1 166 1 1 12 CYS SG S 2.347 -1.968 1.509 1.00 . A A . 12 CYS SG 1 1
1 167 1 1 13 GLY C C -0.825 4.650 3.352 1.00 . A A . 13 GLY C 1 1
1 168 1 1 13 GLY CA C -0.712 3.159 3.740 1.00 . A A . 13 GLY CA 1 1
1 169 1 1 13 GLY H H 0.387 2.496 1.914 1.00 . A A . 13 GLY H 1 1
1 170 1 1 13 GLY HA2 H -1.708 2.826 4.091 1.00 . A A . 13 GLY HA2 1 1
1 171 1 1 13 GLY HA3 H -0.059 3.087 4.631 1.00 . A A . 13 GLY HA3 1 1
1 172 1 1 13 GLY N N -0.206 2.220 2.710 1.00 . A A . 13 GLY N 1 1
1 173 1 1 13 GLY O O -1.770 5.303 3.801 1.00 . A A . 13 GLY O 1 1
1 174 1 1 14 ABA C C 1.866 7.095 2.676 1.00 . A A . 14 ABA C 1 1
1 175 1 1 14 ABA CA C 0.356 6.686 2.492 1.00 . A A . 14 ABA CA 1 1
1 176 1 1 14 ABA CB C -0.327 7.337 1.231 1.00 . A A . 14 ABA CB 1 1
1 177 1 1 14 ABA CG C -1.707 6.794 0.822 1.00 . A A . 14 ABA CG 1 1
1 178 1 1 14 ABA H H 0.875 4.563 2.291 1.00 . A A . 14 ABA H 1 1
1 179 1 1 14 ABA HA H -0.142 7.160 3.361 1.00 . A A . 14 ABA HA 1 1
1 180 1 1 14 ABA HB2 H -0.492 8.397 1.500 1.00 . A A . 14 ABA HB2 1 1
1 181 1 1 14 ABA HG1 H -1.641 5.735 0.514 1.00 . A A . 14 ABA HG1 1 1
1 182 1 1 14 ABA HG2 H -2.124 7.358 -0.029 1.00 . A A . 14 ABA HG2 1 1
1 183 1 1 14 ABA HG3 H -2.427 6.850 1.658 1.00 . A A . 14 ABA HG3 1 1
1 184 1 1 14 ABA N N 0.144 5.207 2.599 1.00 . A A . 14 ABA N 1 1
1 185 1 1 14 ABA O O 2.265 8.173 2.222 1.00 . A A . 14 ABA O 1 1
1 186 1 1 15 VAL C C 5.137 5.443 3.615 1.00 . A A . 15 VAL C 1 1
1 187 1 1 15 VAL CA C 4.104 6.618 3.748 1.00 . A A . 15 VAL CA 1 1
1 188 1 1 15 VAL CB C 4.110 7.333 5.145 1.00 . A A . 15 VAL CB 1 1
1 189 1 1 15 VAL CG1 C 3.868 6.423 6.372 1.00 . A A . 15 VAL CG1 1 1
1 190 1 1 15 VAL CG2 C 5.374 8.192 5.368 1.00 . A A . 15 VAL CG2 1 1
1 191 1 1 15 VAL H H 2.213 5.480 3.801 1.00 . A A . 15 VAL H 1 1
1 192 1 1 15 VAL HA H 4.458 7.352 3.004 1.00 . A A . 15 VAL HA 1 1
1 193 1 1 15 VAL HB H 3.260 8.041 5.133 1.00 . A A . 15 VAL HB 1 1
1 194 1 1 15 VAL HG11 H 2.952 5.814 6.255 1.00 . A A . 15 VAL HG11 1 1
1 195 1 1 15 VAL HG12 H 4.708 5.723 6.540 1.00 . A A . 15 VAL HG12 1 1
1 196 1 1 15 VAL HG13 H 3.744 7.012 7.300 1.00 . A A . 15 VAL HG13 1 1
1 197 1 1 15 VAL HG21 H 5.522 8.918 4.547 1.00 . A A . 15 VAL HG21 1 1
1 198 1 1 15 VAL HG22 H 5.311 8.779 6.304 1.00 . A A . 15 VAL HG22 1 1
1 199 1 1 15 VAL HG23 H 6.290 7.575 5.430 1.00 . A A . 15 VAL HG23 1 1
1 200 1 1 15 VAL N N 2.694 6.281 3.381 1.00 . A A . 15 VAL N 1 1
1 201 1 1 15 VAL O O 6.293 5.706 3.272 1.00 . A A . 15 VAL O 1 1
1 202 1 1 16 ILE C C 6.170 2.499 2.660 1.00 . A A . 16 ILE C 1 1
1 203 1 1 16 ILE CA C 5.704 3.031 4.058 1.00 . A A . 16 ILE CA 1 1
1 204 1 1 16 ILE CB C 5.104 1.973 5.068 1.00 . A A . 16 ILE CB 1 1
1 205 1 1 16 ILE CD1 C 6.276 2.866 7.274 1.00 . A A . 16 ILE CD1 1 1
1 206 1 1 16 ILE CG1 C 4.979 2.479 6.540 1.00 . A A . 16 ILE CG1 1 1
1 207 1 1 16 ILE CG2 C 5.784 0.579 5.047 1.00 . A A . 16 ILE CG2 1 1
1 208 1 1 16 ILE H H 3.753 4.099 4.103 1.00 . A A . 16 ILE H 1 1
1 209 1 1 16 ILE HA H 6.627 3.413 4.535 1.00 . A A . 16 ILE HA 1 1
1 210 1 1 16 ILE HB H 4.061 1.778 4.762 1.00 . A A . 16 ILE HB 1 1
1 211 1 1 16 ILE HD11 H 6.993 2.026 7.318 1.00 . A A . 16 ILE HD11 1 1
1 212 1 1 16 ILE HD12 H 6.786 3.719 6.791 1.00 . A A . 16 ILE HD12 1 1
1 213 1 1 16 ILE HD13 H 6.063 3.167 8.315 1.00 . A A . 16 ILE HD13 1 1
1 214 1 1 16 ILE HG12 H 4.295 3.347 6.566 1.00 . A A . 16 ILE HG12 1 1
1 215 1 1 16 ILE HG13 H 4.457 1.712 7.143 1.00 . A A . 16 ILE HG13 1 1
1 216 1 1 16 ILE HG21 H 6.861 0.633 5.288 1.00 . A A . 16 ILE HG21 1 1
1 217 1 1 16 ILE HG22 H 5.316 -0.121 5.766 1.00 . A A . 16 ILE HG22 1 1
1 218 1 1 16 ILE HG23 H 5.695 0.094 4.057 1.00 . A A . 16 ILE HG23 1 1
1 219 1 1 16 ILE N N 4.756 4.184 3.916 1.00 . A A . 16 ILE N 1 1
1 220 1 1 16 ILE O O 7.356 2.617 2.338 1.00 . A A . 16 ILE O 1 1
1 221 1 1 17 CYS C C 5.471 2.810 -0.521 1.00 . A A . 17 CYS C 1 1
1 222 1 1 17 CYS CA C 5.539 1.567 0.423 1.00 . A A . 17 CYS CA 1 1
1 223 1 1 17 CYS CB C 4.594 0.368 0.102 1.00 . A A . 17 CYS CB 1 1
1 224 1 1 17 CYS H H 4.293 1.986 2.191 1.00 . A A . 17 CYS H 1 1
1 225 1 1 17 CYS HA H 6.568 1.191 0.302 1.00 . A A . 17 CYS HA 1 1
1 226 1 1 17 CYS HB2 H 3.696 0.336 0.740 1.00 . A A . 17 CYS HB2 1 1
1 227 1 1 17 CYS HB3 H 4.163 0.404 -0.906 1.00 . A A . 17 CYS HB3 1 1
1 228 1 1 17 CYS N N 5.255 1.947 1.838 1.00 . A A . 17 CYS N 1 1
1 229 1 1 17 CYS O O 5.563 3.960 -0.077 1.00 . A A . 17 CYS O 1 1
1 230 1 1 17 CYS SG S 5.461 -1.207 0.304 1.00 . A A . 17 CYS SG 1 1
1 231 1 1 18 ALA C C 3.320 3.778 -2.806 1.00 . A A . 18 ALA C 1 1
1 232 1 1 18 ALA CA C 4.862 3.623 -2.796 1.00 . A A . 18 ALA CA 1 1
1 233 1 1 18 ALA CB C 5.475 3.347 -4.182 1.00 . A A . 18 ALA CB 1 1
1 234 1 1 18 ALA H H 5.404 1.577 -2.053 1.00 . A A . 18 ALA H 1 1
1 235 1 1 18 ALA HA H 5.198 4.642 -2.500 1.00 . A A . 18 ALA HA 1 1
1 236 1 1 18 ALA HB1 H 6.580 3.299 -4.145 1.00 . A A . 18 ALA HB1 1 1
1 237 1 1 18 ALA HB2 H 5.115 2.395 -4.613 1.00 . A A . 18 ALA HB2 1 1
1 238 1 1 18 ALA HB3 H 5.216 4.144 -4.903 1.00 . A A . 18 ALA HB3 1 1
1 239 1 1 18 ALA N N 5.336 2.578 -1.836 1.00 . A A . 18 ALA N 1 1
1 240 1 1 18 ALA O O 2.633 3.688 -3.828 1.00 . A A . 18 ALA O 1 1
1 241 1 1 19 CYS C C 3.475 6.372 -0.718 1.00 . A A . 19 CYS C 1 1
1 242 1 1 19 CYS CA C 2.394 5.631 -1.532 1.00 . A A . 19 CYS CA 1 1
1 243 1 1 19 CYS CB C 1.006 5.731 -0.818 1.00 . A A . 19 CYS CB 1 1
1 244 1 1 19 CYS H H 3.441 3.939 -0.896 1.00 . A A . 19 CYS H 1 1
1 245 1 1 19 CYS HXT H 4.733 7.878 -0.880 1.00 . A A . 19 CYS HXT 1 1
1 246 1 1 19 CYS HA H 2.474 6.084 -2.545 1.00 . A A . 19 CYS HA 1 1
1 247 1 1 19 CYS HB2 H 0.119 5.381 -1.399 1.00 . A A . 19 CYS HB2 1 1
1 248 1 1 19 CYS HB3 H 1.004 5.087 0.079 1.00 . A A . 19 CYS HB3 1 1
1 249 1 1 19 CYS N N 2.806 4.224 -1.649 1.00 . A A . 19 CYS N 1 1
1 250 1 1 19 CYS O O 3.807 6.080 0.430 1.00 . A A . 19 CYS O 1 1
1 251 1 1 19 CYS OXT O 4.072 7.456 -1.433 1.00 . A A . 19 CYS OXT 1 1
1 252 1 1 19 CYS SG S 0.719 7.431 -0.260 1.00 . A A . 19 CYS SG 1 1
2 253 1 1 1 DAL C C -6.041 -0.270 1.718 1.00 . A A . 1 DAL C 1 1
2 254 1 1 1 DAL CA C -5.063 -1.411 2.147 1.00 . A A . 1 DAL CA 1 1
2 255 1 1 1 DAL CB C -3.565 -1.098 1.937 1.00 . A A . 1 DAL CB 1 1
2 256 1 1 1 DAL H1 H -4.663 -2.638 3.765 1.00 . A A . 1 DAL H1 1 1
2 257 1 1 1 DAL H2 H -6.219 -2.142 3.701 1.00 . A A . 1 DAL H2 1 1
2 258 1 1 1 DAL HA H -5.308 -2.290 1.521 1.00 . A A . 1 DAL HA 1 1
2 259 1 1 1 DAL HB1 H -3.213 -0.299 2.618 1.00 . A A . 1 DAL HB1 1 1
2 260 1 1 1 DAL HB2 H -3.402 -0.723 0.915 1.00 . A A . 1 DAL HB2 1 1
2 261 1 1 1 DAL N N -5.254 -1.827 3.555 1.00 . A A . 1 DAL N 1 1
2 262 1 1 1 DAL O O -6.921 0.162 2.471 1.00 . A A . 1 DAL O 1 1
2 263 1 1 2 SER C C -7.803 -0.245 -1.133 1.00 . A A . 2 SER C 1 1
2 264 1 1 2 SER CA C -7.028 0.830 -0.304 1.00 . A A . 2 SER CA 1 1
2 265 1 1 2 SER CB C -6.424 1.948 -1.185 1.00 . A A . 2 SER CB 1 1
2 266 1 1 2 SER H H -5.139 -0.258 -0.059 1.00 . A A . 2 SER H 1 1
2 267 1 1 2 SER HA H -7.729 1.332 0.394 1.00 . A A . 2 SER HA 1 1
2 268 1 1 2 SER HB2 H -5.686 1.536 -1.899 1.00 . A A . 2 SER HB2 1 1
2 269 1 1 2 SER HB3 H -7.213 2.417 -1.802 1.00 . A A . 2 SER HB3 1 1
2 270 1 1 2 SER HG H -5.109 2.521 0.098 1.00 . A A . 2 SER HG 1 1
2 271 1 1 2 SER N N -5.935 0.141 0.437 1.00 . A A . 2 SER N 1 1
2 272 1 1 2 SER O O -7.658 -0.367 -2.355 1.00 . A A . 2 SER O 1 1
2 273 1 1 2 SER OG O -5.807 2.959 -0.395 1.00 . A A . 2 SER OG 1 1
2 274 1 1 3 GLY C C -8.038 -3.465 -0.517 1.00 . A A . 3 GLY C 1 1
2 275 1 1 3 GLY CA C -9.067 -2.375 -0.906 1.00 . A A . 3 GLY CA 1 1
2 276 1 1 3 GLY H H -8.356 -0.953 0.593 1.00 . A A . 3 GLY H 1 1
2 277 1 1 3 GLY HA2 H -10.037 -2.584 -0.410 1.00 . A A . 3 GLY HA2 1 1
2 278 1 1 3 GLY HA3 H -9.305 -2.343 -1.987 1.00 . A A . 3 GLY HA3 1 1
2 279 1 1 3 GLY N N -8.577 -1.068 -0.404 1.00 . A A . 3 GLY N 1 1
2 280 1 1 3 GLY O O -7.808 -3.645 0.683 1.00 . A A . 3 GLY O 1 1
2 281 1 1 4 TRP C C -5.170 -4.602 -2.526 1.00 . A A . 4 TRP C 1 1
2 282 1 1 4 TRP CA C -6.031 -4.751 -1.232 1.00 . A A . 4 TRP CA 1 1
2 283 1 1 4 TRP CB C -6.069 -6.225 -0.761 1.00 . A A . 4 TRP CB 1 1
2 284 1 1 4 TRP CD1 C -8.060 -7.123 0.689 1.00 . A A . 4 TRP CD1 1 1
2 285 1 1 4 TRP CD2 C -6.365 -6.273 1.853 1.00 . A A . 4 TRP CD2 1 1
2 286 1 1 4 TRP CE2 C -7.391 -6.684 2.742 1.00 . A A . 4 TRP CE2 1 1
2 287 1 1 4 TRP CE3 C -5.186 -5.666 2.350 1.00 . A A . 4 TRP CE3 1 1
2 288 1 1 4 TRP CG C -6.782 -6.540 0.560 1.00 . A A . 4 TRP CG 1 1
2 289 1 1 4 TRP CH2 C -6.069 -5.888 4.608 1.00 . A A . 4 TRP CH2 1 1
2 290 1 1 4 TRP CZ2 C -7.240 -6.487 4.138 1.00 . A A . 4 TRP CZ2 1 1
2 291 1 1 4 TRP CZ3 C -5.057 -5.485 3.727 1.00 . A A . 4 TRP CZ3 1 1
2 292 1 1 4 TRP H H -7.620 -3.974 -2.466 1.00 . A A . 4 TRP H 1 1
2 293 1 1 4 TRP HA H -5.529 -4.193 -0.425 1.00 . A A . 4 TRP HA 1 1
2 294 1 1 4 TRP HB2 H -6.530 -6.761 -1.586 1.00 . A A . 4 TRP HB2 1 1
2 295 1 1 4 TRP HB3 H -5.042 -6.640 -0.701 1.00 . A A . 4 TRP HB3 1 1
2 296 1 1 4 TRP HD1 H -8.678 -7.431 -0.142 1.00 . A A . 4 TRP HD1 1 1
2 297 1 1 4 TRP HE1 H -9.345 -7.588 2.398 1.00 . A A . 4 TRP HE1 1 1
2 298 1 1 4 TRP HE3 H -4.405 -5.344 1.680 1.00 . A A . 4 TRP HE3 1 1
2 299 1 1 4 TRP HH2 H -5.942 -5.730 5.669 1.00 . A A . 4 TRP HH2 1 1
2 300 1 1 4 TRP HZ2 H -8.011 -6.784 4.834 1.00 . A A . 4 TRP HZ2 1 1
2 301 1 1 4 TRP HZ3 H -4.165 -5.020 4.119 1.00 . A A . 4 TRP HZ3 1 1
2 302 1 1 4 TRP N N -7.363 -4.132 -1.486 1.00 . A A . 4 TRP N 1 1
2 303 1 1 4 TRP NE1 N -8.457 -7.223 2.035 1.00 . A A . 4 TRP NE1 1 1
2 304 1 1 4 TRP O O -4.887 -5.555 -3.260 1.00 . A A . 4 TRP O 1 1
2 305 1 1 5 VAL C C -2.250 -3.403 -2.749 1.00 . A A . 5 VAL C 1 1
2 306 1 1 5 VAL CA C -3.511 -3.056 -3.592 1.00 . A A . 5 VAL CA 1 1
2 307 1 1 5 VAL CB C -3.568 -1.653 -4.302 1.00 . A A . 5 VAL CB 1 1
2 308 1 1 5 VAL CG1 C -2.343 -1.416 -5.217 1.00 . A A . 5 VAL CG1 1 1
2 309 1 1 5 VAL CG2 C -4.847 -1.448 -5.149 1.00 . A A . 5 VAL CG2 1 1
2 310 1 1 5 VAL H H -5.138 -2.727 -2.074 1.00 . A A . 5 VAL H 1 1
2 311 1 1 5 VAL HA H -3.484 -3.772 -4.413 1.00 . A A . 5 VAL HA 1 1
2 312 1 1 5 VAL HB H -3.570 -0.846 -3.548 1.00 . A A . 5 VAL HB 1 1
2 313 1 1 5 VAL HG11 H -2.268 -2.175 -6.018 1.00 . A A . 5 VAL HG11 1 1
2 314 1 1 5 VAL HG12 H -2.376 -0.425 -5.706 1.00 . A A . 5 VAL HG12 1 1
2 315 1 1 5 VAL HG13 H -1.395 -1.449 -4.649 1.00 . A A . 5 VAL HG13 1 1
2 316 1 1 5 VAL HG21 H -4.941 -2.206 -5.949 1.00 . A A . 5 VAL HG21 1 1
2 317 1 1 5 VAL HG22 H -5.761 -1.510 -4.531 1.00 . A A . 5 VAL HG22 1 1
2 318 1 1 5 VAL HG23 H -4.865 -0.453 -5.632 1.00 . A A . 5 VAL HG23 1 1
2 319 1 1 5 VAL N N -4.695 -3.366 -2.731 1.00 . A A . 5 VAL N 1 1
2 320 1 1 5 VAL O O -1.671 -4.470 -2.963 1.00 . A A . 5 VAL O 1 1
2 321 1 1 6 CYS C C -0.316 -4.065 -0.322 1.00 . A A . 6 CYS C 1 1
2 322 1 1 6 CYS CA C -1.445 -2.993 -0.410 1.00 . A A . 6 CYS CA 1 1
2 323 1 1 6 CYS CB C -2.611 -3.380 0.532 1.00 . A A . 6 CYS CB 1 1
2 324 1 1 6 CYS H H -2.367 -1.655 -1.865 1.00 . A A . 6 CYS H 1 1
2 325 1 1 6 CYS HA H -1.094 -2.033 0.017 1.00 . A A . 6 CYS HA 1 1
2 326 1 1 6 CYS HB2 H -3.596 -3.171 0.090 1.00 . A A . 6 CYS HB2 1 1
2 327 1 1 6 CYS HB3 H -2.583 -4.462 0.710 1.00 . A A . 6 CYS HB3 1 1
2 328 1 1 6 CYS N N -1.919 -2.565 -1.753 1.00 . A A . 6 CYS N 1 1
2 329 1 1 6 CYS O O -0.436 -5.230 -0.710 1.00 . A A . 6 CYS O 1 1
2 330 1 1 6 CYS SG S -2.529 -2.568 2.152 1.00 . A A . 6 CYS SG 1 1
2 331 1 1 7 ABA C C 2.957 -4.940 0.417 1.00 . A A . 7 ABA C 1 1
2 332 1 1 7 ABA CA C 1.638 -4.504 1.137 1.00 . A A . 7 ABA CA 1 1
2 333 1 1 7 ABA CB C 1.887 -3.664 2.430 1.00 . A A . 7 ABA CB 1 1
2 334 1 1 7 ABA CG C 0.645 -3.620 3.358 1.00 . A A . 7 ABA CG 1 1
2 335 1 1 7 ABA H H 0.397 -2.766 0.812 1.00 . A A . 7 ABA H 1 1
2 336 1 1 7 ABA HA H 1.120 -5.441 1.425 1.00 . A A . 7 ABA HA 1 1
2 337 1 1 7 ABA HB2 H 2.703 -4.113 3.029 1.00 . A A . 7 ABA HB2 1 1
2 338 1 1 7 ABA HG1 H 0.841 -3.100 4.308 1.00 . A A . 7 ABA HG1 1 1
2 339 1 1 7 ABA HG2 H -0.206 -3.111 2.876 1.00 . A A . 7 ABA HG2 1 1
2 340 1 1 7 ABA HG3 H 0.286 -4.639 3.601 1.00 . A A . 7 ABA HG3 1 1
2 341 1 1 7 ABA N N 0.722 -3.625 0.360 1.00 . A A . 7 ABA N 1 1
2 342 1 1 7 ABA O O 3.983 -5.125 1.082 1.00 . A A . 7 ABA O 1 1
2 343 1 1 8 LEU C C 4.842 -4.336 -2.420 1.00 . A A . 8 LEU C 1 1
2 344 1 1 8 LEU CA C 4.139 -5.536 -1.713 1.00 . A A . 8 LEU CA 1 1
2 345 1 1 8 LEU CB C 3.775 -6.733 -2.648 1.00 . A A . 8 LEU CB 1 1
2 346 1 1 8 LEU CD1 C 2.865 -7.783 -4.781 1.00 . A A . 8 LEU CD1 1 1
2 347 1 1 8 LEU CD2 C 1.424 -6.085 -3.607 1.00 . A A . 8 LEU CD2 1 1
2 348 1 1 8 LEU CG C 2.877 -6.512 -3.909 1.00 . A A . 8 LEU CG 1 1
2 349 1 1 8 LEU H H 2.102 -4.768 -1.382 1.00 . A A . 8 LEU H 1 1
2 350 1 1 8 LEU HA H 4.927 -5.915 -1.028 1.00 . A A . 8 LEU HA 1 1
2 351 1 1 8 LEU HB2 H 4.739 -7.154 -2.995 1.00 . A A . 8 LEU HB2 1 1
2 352 1 1 8 LEU HB3 H 3.343 -7.550 -2.037 1.00 . A A . 8 LEU HB3 1 1
2 353 1 1 8 LEU HD11 H 3.886 -8.080 -5.085 1.00 . A A . 8 LEU HD11 1 1
2 354 1 1 8 LEU HD12 H 2.417 -8.647 -4.253 1.00 . A A . 8 LEU HD12 1 1
2 355 1 1 8 LEU HD13 H 2.290 -7.636 -5.715 1.00 . A A . 8 LEU HD13 1 1
2 356 1 1 8 LEU HD21 H 0.913 -6.794 -2.929 1.00 . A A . 8 LEU HD21 1 1
2 357 1 1 8 LEU HD22 H 1.379 -5.086 -3.137 1.00 . A A . 8 LEU HD22 1 1
2 358 1 1 8 LEU HD23 H 0.815 -6.013 -4.528 1.00 . A A . 8 LEU HD23 1 1
2 359 1 1 8 LEU HG H 3.328 -5.713 -4.525 1.00 . A A . 8 LEU HG 1 1
2 360 1 1 8 LEU N N 2.931 -5.157 -0.916 1.00 . A A . 8 LEU N 1 1
2 361 1 1 8 LEU O O 5.313 -4.444 -3.557 1.00 . A A . 8 LEU O 1 1
2 362 1 1 9 ABA C C 4.775 -0.962 -2.946 1.00 . A A . 9 ABA C 1 1
2 363 1 1 9 ABA CA C 5.662 -1.989 -2.169 1.00 . A A . 9 ABA CA 1 1
2 364 1 1 9 ABA CB C 6.422 -1.369 -0.954 1.00 . A A . 9 ABA CB 1 1
2 365 1 1 9 ABA CG C 7.631 -2.224 -0.520 1.00 . A A . 9 ABA CG 1 1
2 366 1 1 9 ABA H H 4.554 -3.262 -0.759 1.00 . A A . 9 ABA H 1 1
2 367 1 1 9 ABA HA H 6.442 -2.285 -2.900 1.00 . A A . 9 ABA HA 1 1
2 368 1 1 9 ABA HB2 H 6.809 -0.371 -1.229 1.00 . A A . 9 ABA HB2 1 1
2 369 1 1 9 ABA HG1 H 7.313 -3.227 -0.174 1.00 . A A . 9 ABA HG1 1 1
2 370 1 1 9 ABA HG2 H 8.176 -1.755 0.316 1.00 . A A . 9 ABA HG2 1 1
2 371 1 1 9 ABA HG3 H 8.344 -2.379 -1.349 1.00 . A A . 9 ABA HG3 1 1
2 372 1 1 9 ABA N N 4.971 -3.213 -1.695 1.00 . A A . 9 ABA N 1 1
2 373 1 1 9 ABA O O 5.361 -0.088 -3.591 1.00 . A A . 9 ABA O 1 1
2 374 1 1 10 ILE C C 1.322 0.105 -2.687 1.00 . A A . 10 ILE C 1 1
2 375 1 1 10 ILE CA C 2.534 -0.090 -3.645 1.00 . A A . 10 ILE CA 1 1
2 376 1 1 10 ILE CB C 2.054 -0.533 -5.086 1.00 . A A . 10 ILE CB 1 1
2 377 1 1 10 ILE CD1 C 3.350 -2.657 -5.892 1.00 . A A . 10 ILE CD1 1 1
2 378 1 1 10 ILE CG1 C 3.103 -1.151 -6.069 1.00 . A A . 10 ILE CG1 1 1
2 379 1 1 10 ILE CG2 C 1.367 0.660 -5.801 1.00 . A A . 10 ILE CG2 1 1
2 380 1 1 10 ILE H H 3.025 -1.797 -2.355 1.00 . A A . 10 ILE H 1 1
2 381 1 1 10 ILE HA H 3.068 0.883 -3.731 1.00 . A A . 10 ILE HA 1 1
2 382 1 1 10 ILE HB H 1.269 -1.302 -4.951 1.00 . A A . 10 ILE HB 1 1
2 383 1 1 10 ILE HD11 H 2.422 -3.241 -6.036 1.00 . A A . 10 ILE HD11 1 1
2 384 1 1 10 ILE HD12 H 4.087 -3.029 -6.626 1.00 . A A . 10 ILE HD12 1 1
2 385 1 1 10 ILE HD13 H 3.739 -2.906 -4.892 1.00 . A A . 10 ILE HD13 1 1
2 386 1 1 10 ILE HG12 H 2.774 -1.036 -7.123 1.00 . A A . 10 ILE HG12 1 1
2 387 1 1 10 ILE HG13 H 4.063 -0.605 -6.022 1.00 . A A . 10 ILE HG13 1 1
2 388 1 1 10 ILE HG21 H 0.536 1.081 -5.205 1.00 . A A . 10 ILE HG21 1 1
2 389 1 1 10 ILE HG22 H 2.076 1.487 -5.998 1.00 . A A . 10 ILE HG22 1 1
2 390 1 1 10 ILE HG23 H 0.928 0.364 -6.772 1.00 . A A . 10 ILE HG23 1 1
2 391 1 1 10 ILE N N 3.421 -1.050 -2.937 1.00 . A A . 10 ILE N 1 1
2 392 1 1 10 ILE O O 0.473 -0.782 -2.552 1.00 . A A . 10 ILE O 1 1
2 393 1 1 11 GLU C C -0.345 0.790 -0.079 1.00 . A A . 11 GLU C 1 1
2 394 1 1 11 GLU CA C 0.103 1.757 -1.228 1.00 . A A . 11 GLU CA 1 1
2 395 1 1 11 GLU CB C -0.997 2.419 -2.128 1.00 . A A . 11 GLU CB 1 1
2 396 1 1 11 GLU CD C -2.941 2.245 -3.795 1.00 . A A . 11 GLU CD 1 1
2 397 1 1 11 GLU CG C -1.971 1.490 -2.881 1.00 . A A . 11 GLU CG 1 1
2 398 1 1 11 GLU H H 2.073 1.887 -2.158 1.00 . A A . 11 GLU H 1 1
2 399 1 1 11 GLU HA H 0.514 2.624 -0.660 1.00 . A A . 11 GLU HA 1 1
2 400 1 1 11 GLU HB2 H -1.581 3.100 -1.484 1.00 . A A . 11 GLU HB2 1 1
2 401 1 1 11 GLU HB3 H -0.544 3.087 -2.900 1.00 . A A . 11 GLU HB3 1 1
2 402 1 1 11 GLU HE2 H -4.462 3.453 -3.667 1.00 . A A . 11 GLU HE2 1 1
2 403 1 1 11 GLU HG2 H -1.394 0.779 -3.496 1.00 . A A . 11 GLU HG2 1 1
2 404 1 1 11 GLU HG3 H -2.553 0.877 -2.171 1.00 . A A . 11 GLU HG3 1 1
2 405 1 1 11 GLU N N 1.246 1.291 -2.057 1.00 . A A . 11 GLU N 1 1
2 406 1 1 11 GLU O O -1.524 0.474 0.064 1.00 . A A . 11 GLU O 1 1
2 407 1 1 11 GLU OE1 O -2.896 2.189 -5.023 1.00 . A A . 11 GLU OE1 1 1
2 408 1 1 11 GLU OE2 O -3.857 2.982 -3.089 1.00 . A A . 11 GLU OE2 1 1
2 409 1 1 12 CYS C C -0.249 0.807 3.181 1.00 . A A . 12 CYS C 1 1
2 410 1 1 12 CYS CA C 0.359 -0.179 2.131 1.00 . A A . 12 CYS CA 1 1
2 411 1 1 12 CYS CB C 1.703 -0.678 2.744 1.00 . A A . 12 CYS CB 1 1
2 412 1 1 12 CYS H H 1.529 0.813 0.557 1.00 . A A . 12 CYS H 1 1
2 413 1 1 12 CYS HA H -0.324 -1.038 2.011 1.00 . A A . 12 CYS HA 1 1
2 414 1 1 12 CYS HB2 H 2.450 0.139 2.727 1.00 . A A . 12 CYS HB2 1 1
2 415 1 1 12 CYS HB3 H 1.602 -0.967 3.808 1.00 . A A . 12 CYS HB3 1 1
2 416 1 1 12 CYS N N 0.617 0.437 0.798 1.00 . A A . 12 CYS N 1 1
2 417 1 1 12 CYS O O -0.919 0.341 4.108 1.00 . A A . 12 CYS O 1 1
2 418 1 1 12 CYS SG S 2.508 -2.032 1.860 1.00 . A A . 12 CYS SG 1 1
2 419 1 1 13 GLY C C -0.618 4.573 3.614 1.00 . A A . 13 GLY C 1 1
2 420 1 1 13 GLY CA C -0.395 3.119 4.081 1.00 . A A . 13 GLY CA 1 1
2 421 1 1 13 GLY H H 0.533 2.344 2.196 1.00 . A A . 13 GLY H 1 1
2 422 1 1 13 GLY HA2 H -1.316 2.786 4.598 1.00 . A A . 13 GLY HA2 1 1
2 423 1 1 13 GLY HA3 H 0.381 3.128 4.869 1.00 . A A . 13 GLY HA3 1 1
2 424 1 1 13 GLY N N -0.001 2.127 3.053 1.00 . A A . 13 GLY N 1 1
2 425 1 1 13 GLY O O -1.558 5.208 4.099 1.00 . A A . 13 GLY O 1 1
2 426 1 1 14 ABA C C 1.946 7.063 2.743 1.00 . A A . 14 ABA C 1 1
2 427 1 1 14 ABA CA C 0.440 6.615 2.628 1.00 . A A . 14 ABA CA 1 1
2 428 1 1 14 ABA CB C -0.331 7.247 1.408 1.00 . A A . 14 ABA CB 1 1
2 429 1 1 14 ABA CG C -1.701 6.645 1.041 1.00 . A A . 14 ABA CG 1 1
2 430 1 1 14 ABA H H 0.972 4.489 2.394 1.00 . A A . 14 ABA H 1 1
2 431 1 1 14 ABA HA H -0.023 7.086 3.518 1.00 . A A . 14 ABA HA 1 1
2 432 1 1 14 ABA HB2 H -0.534 8.295 1.698 1.00 . A A . 14 ABA HB2 1 1
2 433 1 1 14 ABA HG1 H -1.604 5.596 0.702 1.00 . A A . 14 ABA HG1 1 1
2 434 1 1 14 ABA HG2 H -2.176 7.209 0.219 1.00 . A A . 14 ABA HG2 1 1
2 435 1 1 14 ABA HG3 H -2.391 6.652 1.903 1.00 . A A . 14 ABA HG3 1 1
2 436 1 1 14 ABA N N 0.266 5.131 2.762 1.00 . A A . 14 ABA N 1 1
2 437 1 1 14 ABA O O 2.305 8.138 2.251 1.00 . A A . 14 ABA O 1 1
2 438 1 1 15 VAL C C 5.202 5.437 3.518 1.00 . A A . 15 VAL C 1 1
2 439 1 1 15 VAL CA C 4.237 6.654 3.742 1.00 . A A . 15 VAL CA 1 1
2 440 1 1 15 VAL CB C 4.405 7.307 5.169 1.00 . A A . 15 VAL CB 1 1
2 441 1 1 15 VAL CG1 C 5.863 7.714 5.500 1.00 . A A . 15 VAL CG1 1 1
2 442 1 1 15 VAL CG2 C 3.523 8.558 5.407 1.00 . A A . 15 VAL CG2 1 1
2 443 1 1 15 VAL H H 2.407 5.402 3.766 1.00 . A A . 15 VAL H 1 1
2 444 1 1 15 VAL HA H 4.560 7.400 3.001 1.00 . A A . 15 VAL HA 1 1
2 445 1 1 15 VAL HB H 4.104 6.555 5.923 1.00 . A A . 15 VAL HB 1 1
2 446 1 1 15 VAL HG11 H 6.261 8.453 4.779 1.00 . A A . 15 VAL HG11 1 1
2 447 1 1 15 VAL HG12 H 5.953 8.157 6.510 1.00 . A A . 15 VAL HG12 1 1
2 448 1 1 15 VAL HG13 H 6.547 6.846 5.487 1.00 . A A . 15 VAL HG13 1 1
2 449 1 1 15 VAL HG21 H 3.733 9.359 4.674 1.00 . A A . 15 VAL HG21 1 1
2 450 1 1 15 VAL HG22 H 2.445 8.323 5.332 1.00 . A A . 15 VAL HG22 1 1
2 451 1 1 15 VAL HG23 H 3.671 8.987 6.416 1.00 . A A . 15 VAL HG23 1 1
2 452 1 1 15 VAL N N 2.813 6.290 3.449 1.00 . A A . 15 VAL N 1 1
2 453 1 1 15 VAL O O 6.256 5.611 2.901 1.00 . A A . 15 VAL O 1 1
2 454 1 1 16 ILE C C 6.231 2.479 2.824 1.00 . A A . 16 ILE C 1 1
2 455 1 1 16 ILE CA C 5.824 3.089 4.207 1.00 . A A . 16 ILE CA 1 1
2 456 1 1 16 ILE CB C 5.240 2.080 5.276 1.00 . A A . 16 ILE CB 1 1
2 457 1 1 16 ILE CD1 C 6.536 2.982 7.406 1.00 . A A . 16 ILE CD1 1 1
2 458 1 1 16 ILE CG1 C 5.194 2.643 6.732 1.00 . A A . 16 ILE CG1 1 1
2 459 1 1 16 ILE CG2 C 5.871 0.662 5.277 1.00 . A A . 16 ILE CG2 1 1
2 460 1 1 16 ILE H H 3.920 4.223 4.415 1.00 . A A . 16 ILE H 1 1
2 461 1 1 16 ILE HA H 6.767 3.485 4.631 1.00 . A A . 16 ILE HA 1 1
2 462 1 1 16 ILE HB H 4.180 1.904 5.014 1.00 . A A . 16 ILE HB 1 1
2 463 1 1 16 ILE HD11 H 7.205 2.104 7.462 1.00 . A A . 16 ILE HD11 1 1
2 464 1 1 16 ILE HD12 H 7.078 3.784 6.872 1.00 . A A . 16 ILE HD12 1 1
2 465 1 1 16 ILE HD13 H 6.379 3.336 8.441 1.00 . A A . 16 ILE HD13 1 1
2 466 1 1 16 ILE HG12 H 4.562 3.550 6.752 1.00 . A A . 16 ILE HG12 1 1
2 467 1 1 16 ILE HG13 H 4.654 1.927 7.380 1.00 . A A . 16 ILE HG13 1 1
2 468 1 1 16 ILE HG21 H 6.959 0.684 5.466 1.00 . A A . 16 ILE HG21 1 1
2 469 1 1 16 ILE HG22 H 5.412 0.005 6.040 1.00 . A A . 16 ILE HG22 1 1
2 470 1 1 16 ILE HG23 H 5.719 0.145 4.310 1.00 . A A . 16 ILE HG23 1 1
2 471 1 1 16 ILE N N 4.883 4.248 4.070 1.00 . A A . 16 ILE N 1 1
2 472 1 1 16 ILE O O 7.415 2.505 2.476 1.00 . A A . 16 ILE O 1 1
2 473 1 1 17 CYS C C 5.370 2.792 -0.329 1.00 . A A . 17 CYS C 1 1
2 474 1 1 17 CYS CA C 5.475 1.562 0.628 1.00 . A A . 17 CYS CA 1 1
2 475 1 1 17 CYS CB C 4.513 0.364 0.365 1.00 . A A . 17 CYS CB 1 1
2 476 1 1 17 CYS H H 4.316 2.113 2.425 1.00 . A A . 17 CYS H 1 1
2 477 1 1 17 CYS HA H 6.498 1.180 0.471 1.00 . A A . 17 CYS HA 1 1
2 478 1 1 17 CYS HB2 H 3.652 0.343 1.054 1.00 . A A . 17 CYS HB2 1 1
2 479 1 1 17 CYS HB3 H 4.032 0.392 -0.621 1.00 . A A . 17 CYS HB3 1 1
2 480 1 1 17 CYS N N 5.260 1.969 2.046 1.00 . A A . 17 CYS N 1 1
2 481 1 1 17 CYS O O 5.440 3.950 0.101 1.00 . A A . 17 CYS O 1 1
2 482 1 1 17 CYS SG S 5.376 -1.217 0.532 1.00 . A A . 17 CYS SG 1 1
2 483 1 1 18 ALA C C 3.267 3.796 -2.666 1.00 . A A . 18 ALA C 1 1
2 484 1 1 18 ALA CA C 4.803 3.583 -2.625 1.00 . A A . 18 ALA CA 1 1
2 485 1 1 18 ALA CB C 5.425 3.268 -3.999 1.00 . A A . 18 ALA CB 1 1
2 486 1 1 18 ALA H H 5.267 1.532 -1.840 1.00 . A A . 18 ALA H 1 1
2 487 1 1 18 ALA HA H 5.168 4.593 -2.333 1.00 . A A . 18 ALA HA 1 1
2 488 1 1 18 ALA HB1 H 6.526 3.167 -3.943 1.00 . A A . 18 ALA HB1 1 1
2 489 1 1 18 ALA HB2 H 5.027 2.333 -4.435 1.00 . A A . 18 ALA HB2 1 1
2 490 1 1 18 ALA HB3 H 5.218 4.073 -4.728 1.00 . A A . 18 ALA HB3 1 1
2 491 1 1 18 ALA N N 5.230 2.538 -1.641 1.00 . A A . 18 ALA N 1 1
2 492 1 1 18 ALA O O 2.599 3.752 -3.703 1.00 . A A . 18 ALA O 1 1
2 493 1 1 19 CYS C C 3.385 6.240 -0.390 1.00 . A A . 19 CYS C 1 1
2 494 1 1 19 CYS CA C 2.353 5.622 -1.349 1.00 . A A . 19 CYS CA 1 1
2 495 1 1 19 CYS CB C 0.930 5.724 -0.720 1.00 . A A . 19 CYS CB 1 1
2 496 1 1 19 CYS H H 3.341 3.892 -0.745 1.00 . A A . 19 CYS H 1 1
2 497 1 1 19 CYS HXT H 4.117 6.033 1.427 1.00 . A A . 19 CYS HXT 1 1
2 498 1 1 19 CYS HA H 2.512 6.129 -2.326 1.00 . A A . 19 CYS HA 1 1
2 499 1 1 19 CYS HB2 H 0.070 5.421 -1.364 1.00 . A A . 19 CYS HB2 1 1
2 500 1 1 19 CYS HB3 H 0.860 5.043 0.147 1.00 . A A . 19 CYS HB3 1 1
2 501 1 1 19 CYS N N 2.739 4.218 -1.508 1.00 . A A . 19 CYS N 1 1
2 502 1 1 19 CYS O O 4.092 7.203 -0.686 1.00 . A A . 19 CYS O 1 1
2 503 1 1 19 CYS OXT O 3.456 5.597 0.884 1.00 . A A . 19 CYS OXT 1 1
2 504 1 1 19 CYS SG S 0.647 7.409 -0.120 1.00 . A A . 19 CYS SG 1 1
3 505 1 1 1 DAL C C -6.328 -0.338 1.295 1.00 . A A . 1 DAL C 1 1
3 506 1 1 1 DAL CA C -5.212 -1.263 1.870 1.00 . A A . 1 DAL CA 1 1
3 507 1 1 1 DAL CB C -3.769 -0.792 1.587 1.00 . A A . 1 DAL CB 1 1
3 508 1 1 1 DAL H1 H -5.199 -0.629 3.840 1.00 . A A . 1 DAL H1 1 1
3 509 1 1 1 DAL H2 H -4.613 -2.143 3.645 1.00 . A A . 1 DAL H2 1 1
3 510 1 1 1 DAL HA H -5.340 -2.245 1.377 1.00 . A A . 1 DAL HA 1 1
3 511 1 1 1 DAL HB1 H -3.478 0.066 2.223 1.00 . A A . 1 DAL HB1 1 1
3 512 1 1 1 DAL HB2 H -3.678 -0.438 0.545 1.00 . A A . 1 DAL HB2 1 1
3 513 1 1 1 DAL N N -5.348 -1.503 3.324 1.00 . A A . 1 DAL N 1 1
3 514 1 1 1 DAL O O -7.235 0.121 1.999 1.00 . A A . 1 DAL O 1 1
3 515 1 1 2 SER C C -8.007 -1.195 -1.502 1.00 . A A . 2 SER C 1 1
3 516 1 1 2 SER CA C -7.514 0.136 -0.849 1.00 . A A . 2 SER CA 1 1
3 517 1 1 2 SER CB C -7.159 1.248 -1.863 1.00 . A A . 2 SER CB 1 1
3 518 1 1 2 SER H H -5.459 -0.552 -0.479 1.00 . A A . 2 SER H 1 1
3 519 1 1 2 SER HA H -8.323 0.543 -0.209 1.00 . A A . 2 SER HA 1 1
3 520 1 1 2 SER HB2 H -6.748 2.136 -1.346 1.00 . A A . 2 SER HB2 1 1
3 521 1 1 2 SER HB3 H -6.376 0.912 -2.570 1.00 . A A . 2 SER HB3 1 1
3 522 1 1 2 SER HG H -8.017 2.336 -3.197 1.00 . A A . 2 SER HG 1 1
3 523 1 1 2 SER N N -6.301 -0.170 -0.042 1.00 . A A . 2 SER N 1 1
3 524 1 1 2 SER O O -7.847 -1.430 -2.706 1.00 . A A . 2 SER O 1 1
3 525 1 1 2 SER OG O -8.311 1.647 -2.597 1.00 . A A . 2 SER OG 1 1
3 526 1 1 3 GLY C C -7.433 -4.300 -0.810 1.00 . A A . 3 GLY C 1 1
3 527 1 1 3 GLY CA C -8.755 -3.515 -1.003 1.00 . A A . 3 GLY CA 1 1
3 528 1 1 3 GLY H H -8.426 -1.789 0.324 1.00 . A A . 3 GLY H 1 1
3 529 1 1 3 GLY HA2 H -9.529 -3.928 -0.323 1.00 . A A . 3 GLY HA2 1 1
3 530 1 1 3 GLY HA3 H -9.197 -3.630 -2.013 1.00 . A A . 3 GLY HA3 1 1
3 531 1 1 3 GLY N N -8.553 -2.087 -0.652 1.00 . A A . 3 GLY N 1 1
3 532 1 1 3 GLY O O -6.984 -4.427 0.335 1.00 . A A . 3 GLY O 1 1
3 533 1 1 4 TRP C C -4.686 -4.769 -3.204 1.00 . A A . 4 TRP C 1 1
3 534 1 1 4 TRP CA C -5.352 -5.187 -1.860 1.00 . A A . 4 TRP CA 1 1
3 535 1 1 4 TRP CB C -5.127 -6.683 -1.551 1.00 . A A . 4 TRP CB 1 1
3 536 1 1 4 TRP CD1 C -6.570 -7.611 0.444 1.00 . A A . 4 TRP CD1 1 1
3 537 1 1 4 TRP CD2 C -4.451 -7.147 0.940 1.00 . A A . 4 TRP CD2 1 1
3 538 1 1 4 TRP CE2 C -5.122 -7.594 2.106 1.00 . A A . 4 TRP CE2 1 1
3 539 1 1 4 TRP CE3 C -3.077 -6.800 0.991 1.00 . A A . 4 TRP CE3 1 1
3 540 1 1 4 TRP CG C -5.359 -7.138 -0.104 1.00 . A A . 4 TRP CG 1 1
3 541 1 1 4 TRP CH2 C -3.074 -7.315 3.369 1.00 . A A . 4 TRP CH2 1 1
3 542 1 1 4 TRP CZ2 C -4.424 -7.676 3.338 1.00 . A A . 4 TRP CZ2 1 1
3 543 1 1 4 TRP CZ3 C -2.412 -6.884 2.213 1.00 . A A . 4 TRP CZ3 1 1
3 544 1 1 4 TRP H H -7.175 -4.540 -2.821 1.00 . A A . 4 TRP H 1 1
3 545 1 1 4 TRP HA H -4.831 -4.650 -1.051 1.00 . A A . 4 TRP HA 1 1
3 546 1 1 4 TRP HB2 H -5.768 -7.218 -2.244 1.00 . A A . 4 TRP HB2 1 1
3 547 1 1 4 TRP HB3 H -4.097 -6.979 -1.830 1.00 . A A . 4 TRP HB3 1 1
3 548 1 1 4 TRP HD1 H -7.492 -7.712 -0.109 1.00 . A A . 4 TRP HD1 1 1
3 549 1 1 4 TRP HE1 H -7.179 -8.228 2.454 1.00 . A A . 4 TRP HE1 1 1
3 550 1 1 4 TRP HE3 H -2.555 -6.473 0.104 1.00 . A A . 4 TRP HE3 1 1
3 551 1 1 4 TRP HH2 H -2.532 -7.370 4.302 1.00 . A A . 4 TRP HH2 1 1
3 552 1 1 4 TRP HZ2 H -4.915 -8.008 4.241 1.00 . A A . 4 TRP HZ2 1 1
3 553 1 1 4 TRP HZ3 H -1.367 -6.613 2.267 1.00 . A A . 4 TRP HZ3 1 1
3 554 1 1 4 TRP N N -6.784 -4.770 -1.900 1.00 . A A . 4 TRP N 1 1
3 555 1 1 4 TRP NE1 N -6.447 -7.891 1.818 1.00 . A A . 4 TRP NE1 1 1
3 556 1 1 4 TRP O O -4.337 -5.580 -4.069 1.00 . A A . 4 TRP O 1 1
3 557 1 1 5 VAL C C -2.020 -3.072 -3.145 1.00 . A A . 5 VAL C 1 1
3 558 1 1 5 VAL CA C -3.274 -2.892 -4.050 1.00 . A A . 5 VAL CA 1 1
3 559 1 1 5 VAL CB C -3.547 -1.476 -4.673 1.00 . A A . 5 VAL CB 1 1
3 560 1 1 5 VAL CG1 C -2.352 -0.989 -5.528 1.00 . A A . 5 VAL CG1 1 1
3 561 1 1 5 VAL CG2 C -4.817 -1.423 -5.555 1.00 . A A . 5 VAL CG2 1 1
3 562 1 1 5 VAL H H -4.851 -3.001 -2.481 1.00 . A A . 5 VAL H 1 1
3 563 1 1 5 VAL HA H -3.069 -3.533 -4.907 1.00 . A A . 5 VAL HA 1 1
3 564 1 1 5 VAL HB H -3.703 -0.738 -3.866 1.00 . A A . 5 VAL HB 1 1
3 565 1 1 5 VAL HG11 H -1.417 -0.946 -4.940 1.00 . A A . 5 VAL HG11 1 1
3 566 1 1 5 VAL HG12 H -2.159 -1.655 -6.390 1.00 . A A . 5 VAL HG12 1 1
3 567 1 1 5 VAL HG13 H -2.518 0.028 -5.929 1.00 . A A . 5 VAL HG13 1 1
3 568 1 1 5 VAL HG21 H -4.768 -2.136 -6.399 1.00 . A A . 5 VAL HG21 1 1
3 569 1 1 5 VAL HG22 H -5.727 -1.666 -4.975 1.00 . A A . 5 VAL HG22 1 1
3 570 1 1 5 VAL HG23 H -4.982 -0.415 -5.980 1.00 . A A . 5 VAL HG23 1 1
3 571 1 1 5 VAL N N -4.428 -3.458 -3.288 1.00 . A A . 5 VAL N 1 1
3 572 1 1 5 VAL O O -1.208 -3.961 -3.412 1.00 . A A . 5 VAL O 1 1
3 573 1 1 6 CYS C C -0.468 -3.911 -0.565 1.00 . A A . 6 CYS C 1 1
3 574 1 1 6 CYS CA C -1.507 -2.756 -0.701 1.00 . A A . 6 CYS CA 1 1
3 575 1 1 6 CYS CB C -2.708 -3.044 0.236 1.00 . A A . 6 CYS CB 1 1
3 576 1 1 6 CYS H H -2.402 -1.402 -2.180 1.00 . A A . 6 CYS H 1 1
3 577 1 1 6 CYS HA H -1.088 -1.815 -0.298 1.00 . A A . 6 CYS HA 1 1
3 578 1 1 6 CYS HB2 H -3.682 -2.820 -0.225 1.00 . A A . 6 CYS HB2 1 1
3 579 1 1 6 CYS HB3 H -2.752 -4.117 0.465 1.00 . A A . 6 CYS HB3 1 1
3 580 1 1 6 CYS N N -1.943 -2.304 -2.049 1.00 . A A . 6 CYS N 1 1
3 581 1 1 6 CYS O O -0.655 -5.061 -0.975 1.00 . A A . 6 CYS O 1 1
3 582 1 1 6 CYS SG S -2.595 -2.151 1.810 1.00 . A A . 6 CYS SG 1 1
3 583 1 1 7 ABA C C 2.713 -5.012 0.259 1.00 . A A . 7 ABA C 1 1
3 584 1 1 7 ABA CA C 1.414 -4.480 0.946 1.00 . A A . 7 ABA CA 1 1
3 585 1 1 7 ABA CB C 1.713 -3.647 2.234 1.00 . A A . 7 ABA CB 1 1
3 586 1 1 7 ABA CG C 0.473 -3.542 3.162 1.00 . A A . 7 ABA CG 1 1
3 587 1 1 7 ABA H H 0.312 -2.651 0.588 1.00 . A A . 7 ABA H 1 1
3 588 1 1 7 ABA HA H 0.827 -5.376 1.232 1.00 . A A . 7 ABA HA 1 1
3 589 1 1 7 ABA HB2 H 2.506 -4.131 2.837 1.00 . A A . 7 ABA HB2 1 1
3 590 1 1 7 ABA HG1 H 0.684 -2.997 4.095 1.00 . A A . 7 ABA HG1 1 1
3 591 1 1 7 ABA HG2 H -0.372 -3.032 2.667 1.00 . A A . 7 ABA HG2 1 1
3 592 1 1 7 ABA HG3 H 0.092 -4.543 3.439 1.00 . A A . 7 ABA HG3 1 1
3 593 1 1 7 ABA N N 0.568 -3.544 0.159 1.00 . A A . 7 ABA N 1 1
3 594 1 1 7 ABA O O 3.618 -5.462 0.970 1.00 . A A . 7 ABA O 1 1
3 595 1 1 8 LEU C C 4.587 -4.158 -2.610 1.00 . A A . 8 LEU C 1 1
3 596 1 1 8 LEU CA C 4.062 -5.390 -1.811 1.00 . A A . 8 LEU CA 1 1
3 597 1 1 8 LEU CB C 3.875 -6.668 -2.690 1.00 . A A . 8 LEU CB 1 1
3 598 1 1 8 LEU CD1 C 2.148 -8.263 -1.584 1.00 . A A . 8 LEU CD1 1 1
3 599 1 1 8 LEU CD2 C 4.121 -9.210 -2.815 1.00 . A A . 8 LEU CD2 1 1
3 600 1 1 8 LEU CG C 3.628 -8.024 -1.960 1.00 . A A . 8 LEU CG 1 1
3 601 1 1 8 LEU H H 2.045 -4.518 -1.562 1.00 . A A . 8 LEU H 1 1
3 602 1 1 8 LEU HA H 4.877 -5.624 -1.094 1.00 . A A . 8 LEU HA 1 1
3 603 1 1 8 LEU HB2 H 3.095 -6.501 -3.458 1.00 . A A . 8 LEU HB2 1 1
3 604 1 1 8 LEU HB3 H 4.808 -6.774 -3.281 1.00 . A A . 8 LEU HB3 1 1
3 605 1 1 8 LEU HD11 H 1.486 -8.240 -2.469 1.00 . A A . 8 LEU HD11 1 1
3 606 1 1 8 LEU HD12 H 2.005 -9.245 -1.094 1.00 . A A . 8 LEU HD12 1 1
3 607 1 1 8 LEU HD13 H 1.767 -7.511 -0.872 1.00 . A A . 8 LEU HD13 1 1
3 608 1 1 8 LEU HD21 H 5.199 -9.122 -3.050 1.00 . A A . 8 LEU HD21 1 1
3 609 1 1 8 LEU HD22 H 3.993 -10.176 -2.292 1.00 . A A . 8 LEU HD22 1 1
3 610 1 1 8 LEU HD23 H 3.582 -9.283 -3.779 1.00 . A A . 8 LEU HD23 1 1
3 611 1 1 8 LEU HG H 4.223 -8.033 -1.028 1.00 . A A . 8 LEU HG 1 1
3 612 1 1 8 LEU N N 2.806 -5.022 -1.090 1.00 . A A . 8 LEU N 1 1
3 613 1 1 8 LEU O O 4.745 -4.196 -3.835 1.00 . A A . 8 LEU O 1 1
3 614 1 1 9 ABA C C 4.738 -0.813 -3.166 1.00 . A A . 9 ABA C 1 1
3 615 1 1 9 ABA CA C 5.601 -1.876 -2.409 1.00 . A A . 9 ABA CA 1 1
3 616 1 1 9 ABA CB C 6.424 -1.250 -1.237 1.00 . A A . 9 ABA CB 1 1
3 617 1 1 9 ABA CG C 7.683 -2.066 -0.886 1.00 . A A . 9 ABA CG 1 1
3 618 1 1 9 ABA H H 4.686 -3.164 -0.876 1.00 . A A . 9 ABA H 1 1
3 619 1 1 9 ABA HA H 6.336 -2.218 -3.165 1.00 . A A . 9 ABA HA 1 1
3 620 1 1 9 ABA HB2 H 6.771 -0.238 -1.519 1.00 . A A . 9 ABA HB2 1 1
3 621 1 1 9 ABA HG1 H 7.425 -3.086 -0.543 1.00 . A A . 9 ABA HG1 1 1
3 622 1 1 9 ABA HG2 H 8.256 -1.586 -0.073 1.00 . A A . 9 ABA HG2 1 1
3 623 1 1 9 ABA HG3 H 8.359 -2.172 -1.754 1.00 . A A . 9 ABA HG3 1 1
3 624 1 1 9 ABA N N 4.906 -3.077 -1.874 1.00 . A A . 9 ABA N 1 1
3 625 1 1 9 ABA O O 5.342 0.062 -3.794 1.00 . A A . 9 ABA O 1 1
3 626 1 1 10 ILE C C 1.307 0.308 -2.824 1.00 . A A . 10 ILE C 1 1
3 627 1 1 10 ILE CA C 2.522 0.167 -3.792 1.00 . A A . 10 ILE CA 1 1
3 628 1 1 10 ILE CB C 2.044 -0.147 -5.267 1.00 . A A . 10 ILE CB 1 1
3 629 1 1 10 ILE CD1 C 3.488 -2.086 -6.297 1.00 . A A . 10 ILE CD1 1 1
3 630 1 1 10 ILE CG1 C 3.104 -0.599 -6.329 1.00 . A A . 10 ILE CG1 1 1
3 631 1 1 10 ILE CG2 C 1.302 1.082 -5.859 1.00 . A A . 10 ILE CG2 1 1
3 632 1 1 10 ILE H H 2.973 -1.596 -2.568 1.00 . A A . 10 ILE H 1 1
3 633 1 1 10 ILE HA H 3.076 1.131 -3.792 1.00 . A A . 10 ILE HA 1 1
3 634 1 1 10 ILE HB H 1.300 -0.964 -5.202 1.00 . A A . 10 ILE HB 1 1
3 635 1 1 10 ILE HD11 H 2.600 -2.741 -6.368 1.00 . A A . 10 ILE HD11 1 1
3 636 1 1 10 ILE HD12 H 4.151 -2.341 -7.144 1.00 . A A . 10 ILE HD12 1 1
3 637 1 1 10 ILE HD13 H 4.030 -2.357 -5.379 1.00 . A A . 10 ILE HD13 1 1
3 638 1 1 10 ILE HG12 H 2.720 -0.434 -7.357 1.00 . A A . 10 ILE HG12 1 1
3 639 1 1 10 ILE HG13 H 4.016 0.023 -6.276 1.00 . A A . 10 ILE HG13 1 1
3 640 1 1 10 ILE HG21 H 0.460 1.410 -5.224 1.00 . A A . 10 ILE HG21 1 1
3 641 1 1 10 ILE HG22 H 1.974 1.952 -5.977 1.00 . A A . 10 ILE HG22 1 1
3 642 1 1 10 ILE HG23 H 0.865 0.865 -6.852 1.00 . A A . 10 ILE HG23 1 1
3 643 1 1 10 ILE N N 3.385 -0.866 -3.158 1.00 . A A . 10 ILE N 1 1
3 644 1 1 10 ILE O O 0.468 -0.593 -2.724 1.00 . A A . 10 ILE O 1 1
3 645 1 1 11 GLU C C -0.365 0.916 -0.172 1.00 . A A . 11 GLU C 1 1
3 646 1 1 11 GLU CA C 0.066 1.899 -1.311 1.00 . A A . 11 GLU CA 1 1
3 647 1 1 11 GLU CB C -1.065 2.546 -2.181 1.00 . A A . 11 GLU CB 1 1
3 648 1 1 11 GLU CD C -3.143 2.308 -3.663 1.00 . A A . 11 GLU CD 1 1
3 649 1 1 11 GLU CG C -1.980 1.592 -2.976 1.00 . A A . 11 GLU CG 1 1
3 650 1 1 11 GLU H H 2.026 2.085 -2.248 1.00 . A A . 11 GLU H 1 1
3 651 1 1 11 GLU HA H 0.469 2.761 -0.730 1.00 . A A . 11 GLU HA 1 1
3 652 1 1 11 GLU HB2 H -1.678 3.159 -1.500 1.00 . A A . 11 GLU HB2 1 1
3 653 1 1 11 GLU HB3 H -0.659 3.273 -2.924 1.00 . A A . 11 GLU HB3 1 1
3 654 1 1 11 GLU HE2 H -4.907 3.010 -3.235 1.00 . A A . 11 GLU HE2 1 1
3 655 1 1 11 GLU HG2 H -1.377 1.078 -3.742 1.00 . A A . 11 GLU HG2 1 1
3 656 1 1 11 GLU HG3 H -2.381 0.795 -2.328 1.00 . A A . 11 GLU HG3 1 1
3 657 1 1 11 GLU N N 1.213 1.472 -2.156 1.00 . A A . 11 GLU N 1 1
3 658 1 1 11 GLU O O -1.547 0.625 0.007 1.00 . A A . 11 GLU O 1 1
3 659 1 1 11 GLU OE1 O -3.142 2.613 -4.855 1.00 . A A . 11 GLU OE1 1 1
3 660 1 1 11 GLU OE2 O -4.178 2.562 -2.800 1.00 . A A . 11 GLU OE2 1 1
3 661 1 1 12 CYS C C -0.202 0.852 3.082 1.00 . A A . 12 CYS C 1 1
3 662 1 1 12 CYS CA C 0.370 -0.114 1.995 1.00 . A A . 12 CYS CA 1 1
3 663 1 1 12 CYS CB C 1.712 -0.662 2.567 1.00 . A A . 12 CYS CB 1 1
3 664 1 1 12 CYS H H 1.518 0.900 0.413 1.00 . A A . 12 CYS H 1 1
3 665 1 1 12 CYS HA H -0.329 -0.956 1.864 1.00 . A A . 12 CYS HA 1 1
3 666 1 1 12 CYS HB2 H 2.489 0.125 2.528 1.00 . A A . 12 CYS HB2 1 1
3 667 1 1 12 CYS HB3 H 1.629 -0.952 3.631 1.00 . A A . 12 CYS HB3 1 1
3 668 1 1 12 CYS N N 0.610 0.530 0.673 1.00 . A A . 12 CYS N 1 1
3 669 1 1 12 CYS O O -0.886 0.376 3.993 1.00 . A A . 12 CYS O 1 1
3 670 1 1 12 CYS SG S 2.424 -2.052 1.660 1.00 . A A . 12 CYS SG 1 1
3 671 1 1 13 GLY C C -0.503 4.591 3.652 1.00 . A A . 13 GLY C 1 1
3 672 1 1 13 GLY CA C -0.243 3.131 4.077 1.00 . A A . 13 GLY CA 1 1
3 673 1 1 13 GLY H H 0.619 2.397 2.144 1.00 . A A . 13 GLY H 1 1
3 674 1 1 13 GLY HA2 H -1.126 2.782 4.647 1.00 . A A . 13 GLY HA2 1 1
3 675 1 1 13 GLY HA3 H 0.583 3.128 4.812 1.00 . A A . 13 GLY HA3 1 1
3 676 1 1 13 GLY N N 0.091 2.166 3.001 1.00 . A A . 13 GLY N 1 1
3 677 1 1 13 GLY O O -1.453 5.196 4.156 1.00 . A A . 13 GLY O 1 1
3 678 1 1 14 ABA C C 2.041 7.107 2.794 1.00 . A A . 14 ABA C 1 1
3 679 1 1 14 ABA CA C 0.528 6.669 2.712 1.00 . A A . 14 ABA CA 1 1
3 680 1 1 14 ABA CB C -0.268 7.320 1.519 1.00 . A A . 14 ABA CB 1 1
3 681 1 1 14 ABA CG C -1.637 6.711 1.166 1.00 . A A . 14 ABA CG 1 1
3 682 1 1 14 ABA H H 1.111 4.571 2.469 1.00 . A A . 14 ABA H 1 1
3 683 1 1 14 ABA HA H 0.085 7.117 3.624 1.00 . A A . 14 ABA HA 1 1
3 684 1 1 14 ABA HB2 H -0.473 8.361 1.833 1.00 . A A . 14 ABA HB2 1 1
3 685 1 1 14 ABA HG1 H -1.534 5.668 0.811 1.00 . A A . 14 ABA HG1 1 1
3 686 1 1 14 ABA HG2 H -2.132 7.282 0.363 1.00 . A A . 14 ABA HG2 1 1
3 687 1 1 14 ABA HG3 H -2.309 6.694 2.042 1.00 . A A . 14 ABA HG3 1 1
3 688 1 1 14 ABA N N 0.367 5.183 2.811 1.00 . A A . 14 ABA N 1 1
3 689 1 1 14 ABA O O 2.401 8.177 2.294 1.00 . A A . 14 ABA O 1 1
3 690 1 1 15 VAL C C 5.348 5.448 3.625 1.00 . A A . 15 VAL C 1 1
3 691 1 1 15 VAL CA C 4.347 6.655 3.728 1.00 . A A . 15 VAL CA 1 1
3 692 1 1 15 VAL CB C 4.441 7.461 5.071 1.00 . A A . 15 VAL CB 1 1
3 693 1 1 15 VAL CG1 C 4.270 6.636 6.369 1.00 . A A . 15 VAL CG1 1 1
3 694 1 1 15 VAL CG2 C 5.719 8.322 5.158 1.00 . A A . 15 VAL CG2 1 1
3 695 1 1 15 VAL H H 2.464 5.531 3.943 1.00 . A A . 15 VAL H 1 1
3 696 1 1 15 VAL HA H 4.665 7.327 2.912 1.00 . A A . 15 VAL HA 1 1
3 697 1 1 15 VAL HB H 3.594 8.171 5.063 1.00 . A A . 15 VAL HB 1 1
3 698 1 1 15 VAL HG11 H 3.345 6.030 6.348 1.00 . A A . 15 VAL HG11 1 1
3 699 1 1 15 VAL HG12 H 5.114 5.943 6.534 1.00 . A A . 15 VAL HG12 1 1
3 700 1 1 15 VAL HG13 H 4.204 7.287 7.261 1.00 . A A . 15 VAL HG13 1 1
3 701 1 1 15 VAL HG21 H 5.819 8.991 4.283 1.00 . A A . 15 VAL HG21 1 1
3 702 1 1 15 VAL HG22 H 5.717 8.971 6.054 1.00 . A A . 15 VAL HG22 1 1
3 703 1 1 15 VAL HG23 H 6.635 7.703 5.204 1.00 . A A . 15 VAL HG23 1 1
3 704 1 1 15 VAL N N 2.915 6.316 3.468 1.00 . A A . 15 VAL N 1 1
3 705 1 1 15 VAL O O 6.497 5.664 3.229 1.00 . A A . 15 VAL O 1 1
3 706 1 1 16 ILE C C 6.267 2.498 2.702 1.00 . A A . 16 ILE C 1 1
3 707 1 1 16 ILE CA C 5.857 3.026 4.120 1.00 . A A . 16 ILE CA 1 1
3 708 1 1 16 ILE CB C 5.234 1.980 5.130 1.00 . A A . 16 ILE CB 1 1
3 709 1 1 16 ILE CD1 C 4.375 1.778 7.605 1.00 . A A . 16 ILE CD1 1 1
3 710 1 1 16 ILE CG1 C 5.298 2.493 6.604 1.00 . A A . 16 ILE CG1 1 1
3 711 1 1 16 ILE CG2 C 5.851 0.556 5.045 1.00 . A A . 16 ILE CG2 1 1
3 712 1 1 16 ILE H H 3.949 4.165 4.229 1.00 . A A . 16 ILE H 1 1
3 713 1 1 16 ILE HA H 6.802 3.373 4.586 1.00 . A A . 16 ILE HA 1 1
3 714 1 1 16 ILE HB H 4.162 1.864 4.882 1.00 . A A . 16 ILE HB 1 1
3 715 1 1 16 ILE HD11 H 3.318 1.816 7.283 1.00 . A A . 16 ILE HD11 1 1
3 716 1 1 16 ILE HD12 H 4.647 0.716 7.739 1.00 . A A . 16 ILE HD12 1 1
3 717 1 1 16 ILE HD13 H 4.429 2.253 8.601 1.00 . A A . 16 ILE HD13 1 1
3 718 1 1 16 ILE HG12 H 6.340 2.460 6.975 1.00 . A A . 16 ILE HG12 1 1
3 719 1 1 16 ILE HG13 H 5.024 3.563 6.639 1.00 . A A . 16 ILE HG13 1 1
3 720 1 1 16 ILE HG21 H 5.725 0.109 4.042 1.00 . A A . 16 ILE HG21 1 1
3 721 1 1 16 ILE HG22 H 6.933 0.554 5.269 1.00 . A A . 16 ILE HG22 1 1
3 722 1 1 16 ILE HG23 H 5.368 -0.155 5.741 1.00 . A A . 16 ILE HG23 1 1
3 723 1 1 16 ILE N N 4.947 4.214 4.002 1.00 . A A . 16 ILE N 1 1
3 724 1 1 16 ILE O O 7.443 2.591 2.340 1.00 . A A . 16 ILE O 1 1
3 725 1 1 17 CYS C C 5.389 2.893 -0.436 1.00 . A A . 17 CYS C 1 1
3 726 1 1 17 CYS CA C 5.518 1.633 0.478 1.00 . A A . 17 CYS CA 1 1
3 727 1 1 17 CYS CB C 4.567 0.433 0.188 1.00 . A A . 17 CYS CB 1 1
3 728 1 1 17 CYS H H 4.362 2.037 2.305 1.00 . A A . 17 CYS H 1 1
3 729 1 1 17 CYS HA H 6.544 1.269 0.299 1.00 . A A . 17 CYS HA 1 1
3 730 1 1 17 CYS HB2 H 3.708 0.380 0.879 1.00 . A A . 17 CYS HB2 1 1
3 731 1 1 17 CYS HB3 H 4.082 0.484 -0.796 1.00 . A A . 17 CYS HB3 1 1
3 732 1 1 17 CYS N N 5.307 1.983 1.910 1.00 . A A . 17 CYS N 1 1
3 733 1 1 17 CYS O O 5.458 4.036 0.032 1.00 . A A . 17 CYS O 1 1
3 734 1 1 17 CYS SG S 5.461 -1.133 0.308 1.00 . A A . 17 CYS SG 1 1
3 735 1 1 18 ALA C C 3.255 3.975 -2.716 1.00 . A A . 18 ALA C 1 1
3 736 1 1 18 ALA CA C 4.791 3.756 -2.700 1.00 . A A . 18 ALA CA 1 1
3 737 1 1 18 ALA CB C 5.396 3.476 -4.089 1.00 . A A . 18 ALA CB 1 1
3 738 1 1 18 ALA H H 5.281 1.683 -1.987 1.00 . A A . 18 ALA H 1 1
3 739 1 1 18 ALA HA H 5.161 4.755 -2.382 1.00 . A A . 18 ALA HA 1 1
3 740 1 1 18 ALA HB1 H 6.498 3.381 -4.050 1.00 . A A . 18 ALA HB1 1 1
3 741 1 1 18 ALA HB2 H 4.998 2.548 -4.540 1.00 . A A . 18 ALA HB2 1 1
3 742 1 1 18 ALA HB3 H 5.175 4.296 -4.796 1.00 . A A . 18 ALA HB3 1 1
3 743 1 1 18 ALA N N 5.231 2.681 -1.753 1.00 . A A . 18 ALA N 1 1
3 744 1 1 18 ALA O O 2.576 3.972 -3.747 1.00 . A A . 18 ALA O 1 1
3 745 1 1 19 CYS C C 3.415 6.342 -0.364 1.00 . A A . 19 CYS C 1 1
3 746 1 1 19 CYS CA C 2.366 5.759 -1.327 1.00 . A A . 19 CYS CA 1 1
3 747 1 1 19 CYS CB C 0.953 5.847 -0.672 1.00 . A A . 19 CYS CB 1 1
3 748 1 1 19 CYS H H 3.348 3.996 -0.795 1.00 . A A . 19 CYS H 1 1
3 749 1 1 19 CYS HXT H 4.175 6.072 1.432 1.00 . A A . 19 CYS HXT 1 1
3 750 1 1 19 CYS HA H 2.511 6.301 -2.287 1.00 . A A . 19 CYS HA 1 1
3 751 1 1 19 CYS HB2 H 0.083 5.563 -1.311 1.00 . A A . 19 CYS HB2 1 1
3 752 1 1 19 CYS HB3 H 0.895 5.144 0.178 1.00 . A A . 19 CYS HB3 1 1
3 753 1 1 19 CYS N N 2.742 4.358 -1.538 1.00 . A A . 19 CYS N 1 1
3 754 1 1 19 CYS O O 4.119 7.313 -0.639 1.00 . A A . 19 CYS O 1 1
3 755 1 1 19 CYS OXT O 3.504 5.656 0.886 1.00 . A A . 19 CYS OXT 1 1
3 756 1 1 19 CYS SG S 0.682 7.517 -0.025 1.00 . A A . 19 CYS SG 1 1
4 757 1 1 1 DAL C C -6.111 -0.234 1.562 1.00 . A A . 1 DAL C 1 1
4 758 1 1 1 DAL CA C -5.137 -1.385 1.971 1.00 . A A . 1 DAL CA 1 1
4 759 1 1 1 DAL CB C -3.638 -1.055 1.809 1.00 . A A . 1 DAL CB 1 1
4 760 1 1 1 DAL H1 H -4.772 -2.675 3.548 1.00 . A A . 1 DAL H1 1 1
4 761 1 1 1 DAL H2 H -6.329 -2.185 3.462 1.00 . A A . 1 DAL H2 1 1
4 762 1 1 1 DAL HA H -5.361 -2.240 1.306 1.00 . A A . 1 DAL HA 1 1
4 763 1 1 1 DAL HB1 H -3.329 -0.245 2.496 1.00 . A A . 1 DAL HB1 1 1
4 764 1 1 1 DAL HB2 H -3.445 -0.682 0.791 1.00 . A A . 1 DAL HB2 1 1
4 765 1 1 1 DAL N N -5.363 -1.859 3.355 1.00 . A A . 1 DAL N 1 1
4 766 1 1 1 DAL O O -6.991 0.185 2.323 1.00 . A A . 1 DAL O 1 1
4 767 1 1 2 SER C C -7.933 -0.303 -1.227 1.00 . A A . 2 SER C 1 1
4 768 1 1 2 SER CA C -7.145 0.812 -0.463 1.00 . A A . 2 SER CA 1 1
4 769 1 1 2 SER CB C -6.605 1.945 -1.371 1.00 . A A . 2 SER CB 1 1
4 770 1 1 2 SER H H -5.195 -0.167 -0.206 1.00 . A A . 2 SER H 1 1
4 771 1 1 2 SER HA H -7.840 1.313 0.242 1.00 . A A . 2 SER HA 1 1
4 772 1 1 2 SER HB2 H -7.446 2.462 -1.868 1.00 . A A . 2 SER HB2 1 1
4 773 1 1 2 SER HB3 H -6.096 2.720 -0.766 1.00 . A A . 2 SER HB3 1 1
4 774 1 1 2 SER HG H -4.975 1.061 -1.892 1.00 . A A . 2 SER HG 1 1
4 775 1 1 2 SER N N -6.013 0.193 0.286 1.00 . A A . 2 SER N 1 1
4 776 1 1 2 SER O O -7.871 -0.434 -2.454 1.00 . A A . 2 SER O 1 1
4 777 1 1 2 SER OG O -5.705 1.465 -2.367 1.00 . A A . 2 SER OG 1 1
4 778 1 1 3 GLY C C -8.018 -3.525 -0.557 1.00 . A A . 3 GLY C 1 1
4 779 1 1 3 GLY CA C -9.104 -2.473 -0.892 1.00 . A A . 3 GLY CA 1 1
4 780 1 1 3 GLY H H -8.355 -0.999 0.541 1.00 . A A . 3 GLY H 1 1
4 781 1 1 3 GLY HA2 H -10.033 -2.708 -0.332 1.00 . A A . 3 GLY HA2 1 1
4 782 1 1 3 GLY HA3 H -9.411 -2.466 -1.956 1.00 . A A . 3 GLY HA3 1 1
4 783 1 1 3 GLY N N -8.627 -1.144 -0.439 1.00 . A A . 3 GLY N 1 1
4 784 1 1 3 GLY O O -7.737 -3.714 0.632 1.00 . A A . 3 GLY O 1 1
4 785 1 1 4 TRP C C -5.216 -4.529 -2.708 1.00 . A A . 4 TRP C 1 1
4 786 1 1 4 TRP CA C -5.998 -4.725 -1.376 1.00 . A A . 4 TRP CA 1 1
4 787 1 1 4 TRP CB C -5.952 -6.196 -0.913 1.00 . A A . 4 TRP CB 1 1
4 788 1 1 4 TRP CD1 C -5.630 -6.280 1.682 1.00 . A A . 4 TRP CD1 1 1
4 789 1 1 4 TRP CD2 C -7.638 -6.926 0.971 1.00 . A A . 4 TRP CD2 1 1
4 790 1 1 4 TRP CE2 C -7.597 -6.978 2.388 1.00 . A A . 4 TRP CE2 1 1
4 791 1 1 4 TRP CE3 C -8.831 -7.251 0.274 1.00 . A A . 4 TRP CE3 1 1
4 792 1 1 4 TRP CG C -6.406 -6.484 0.522 1.00 . A A . 4 TRP CG 1 1
4 793 1 1 4 TRP CH2 C -9.912 -7.683 2.413 1.00 . A A . 4 TRP CH2 1 1
4 794 1 1 4 TRP CZ2 C -8.750 -7.361 3.117 1.00 . A A . 4 TRP CZ2 1 1
4 795 1 1 4 TRP CZ3 C -9.951 -7.628 1.014 1.00 . A A . 4 TRP CZ3 1 1
4 796 1 1 4 TRP H H -7.629 -3.939 -2.527 1.00 . A A . 4 TRP H 1 1
4 797 1 1 4 TRP HA H -5.479 -4.162 -0.584 1.00 . A A . 4 TRP HA 1 1
4 798 1 1 4 TRP HB2 H -6.552 -6.737 -1.640 1.00 . A A . 4 TRP HB2 1 1
4 799 1 1 4 TRP HB3 H -4.929 -6.607 -1.028 1.00 . A A . 4 TRP HB3 1 1
4 800 1 1 4 TRP HD1 H -4.615 -5.909 1.681 1.00 . A A . 4 TRP HD1 1 1
4 801 1 1 4 TRP HE1 H -6.025 -6.500 3.822 1.00 . A A . 4 TRP HE1 1 1
4 802 1 1 4 TRP HE3 H -8.879 -7.199 -0.804 1.00 . A A . 4 TRP HE3 1 1
4 803 1 1 4 TRP HH2 H -10.799 -7.975 2.957 1.00 . A A . 4 TRP HH2 1 1
4 804 1 1 4 TRP HZ2 H -8.746 -7.401 4.197 1.00 . A A . 4 TRP HZ2 1 1
4 805 1 1 4 TRP HZ3 H -10.868 -7.877 0.499 1.00 . A A . 4 TRP HZ3 1 1
4 806 1 1 4 TRP N N -7.358 -4.148 -1.562 1.00 . A A . 4 TRP N 1 1
4 807 1 1 4 TRP NE1 N -6.350 -6.583 2.852 1.00 . A A . 4 TRP NE1 1 1
4 808 1 1 4 TRP O O -4.998 -5.444 -3.510 1.00 . A A . 4 TRP O 1 1
4 809 1 1 5 VAL C C -2.283 -3.388 -2.791 1.00 . A A . 5 VAL C 1 1
4 810 1 1 5 VAL CA C -3.507 -2.972 -3.664 1.00 . A A . 5 VAL CA 1 1
4 811 1 1 5 VAL CB C -3.533 -1.527 -4.294 1.00 . A A . 5 VAL CB 1 1
4 812 1 1 5 VAL CG1 C -2.272 -1.236 -5.139 1.00 . A A . 5 VAL CG1 1 1
4 813 1 1 5 VAL CG2 C -4.775 -1.277 -5.184 1.00 . A A . 5 VAL CG2 1 1
4 814 1 1 5 VAL H H -5.114 -2.713 -2.116 1.00 . A A . 5 VAL H 1 1
4 815 1 1 5 VAL HA H -3.467 -3.647 -4.521 1.00 . A A . 5 VAL HA 1 1
4 816 1 1 5 VAL HB H -3.567 -0.755 -3.503 1.00 . A A . 5 VAL HB 1 1
4 817 1 1 5 VAL HG11 H -1.349 -1.321 -4.538 1.00 . A A . 5 VAL HG11 1 1
4 818 1 1 5 VAL HG12 H -2.170 -1.936 -5.990 1.00 . A A . 5 VAL HG12 1 1
4 819 1 1 5 VAL HG13 H -2.280 -0.211 -5.554 1.00 . A A . 5 VAL HG13 1 1
4 820 1 1 5 VAL HG21 H -4.835 -1.993 -6.025 1.00 . A A . 5 VAL HG21 1 1
4 821 1 1 5 VAL HG22 H -5.715 -1.370 -4.609 1.00 . A A . 5 VAL HG22 1 1
4 822 1 1 5 VAL HG23 H -4.775 -0.259 -5.616 1.00 . A A . 5 VAL HG23 1 1
4 823 1 1 5 VAL N N -4.718 -3.296 -2.850 1.00 . A A . 5 VAL N 1 1
4 824 1 1 5 VAL O O -1.747 -4.480 -2.996 1.00 . A A . 5 VAL O 1 1
4 825 1 1 6 CYS C C -0.351 -4.101 -0.350 1.00 . A A . 6 CYS C 1 1
4 826 1 1 6 CYS CA C -1.489 -3.040 -0.440 1.00 . A A . 6 CYS CA 1 1
4 827 1 1 6 CYS CB C -2.656 -3.398 0.507 1.00 . A A . 6 CYS CB 1 1
4 828 1 1 6 CYS H H -2.389 -1.663 -1.875 1.00 . A A . 6 CYS H 1 1
4 829 1 1 6 CYS HA H -1.144 -2.089 -0.003 1.00 . A A . 6 CYS HA 1 1
4 830 1 1 6 CYS HB2 H -3.634 -3.208 0.047 1.00 . A A . 6 CYS HB2 1 1
4 831 1 1 6 CYS HB3 H -2.628 -4.473 0.717 1.00 . A A . 6 CYS HB3 1 1
4 832 1 1 6 CYS N N -1.948 -2.579 -1.777 1.00 . A A . 6 CYS N 1 1
4 833 1 1 6 CYS O O -0.468 -5.271 -0.723 1.00 . A A . 6 CYS O 1 1
4 834 1 1 6 CYS SG S -2.589 -2.510 2.087 1.00 . A A . 6 CYS SG 1 1
4 835 1 1 7 ABA C C 2.932 -4.940 0.429 1.00 . A A . 7 ABA C 1 1
4 836 1 1 7 ABA CA C 1.608 -4.479 1.124 1.00 . A A . 7 ABA CA 1 1
4 837 1 1 7 ABA CB C 1.853 -3.583 2.382 1.00 . A A . 7 ABA CB 1 1
4 838 1 1 7 ABA CG C 0.609 -3.488 3.303 1.00 . A A . 7 ABA CG 1 1
4 839 1 1 7 ABA H H 0.363 -2.771 0.746 1.00 . A A . 7 ABA H 1 1
4 840 1 1 7 ABA HA H 1.091 -5.404 1.450 1.00 . A A . 7 ABA HA 1 1
4 841 1 1 7 ABA HB2 H 2.655 -4.023 3.004 1.00 . A A . 7 ABA HB2 1 1
4 842 1 1 7 ABA HG1 H 0.806 -2.921 4.227 1.00 . A A . 7 ABA HG1 1 1
4 843 1 1 7 ABA HG2 H -0.240 -3.001 2.796 1.00 . A A . 7 ABA HG2 1 1
4 844 1 1 7 ABA HG3 H 0.246 -4.491 3.596 1.00 . A A . 7 ABA HG3 1 1
4 845 1 1 7 ABA N N 0.693 -3.636 0.312 1.00 . A A . 7 ABA N 1 1
4 846 1 1 7 ABA O O 3.950 -5.107 1.109 1.00 . A A . 7 ABA O 1 1
4 847 1 1 8 LEU C C 4.788 -4.384 -2.415 1.00 . A A . 8 LEU C 1 1
4 848 1 1 8 LEU CA C 4.138 -5.589 -1.671 1.00 . A A . 8 LEU CA 1 1
4 849 1 1 8 LEU CB C 3.826 -6.842 -2.549 1.00 . A A . 8 LEU CB 1 1
4 850 1 1 8 LEU CD1 C 2.944 -8.051 -4.607 1.00 . A A . 8 LEU CD1 1 1
4 851 1 1 8 LEU CD2 C 1.403 -6.428 -3.456 1.00 . A A . 8 LEU CD2 1 1
4 852 1 1 8 LEU CG C 2.877 -6.745 -3.788 1.00 . A A . 8 LEU CG 1 1
4 853 1 1 8 LEU H H 2.085 -4.845 -1.383 1.00 . A A . 8 LEU H 1 1
4 854 1 1 8 LEU HA H 4.932 -5.918 -0.968 1.00 . A A . 8 LEU HA 1 1
4 855 1 1 8 LEU HB2 H 4.806 -7.214 -2.906 1.00 . A A . 8 LEU HB2 1 1
4 856 1 1 8 LEU HB3 H 3.467 -7.656 -1.888 1.00 . A A . 8 LEU HB3 1 1
4 857 1 1 8 LEU HD11 H 3.977 -8.276 -4.933 1.00 . A A . 8 LEU HD11 1 1
4 858 1 1 8 LEU HD12 H 2.585 -8.924 -4.030 1.00 . A A . 8 LEU HD12 1 1
4 859 1 1 8 LEU HD13 H 2.332 -7.991 -5.527 1.00 . A A . 8 LEU HD13 1 1
4 860 1 1 8 LEU HD21 H 0.977 -7.142 -2.727 1.00 . A A . 8 LEU HD21 1 1
4 861 1 1 8 LEU HD22 H 1.286 -5.414 -3.034 1.00 . A A . 8 LEU HD22 1 1
4 862 1 1 8 LEU HD23 H 0.762 -6.456 -4.357 1.00 . A A . 8 LEU HD23 1 1
4 863 1 1 8 LEU HG H 3.241 -5.941 -4.452 1.00 . A A . 8 LEU HG 1 1
4 864 1 1 8 LEU N N 2.921 -5.193 -0.899 1.00 . A A . 8 LEU N 1 1
4 865 1 1 8 LEU O O 5.029 -4.407 -3.626 1.00 . A A . 8 LEU O 1 1
4 866 1 1 9 ABA C C 4.936 -1.081 -2.913 1.00 . A A . 9 ABA C 1 1
4 867 1 1 9 ABA CA C 5.806 -2.120 -2.129 1.00 . A A . 9 ABA CA 1 1
4 868 1 1 9 ABA CB C 6.565 -1.490 -0.918 1.00 . A A . 9 ABA CB 1 1
4 869 1 1 9 ABA CG C 7.759 -2.348 -0.455 1.00 . A A . 9 ABA CG 1 1
4 870 1 1 9 ABA H H 4.853 -3.445 -0.650 1.00 . A A . 9 ABA H 1 1
4 871 1 1 9 ABA HA H 6.580 -2.440 -2.855 1.00 . A A . 9 ABA HA 1 1
4 872 1 1 9 ABA HB2 H 6.969 -0.500 -1.205 1.00 . A A . 9 ABA HB2 1 1
4 873 1 1 9 ABA HG1 H 7.428 -3.340 -0.090 1.00 . A A . 9 ABA HG1 1 1
4 874 1 1 9 ABA HG2 H 8.303 -1.866 0.375 1.00 . A A . 9 ABA HG2 1 1
4 875 1 1 9 ABA HG3 H 8.479 -2.527 -1.275 1.00 . A A . 9 ABA HG3 1 1
4 876 1 1 9 ABA N N 5.106 -3.334 -1.638 1.00 . A A . 9 ABA N 1 1
4 877 1 1 9 ABA O O 5.530 -0.155 -3.472 1.00 . A A . 9 ABA O 1 1
4 878 1 1 10 ILE C C 1.442 -0.132 -2.894 1.00 . A A . 10 ILE C 1 1
4 879 1 1 10 ILE CA C 2.711 -0.308 -3.780 1.00 . A A . 10 ILE CA 1 1
4 880 1 1 10 ILE CB C 2.343 -0.851 -5.211 1.00 . A A . 10 ILE CB 1 1
4 881 1 1 10 ILE CD1 C 4.457 -0.158 -6.658 1.00 . A A . 10 ILE CD1 1 1
4 882 1 1 10 ILE CG1 C 3.534 -1.271 -6.128 1.00 . A A . 10 ILE CG1 1 1
4 883 1 1 10 ILE CG2 C 1.396 0.105 -5.986 1.00 . A A . 10 ILE CG2 1 1
4 884 1 1 10 ILE H H 3.192 -1.976 -2.430 1.00 . A A . 10 ILE H 1 1
4 885 1 1 10 ILE HA H 3.215 0.672 -3.914 1.00 . A A . 10 ILE HA 1 1
4 886 1 1 10 ILE HB H 1.764 -1.777 -5.044 1.00 . A A . 10 ILE HB 1 1
4 887 1 1 10 ILE HD11 H 4.895 0.443 -5.844 1.00 . A A . 10 ILE HD11 1 1
4 888 1 1 10 ILE HD12 H 5.296 -0.583 -7.238 1.00 . A A . 10 ILE HD12 1 1
4 889 1 1 10 ILE HD13 H 3.919 0.537 -7.328 1.00 . A A . 10 ILE HD13 1 1
4 890 1 1 10 ILE HG12 H 4.155 -2.020 -5.602 1.00 . A A . 10 ILE HG12 1 1
4 891 1 1 10 ILE HG13 H 3.135 -1.823 -7.000 1.00 . A A . 10 ILE HG13 1 1
4 892 1 1 10 ILE HG21 H 0.446 0.272 -5.446 1.00 . A A . 10 ILE HG21 1 1
4 893 1 1 10 ILE HG22 H 1.853 1.100 -6.144 1.00 . A A . 10 ILE HG22 1 1
4 894 1 1 10 ILE HG23 H 1.123 -0.299 -6.978 1.00 . A A . 10 ILE HG23 1 1
4 895 1 1 10 ILE N N 3.591 -1.220 -2.999 1.00 . A A . 10 ILE N 1 1
4 896 1 1 10 ILE O O 0.628 -1.051 -2.757 1.00 . A A . 10 ILE O 1 1
4 897 1 1 11 GLU C C -0.341 0.656 -0.391 1.00 . A A . 11 GLU C 1 1
4 898 1 1 11 GLU CA C 0.029 1.534 -1.641 1.00 . A A . 11 GLU CA 1 1
4 899 1 1 11 GLU CB C -1.090 1.840 -2.703 1.00 . A A . 11 GLU CB 1 1
4 900 1 1 11 GLU CD C -2.689 3.270 -1.240 1.00 . A A . 11 GLU CD 1 1
4 901 1 1 11 GLU CG C -2.535 2.126 -2.248 1.00 . A A . 11 GLU CG 1 1
4 902 1 1 11 GLU H H 2.106 1.670 -2.415 1.00 . A A . 11 GLU H 1 1
4 903 1 1 11 GLU HA H 0.265 2.532 -1.223 1.00 . A A . 11 GLU HA 1 1
4 904 1 1 11 GLU HB2 H -0.836 2.713 -3.341 1.00 . A A . 11 GLU HB2 1 1
4 905 1 1 11 GLU HB3 H -1.106 0.994 -3.409 1.00 . A A . 11 GLU HB3 1 1
4 906 1 1 11 GLU HE2 H -2.832 5.211 -1.216 1.00 . A A . 11 GLU HE2 1 1
4 907 1 1 11 GLU HG2 H -3.137 2.356 -3.146 1.00 . A A . 11 GLU HG2 1 1
4 908 1 1 11 GLU HG3 H -2.992 1.209 -1.839 1.00 . A A . 11 GLU HG3 1 1
4 909 1 1 11 GLU N N 1.269 1.084 -2.346 1.00 . A A . 11 GLU N 1 1
4 910 1 1 11 GLU O O -1.480 0.219 -0.245 1.00 . A A . 11 GLU O 1 1
4 911 1 1 11 GLU OE1 O -2.762 3.095 -0.023 1.00 . A A . 11 GLU OE1 1 1
4 912 1 1 11 GLU OE2 O -2.735 4.497 -1.850 1.00 . A A . 11 GLU OE2 1 1
4 913 1 1 12 CYS C C -0.377 0.826 2.896 1.00 . A A . 12 CYS C 1 1
4 914 1 1 12 CYS CA C 0.352 -0.125 1.894 1.00 . A A . 12 CYS CA 1 1
4 915 1 1 12 CYS CB C 1.687 -0.565 2.560 1.00 . A A . 12 CYS CB 1 1
4 916 1 1 12 CYS H H 1.446 1.020 0.358 1.00 . A A . 12 CYS H 1 1
4 917 1 1 12 CYS HA H -0.274 -1.024 1.769 1.00 . A A . 12 CYS HA 1 1
4 918 1 1 12 CYS HB2 H 2.410 0.270 2.508 1.00 . A A . 12 CYS HB2 1 1
4 919 1 1 12 CYS HB3 H 1.575 -0.793 3.637 1.00 . A A . 12 CYS HB3 1 1
4 920 1 1 12 CYS N N 0.608 0.478 0.550 1.00 . A A . 12 CYS N 1 1
4 921 1 1 12 CYS O O -1.075 0.322 3.782 1.00 . A A . 12 CYS O 1 1
4 922 1 1 12 CYS SG S 2.501 -1.975 1.763 1.00 . A A . 12 CYS SG 1 1
4 923 1 1 13 GLY C C -0.863 4.608 3.330 1.00 . A A . 13 GLY C 1 1
4 924 1 1 13 GLY CA C -0.793 3.120 3.742 1.00 . A A . 13 GLY CA 1 1
4 925 1 1 13 GLY H H 0.386 2.422 1.979 1.00 . A A . 13 GLY H 1 1
4 926 1 1 13 GLY HA2 H -1.820 2.797 4.003 1.00 . A A . 13 GLY HA2 1 1
4 927 1 1 13 GLY HA3 H -0.226 3.058 4.689 1.00 . A A . 13 GLY HA3 1 1
4 928 1 1 13 GLY N N -0.206 2.157 2.780 1.00 . A A . 13 GLY N 1 1
4 929 1 1 13 GLY O O -1.772 5.296 3.803 1.00 . A A . 13 GLY O 1 1
4 930 1 1 14 ABA C C 1.827 7.018 2.529 1.00 . A A . 14 ABA C 1 1
4 931 1 1 14 ABA CA C 0.315 6.604 2.376 1.00 . A A . 14 ABA CA 1 1
4 932 1 1 14 ABA CB C -0.396 7.232 1.118 1.00 . A A . 14 ABA CB 1 1
4 933 1 1 14 ABA CG C -1.778 6.678 0.727 1.00 . A A . 14 ABA CG 1 1
4 934 1 1 14 ABA H H 0.778 4.455 2.181 1.00 . A A . 14 ABA H 1 1
4 935 1 1 14 ABA HA H -0.163 7.104 3.241 1.00 . A A . 14 ABA HA 1 1
4 936 1 1 14 ABA HB2 H -0.562 8.296 1.373 1.00 . A A . 14 ABA HB2 1 1
4 937 1 1 14 ABA HG1 H -1.711 5.615 0.433 1.00 . A A . 14 ABA HG1 1 1
4 938 1 1 14 ABA HG2 H -2.200 7.227 -0.132 1.00 . A A . 14 ABA HG2 1 1
4 939 1 1 14 ABA HG3 H -2.495 6.745 1.563 1.00 . A A . 14 ABA HG3 1 1
4 940 1 1 14 ABA N N 0.091 5.129 2.530 1.00 . A A . 14 ABA N 1 1
4 941 1 1 14 ABA O O 2.214 8.091 2.056 1.00 . A A . 14 ABA O 1 1
4 942 1 1 15 VAL C C 5.058 5.396 3.420 1.00 . A A . 15 VAL C 1 1
4 943 1 1 15 VAL CA C 4.068 6.594 3.624 1.00 . A A . 15 VAL CA 1 1
4 944 1 1 15 VAL CB C 4.156 7.215 5.072 1.00 . A A . 15 VAL CB 1 1
4 945 1 1 15 VAL CG1 C 5.591 7.626 5.489 1.00 . A A . 15 VAL CG1 1 1
4 946 1 1 15 VAL CG2 C 3.251 8.453 5.295 1.00 . A A . 15 VAL CG2 1 1
4 947 1 1 15 VAL H H 2.239 5.340 3.547 1.00 . A A . 15 VAL H 1 1
4 948 1 1 15 VAL HA H 4.421 7.362 2.919 1.00 . A A . 15 VAL HA 1 1
4 949 1 1 15 VAL HB H 3.823 6.443 5.792 1.00 . A A . 15 VAL HB 1 1
4 950 1 1 15 VAL HG11 H 6.019 8.385 4.808 1.00 . A A . 15 VAL HG11 1 1
4 951 1 1 15 VAL HG12 H 5.624 8.044 6.513 1.00 . A A . 15 VAL HG12 1 1
4 952 1 1 15 VAL HG13 H 6.283 6.763 5.491 1.00 . A A . 15 VAL HG13 1 1
4 953 1 1 15 VAL HG21 H 3.490 9.273 4.591 1.00 . A A . 15 VAL HG21 1 1
4 954 1 1 15 VAL HG22 H 2.181 8.211 5.160 1.00 . A A . 15 VAL HG22 1 1
4 955 1 1 15 VAL HG23 H 3.344 8.859 6.319 1.00 . A A . 15 VAL HG23 1 1
4 956 1 1 15 VAL N N 2.664 6.226 3.248 1.00 . A A . 15 VAL N 1 1
4 957 1 1 15 VAL O O 6.130 5.591 2.839 1.00 . A A . 15 VAL O 1 1
4 958 1 1 16 ILE C C 6.188 2.446 2.812 1.00 . A A . 16 ILE C 1 1
4 959 1 1 16 ILE CA C 5.714 3.077 4.164 1.00 . A A . 16 ILE CA 1 1
4 960 1 1 16 ILE CB C 5.125 2.085 5.244 1.00 . A A . 16 ILE CB 1 1
4 961 1 1 16 ILE CD1 C 6.316 3.100 7.385 1.00 . A A . 16 ILE CD1 1 1
4 962 1 1 16 ILE CG1 C 5.011 2.691 6.679 1.00 . A A . 16 ILE CG1 1 1
4 963 1 1 16 ILE CG2 C 5.803 0.691 5.311 1.00 . A A . 16 ILE CG2 1 1
4 964 1 1 16 ILE H H 3.771 4.157 4.274 1.00 . A A . 16 ILE H 1 1
4 965 1 1 16 ILE HA H 6.630 3.514 4.608 1.00 . A A . 16 ILE HA 1 1
4 966 1 1 16 ILE HB H 4.082 1.865 4.953 1.00 . A A . 16 ILE HB 1 1
4 967 1 1 16 ILE HD11 H 7.014 2.250 7.490 1.00 . A A . 16 ILE HD11 1 1
4 968 1 1 16 ILE HD12 H 6.846 3.905 6.844 1.00 . A A . 16 ILE HD12 1 1
4 969 1 1 16 ILE HD13 H 6.111 3.479 8.403 1.00 . A A . 16 ILE HD13 1 1
4 970 1 1 16 ILE HG12 H 4.347 3.575 6.649 1.00 . A A . 16 ILE HG12 1 1
4 971 1 1 16 ILE HG13 H 4.474 1.976 7.332 1.00 . A A . 16 ILE HG13 1 1
4 972 1 1 16 ILE HG21 H 6.882 0.759 5.537 1.00 . A A . 16 ILE HG21 1 1
4 973 1 1 16 ILE HG22 H 5.339 0.043 6.079 1.00 . A A . 16 ILE HG22 1 1
4 974 1 1 16 ILE HG23 H 5.703 0.142 4.356 1.00 . A A . 16 ILE HG23 1 1
4 975 1 1 16 ILE N N 4.744 4.202 3.960 1.00 . A A . 16 ILE N 1 1
4 976 1 1 16 ILE O O 7.381 2.514 2.498 1.00 . A A . 16 ILE O 1 1
4 977 1 1 17 CYS C C 5.389 2.732 -0.348 1.00 . A A . 17 CYS C 1 1
4 978 1 1 17 CYS CA C 5.530 1.498 0.599 1.00 . A A . 17 CYS CA 1 1
4 979 1 1 17 CYS CB C 4.619 0.271 0.296 1.00 . A A . 17 CYS CB 1 1
4 980 1 1 17 CYS H H 4.305 1.999 2.366 1.00 . A A . 17 CYS H 1 1
4 981 1 1 17 CYS HA H 6.570 1.156 0.463 1.00 . A A . 17 CYS HA 1 1
4 982 1 1 17 CYS HB2 H 3.712 0.247 0.919 1.00 . A A . 17 CYS HB2 1 1
4 983 1 1 17 CYS HB3 H 4.204 0.276 -0.719 1.00 . A A . 17 CYS HB3 1 1
4 984 1 1 17 CYS N N 5.263 1.881 2.016 1.00 . A A . 17 CYS N 1 1
4 985 1 1 17 CYS O O 5.372 3.887 0.095 1.00 . A A . 17 CYS O 1 1
4 986 1 1 17 CYS SG S 5.503 -1.286 0.551 1.00 . A A . 17 CYS SG 1 1
4 987 1 1 18 ALA C C 3.329 3.633 -2.763 1.00 . A A . 18 ALA C 1 1
4 988 1 1 18 ALA CA C 4.873 3.515 -2.659 1.00 . A A . 18 ALA CA 1 1
4 989 1 1 18 ALA CB C 5.572 3.243 -4.004 1.00 . A A . 18 ALA CB 1 1
4 990 1 1 18 ALA H H 5.424 1.489 -1.881 1.00 . A A . 18 ALA H 1 1
4 991 1 1 18 ALA HA H 5.178 4.537 -2.346 1.00 . A A . 18 ALA HA 1 1
4 992 1 1 18 ALA HB1 H 6.673 3.222 -3.903 1.00 . A A . 18 ALA HB1 1 1
4 993 1 1 18 ALA HB2 H 5.261 2.280 -4.447 1.00 . A A . 18 ALA HB2 1 1
4 994 1 1 18 ALA HB3 H 5.337 4.029 -4.746 1.00 . A A . 18 ALA HB3 1 1
4 995 1 1 18 ALA N N 5.315 2.486 -1.667 1.00 . A A . 18 ALA N 1 1
4 996 1 1 18 ALA O O 2.707 3.515 -3.822 1.00 . A A . 18 ALA O 1 1
4 997 1 1 19 CYS C C 3.344 6.121 -0.570 1.00 . A A . 19 CYS C 1 1
4 998 1 1 19 CYS CA C 2.327 5.466 -1.522 1.00 . A A . 19 CYS CA 1 1
4 999 1 1 19 CYS CB C 0.897 5.593 -0.911 1.00 . A A . 19 CYS CB 1 1
4 1000 1 1 19 CYS H H 3.298 3.758 -0.847 1.00 . A A . 19 CYS H 1 1
4 1001 1 1 19 CYS HXT H 4.036 5.992 1.269 1.00 . A A . 19 CYS HXT 1 1
4 1002 1 1 19 CYS HA H 2.489 5.948 -2.510 1.00 . A A . 19 CYS HA 1 1
4 1003 1 1 19 CYS HB2 H 0.040 5.271 -1.549 1.00 . A A . 19 CYS HB2 1 1
4 1004 1 1 19 CYS HB3 H 0.817 4.947 -0.019 1.00 . A A . 19 CYS HB3 1 1
4 1005 1 1 19 CYS N N 2.725 4.058 -1.642 1.00 . A A . 19 CYS N 1 1
4 1006 1 1 19 CYS O O 4.064 7.065 -0.895 1.00 . A A . 19 CYS O 1 1
4 1007 1 1 19 CYS OXT O 3.384 5.536 0.733 1.00 . A A . 19 CYS OXT 1 1
4 1008 1 1 19 CYS SG S 0.624 7.306 -0.387 1.00 . A A . 19 CYS SG 1 1
5 1009 1 1 1 DAL C C -6.204 -0.297 1.512 1.00 . A A . 1 DAL C 1 1
5 1010 1 1 1 DAL CA C -5.121 -1.298 2.018 1.00 . A A . 1 DAL CA 1 1
5 1011 1 1 1 DAL CB C -3.663 -0.896 1.708 1.00 . A A . 1 DAL CB 1 1
5 1012 1 1 1 DAL H1 H -4.563 -2.316 3.732 1.00 . A A . 1 DAL H1 1 1
5 1013 1 1 1 DAL H2 H -6.156 -1.956 3.685 1.00 . A A . 1 DAL H2 1 1
5 1014 1 1 1 DAL HA H -5.314 -2.254 1.495 1.00 . A A . 1 DAL HA 1 1
5 1015 1 1 1 DAL HB1 H -3.317 -0.063 2.349 1.00 . A A . 1 DAL HB1 1 1
5 1016 1 1 1 DAL HB2 H -3.580 -0.531 0.670 1.00 . A A . 1 DAL HB2 1 1
5 1017 1 1 1 DAL N N -5.227 -1.581 3.467 1.00 . A A . 1 DAL N 1 1
5 1018 1 1 1 DAL O O -7.093 0.146 2.248 1.00 . A A . 1 DAL O 1 1
5 1019 1 1 2 SER C C -7.952 -0.915 -1.293 1.00 . A A . 2 SER C 1 1
5 1020 1 1 2 SER CA C -7.381 0.360 -0.592 1.00 . A A . 2 SER CA 1 1
5 1021 1 1 2 SER CB C -6.996 1.483 -1.585 1.00 . A A . 2 SER CB 1 1
5 1022 1 1 2 SER H H -5.351 -0.421 -0.278 1.00 . A A . 2 SER H 1 1
5 1023 1 1 2 SER HA H -8.165 0.780 0.071 1.00 . A A . 2 SER HA 1 1
5 1024 1 1 2 SER HB2 H -6.195 1.152 -2.273 1.00 . A A . 2 SER HB2 1 1
5 1025 1 1 2 SER HB3 H -7.861 1.737 -2.226 1.00 . A A . 2 SER HB3 1 1
5 1026 1 1 2 SER HG H -5.809 2.407 -0.386 1.00 . A A . 2 SER HG 1 1
5 1027 1 1 2 SER N N -6.178 -0.043 0.188 1.00 . A A . 2 SER N 1 1
5 1028 1 1 2 SER O O -7.828 -1.105 -2.508 1.00 . A A . 2 SER O 1 1
5 1029 1 1 2 SER OG O -6.577 2.660 -0.903 1.00 . A A . 2 SER OG 1 1
5 1030 1 1 3 GLY C C -7.523 -4.078 -0.748 1.00 . A A . 3 GLY C 1 1
5 1031 1 1 3 GLY CA C -8.806 -3.217 -0.879 1.00 . A A . 3 GLY CA 1 1
5 1032 1 1 3 GLY H H -8.360 -1.568 0.513 1.00 . A A . 3 GLY H 1 1
5 1033 1 1 3 GLY HA2 H -9.587 -3.620 -0.200 1.00 . A A . 3 GLY HA2 1 1
5 1034 1 1 3 GLY HA3 H -9.272 -3.264 -1.883 1.00 . A A . 3 GLY HA3 1 1
5 1035 1 1 3 GLY N N -8.525 -1.818 -0.471 1.00 . A A . 3 GLY N 1 1
5 1036 1 1 3 GLY O O -7.060 -4.281 0.379 1.00 . A A . 3 GLY O 1 1
5 1037 1 1 4 TRP C C -4.871 -4.520 -3.231 1.00 . A A . 4 TRP C 1 1
5 1038 1 1 4 TRP CA C -5.503 -4.988 -1.888 1.00 . A A . 4 TRP CA 1 1
5 1039 1 1 4 TRP CB C -5.302 -6.502 -1.665 1.00 . A A . 4 TRP CB 1 1
5 1040 1 1 4 TRP CD1 C -6.704 -7.463 0.344 1.00 . A A . 4 TRP CD1 1 1
5 1041 1 1 4 TRP CD2 C -4.537 -7.161 0.754 1.00 . A A . 4 TRP CD2 1 1
5 1042 1 1 4 TRP CE2 C -5.177 -7.642 1.924 1.00 . A A . 4 TRP CE2 1 1
5 1043 1 1 4 TRP CE3 C -3.143 -6.904 0.752 1.00 . A A . 4 TRP CE3 1 1
5 1044 1 1 4 TRP CG C -5.495 -7.028 -0.238 1.00 . A A . 4 TRP CG 1 1
5 1045 1 1 4 TRP CH2 C -3.055 -7.577 3.089 1.00 . A A . 4 TRP CH2 1 1
5 1046 1 1 4 TRP CZ2 C -4.425 -7.850 3.108 1.00 . A A . 4 TRP CZ2 1 1
5 1047 1 1 4 TRP CZ3 C -2.424 -7.111 1.929 1.00 . A A . 4 TRP CZ3 1 1
5 1048 1 1 4 TRP H H -7.312 -4.229 -2.772 1.00 . A A . 4 TRP H 1 1
5 1049 1 1 4 TRP HA H -4.947 -4.509 -1.066 1.00 . A A . 4 TRP HA 1 1
5 1050 1 1 4 TRP HB2 H -5.976 -6.985 -2.363 1.00 . A A . 4 TRP HB2 1 1
5 1051 1 1 4 TRP HB3 H -4.290 -6.804 -1.997 1.00 . A A . 4 TRP HB3 1 1
5 1052 1 1 4 TRP HD1 H -7.657 -7.475 -0.166 1.00 . A A . 4 TRP HD1 1 1
5 1053 1 1 4 TRP HE1 H -7.250 -8.175 2.340 1.00 . A A . 4 TRP HE1 1 1
5 1054 1 1 4 TRP HE3 H -2.644 -6.549 -0.138 1.00 . A A . 4 TRP HE3 1 1
5 1055 1 1 4 TRP HH2 H -2.471 -7.729 3.985 1.00 . A A . 4 TRP HH2 1 1
5 1056 1 1 4 TRP HZ2 H -4.891 -8.213 4.013 1.00 . A A . 4 TRP HZ2 1 1
5 1057 1 1 4 TRP HZ3 H -1.363 -6.909 1.944 1.00 . A A . 4 TRP HZ3 1 1
5 1058 1 1 4 TRP N N -6.920 -4.529 -1.873 1.00 . A A . 4 TRP N 1 1
5 1059 1 1 4 TRP NE1 N -6.531 -7.839 1.689 1.00 . A A . 4 TRP NE1 1 1
5 1060 1 1 4 TRP O O -4.610 -5.284 -4.166 1.00 . A A . 4 TRP O 1 1
5 1061 1 1 5 VAL C C -2.116 -3.019 -3.087 1.00 . A A . 5 VAL C 1 1
5 1062 1 1 5 VAL CA C -3.357 -2.681 -3.968 1.00 . A A . 5 VAL CA 1 1
5 1063 1 1 5 VAL CB C -3.560 -1.204 -4.471 1.00 . A A . 5 VAL CB 1 1
5 1064 1 1 5 VAL CG1 C -2.329 -0.682 -5.246 1.00 . A A . 5 VAL CG1 1 1
5 1065 1 1 5 VAL CG2 C -4.804 -1.043 -5.378 1.00 . A A . 5 VAL CG2 1 1
5 1066 1 1 5 VAL H H -4.901 -2.819 -2.368 1.00 . A A . 5 VAL H 1 1
5 1067 1 1 5 VAL HA H -3.202 -3.265 -4.877 1.00 . A A . 5 VAL HA 1 1
5 1068 1 1 5 VAL HB H -3.715 -0.522 -3.616 1.00 . A A . 5 VAL HB 1 1
5 1069 1 1 5 VAL HG11 H -1.414 -0.710 -4.627 1.00 . A A . 5 VAL HG11 1 1
5 1070 1 1 5 VAL HG12 H -2.124 -1.281 -6.153 1.00 . A A . 5 VAL HG12 1 1
5 1071 1 1 5 VAL HG13 H -2.458 0.370 -5.564 1.00 . A A . 5 VAL HG13 1 1
5 1072 1 1 5 VAL HG21 H -4.752 -1.687 -6.275 1.00 . A A . 5 VAL HG21 1 1
5 1073 1 1 5 VAL HG22 H -5.736 -1.306 -4.842 1.00 . A A . 5 VAL HG22 1 1
5 1074 1 1 5 VAL HG23 H -4.931 0.000 -5.724 1.00 . A A . 5 VAL HG23 1 1
5 1075 1 1 5 VAL N N -4.534 -3.226 -3.228 1.00 . A A . 5 VAL N 1 1
5 1076 1 1 5 VAL O O -1.421 -3.996 -3.376 1.00 . A A . 5 VAL O 1 1
5 1077 1 1 6 CYS C C -0.416 -3.932 -0.583 1.00 . A A . 6 CYS C 1 1
5 1078 1 1 6 CYS CA C -1.496 -2.809 -0.661 1.00 . A A . 6 CYS CA 1 1
5 1079 1 1 6 CYS CB C -2.680 -3.142 0.278 1.00 . A A . 6 CYS CB 1 1
5 1080 1 1 6 CYS H H -2.389 -1.372 -2.059 1.00 . A A . 6 CYS H 1 1
5 1081 1 1 6 CYS HA H -1.101 -1.886 -0.209 1.00 . A A . 6 CYS HA 1 1
5 1082 1 1 6 CYS HB2 H -3.658 -2.900 -0.162 1.00 . A A . 6 CYS HB2 1 1
5 1083 1 1 6 CYS HB3 H -2.702 -4.223 0.455 1.00 . A A . 6 CYS HB3 1 1
5 1084 1 1 6 CYS N N -1.939 -2.286 -1.980 1.00 . A A . 6 CYS N 1 1
5 1085 1 1 6 CYS O O -0.583 -5.082 -1.000 1.00 . A A . 6 CYS O 1 1
5 1086 1 1 6 CYS SG S -2.552 -2.315 1.887 1.00 . A A . 6 CYS SG 1 1
5 1087 1 1 7 ABA C C 2.812 -4.954 0.204 1.00 . A A . 7 ABA C 1 1
5 1088 1 1 7 ABA CA C 1.506 -4.448 0.898 1.00 . A A . 7 ABA CA 1 1
5 1089 1 1 7 ABA CB C 1.791 -3.595 2.178 1.00 . A A . 7 ABA CB 1 1
5 1090 1 1 7 ABA CG C 0.554 -3.502 3.109 1.00 . A A . 7 ABA CG 1 1
5 1091 1 1 7 ABA H H 0.351 -2.668 0.563 1.00 . A A . 7 ABA H 1 1
5 1092 1 1 7 ABA HA H 0.943 -5.356 1.195 1.00 . A A . 7 ABA HA 1 1
5 1093 1 1 7 ABA HB2 H 2.588 -4.070 2.782 1.00 . A A . 7 ABA HB2 1 1
5 1094 1 1 7 ABA HG1 H 0.176 -4.506 3.380 1.00 . A A . 7 ABA HG1 1 1
5 1095 1 1 7 ABA HG2 H 0.763 -2.959 4.044 1.00 . A A . 7 ABA HG2 1 1
5 1096 1 1 7 ABA HG3 H -0.290 -2.992 2.617 1.00 . A A . 7 ABA HG3 1 1
5 1097 1 1 7 ABA N N 0.635 -3.540 0.109 1.00 . A A . 7 ABA N 1 1
5 1098 1 1 7 ABA O O 3.760 -5.315 0.910 1.00 . A A . 7 ABA O 1 1
5 1099 1 1 8 LEU C C 4.647 -4.191 -2.676 1.00 . A A . 8 LEU C 1 1
5 1100 1 1 8 LEU CA C 4.107 -5.419 -1.883 1.00 . A A . 8 LEU CA 1 1
5 1101 1 1 8 LEU CB C 3.889 -6.686 -2.774 1.00 . A A . 8 LEU CB 1 1
5 1102 1 1 8 LEU CD1 C 4.583 -8.496 -1.049 1.00 . A A . 8 LEU CD1 1 1
5 1103 1 1 8 LEU CD2 C 2.119 -8.209 -1.617 1.00 . A A . 8 LEU CD2 1 1
5 1104 1 1 8 LEU CG C 3.567 -8.066 -2.127 1.00 . A A . 8 LEU CG 1 1
5 1105 1 1 8 LEU H H 2.078 -4.572 -1.615 1.00 . A A . 8 LEU H 1 1
5 1106 1 1 8 LEU HA H 4.927 -5.671 -1.178 1.00 . A A . 8 LEU HA 1 1
5 1107 1 1 8 LEU HB2 H 3.127 -6.469 -3.548 1.00 . A A . 8 LEU HB2 1 1
5 1108 1 1 8 LEU HB3 H 4.815 -6.838 -3.364 1.00 . A A . 8 LEU HB3 1 1
5 1109 1 1 8 LEU HD11 H 5.621 -8.454 -1.430 1.00 . A A . 8 LEU HD11 1 1
5 1110 1 1 8 LEU HD12 H 4.536 -7.851 -0.152 1.00 . A A . 8 LEU HD12 1 1
5 1111 1 1 8 LEU HD13 H 4.407 -9.535 -0.713 1.00 . A A . 8 LEU HD13 1 1
5 1112 1 1 8 LEU HD21 H 1.383 -7.903 -2.384 1.00 . A A . 8 LEU HD21 1 1
5 1113 1 1 8 LEU HD22 H 1.886 -9.258 -1.354 1.00 . A A . 8 LEU HD22 1 1
5 1114 1 1 8 LEU HD23 H 1.923 -7.604 -0.713 1.00 . A A . 8 LEU HD23 1 1
5 1115 1 1 8 LEU HG H 3.661 -8.804 -2.946 1.00 . A A . 8 LEU HG 1 1
5 1116 1 1 8 LEU N N 2.863 -5.040 -1.145 1.00 . A A . 8 LEU N 1 1
5 1117 1 1 8 LEU O O 4.792 -4.219 -3.902 1.00 . A A . 8 LEU O 1 1
5 1118 1 1 9 ABA C C 4.822 -0.847 -3.199 1.00 . A A . 9 ABA C 1 1
5 1119 1 1 9 ABA CA C 5.687 -1.921 -2.460 1.00 . A A . 9 ABA CA 1 1
5 1120 1 1 9 ABA CB C 6.523 -1.314 -1.287 1.00 . A A . 9 ABA CB 1 1
5 1121 1 1 9 ABA CG C 7.778 -2.143 -0.956 1.00 . A A . 9 ABA CG 1 1
5 1122 1 1 9 ABA H H 4.772 -3.216 -0.934 1.00 . A A . 9 ABA H 1 1
5 1123 1 1 9 ABA HA H 6.413 -2.260 -3.227 1.00 . A A . 9 ABA HA 1 1
5 1124 1 1 9 ABA HB2 H 6.873 -0.300 -1.558 1.00 . A A . 9 ABA HB2 1 1
5 1125 1 1 9 ABA HG1 H 7.514 -3.166 -0.624 1.00 . A A . 9 ABA HG1 1 1
5 1126 1 1 9 ABA HG2 H 8.361 -1.679 -0.142 1.00 . A A . 9 ABA HG2 1 1
5 1127 1 1 9 ABA HG3 H 8.445 -2.245 -1.831 1.00 . A A . 9 ABA HG3 1 1
5 1128 1 1 9 ABA N N 4.990 -3.124 -1.931 1.00 . A A . 9 ABA N 1 1
5 1129 1 1 9 ABA O O 5.424 0.050 -3.796 1.00 . A A . 9 ABA O 1 1
5 1130 1 1 10 ILE C C 1.355 0.213 -2.926 1.00 . A A . 10 ILE C 1 1
5 1131 1 1 10 ILE CA C 2.602 0.105 -3.857 1.00 . A A . 10 ILE CA 1 1
5 1132 1 1 10 ILE CB C 2.172 -0.200 -5.351 1.00 . A A . 10 ILE CB 1 1
5 1133 1 1 10 ILE CD1 C 3.719 -2.061 -6.382 1.00 . A A . 10 ILE CD1 1 1
5 1134 1 1 10 ILE CG1 C 3.275 -0.591 -6.393 1.00 . A A . 10 ILE CG1 1 1
5 1135 1 1 10 ILE CG2 C 1.396 1.009 -5.941 1.00 . A A . 10 ILE CG2 1 1
5 1136 1 1 10 ILE H H 3.061 -1.676 -2.657 1.00 . A A . 10 ILE H 1 1
5 1137 1 1 10 ILE HA H 3.137 1.079 -3.827 1.00 . A A . 10 ILE HA 1 1
5 1138 1 1 10 ILE HB H 1.457 -1.046 -5.324 1.00 . A A . 10 ILE HB 1 1
5 1139 1 1 10 ILE HD11 H 2.860 -2.751 -6.470 1.00 . A A . 10 ILE HD11 1 1
5 1140 1 1 10 ILE HD12 H 4.397 -2.274 -7.228 1.00 . A A . 10 ILE HD12 1 1
5 1141 1 1 10 ILE HD13 H 4.268 -2.325 -5.466 1.00 . A A . 10 ILE HD13 1 1
5 1142 1 1 10 ILE HG12 H 2.909 -0.423 -7.428 1.00 . A A . 10 ILE HG12 1 1
5 1143 1 1 10 ILE HG13 H 4.159 0.067 -6.308 1.00 . A A . 10 ILE HG13 1 1
5 1144 1 1 10 ILE HG21 H 0.516 1.281 -5.329 1.00 . A A . 10 ILE HG21 1 1
5 1145 1 1 10 ILE HG22 H 2.031 1.912 -6.013 1.00 . A A . 10 ILE HG22 1 1
5 1146 1 1 10 ILE HG23 H 1.004 0.800 -6.954 1.00 . A A . 10 ILE HG23 1 1
5 1147 1 1 10 ILE N N 3.469 -0.920 -3.217 1.00 . A A . 10 ILE N 1 1
5 1148 1 1 10 ILE O O 0.546 -0.717 -2.840 1.00 . A A . 10 ILE O 1 1
5 1149 1 1 11 GLU C C -0.376 0.842 -0.318 1.00 . A A . 11 GLU C 1 1
5 1150 1 1 11 GLU CA C -0.045 1.785 -1.532 1.00 . A A . 11 GLU CA 1 1
5 1151 1 1 11 GLU CB C -1.194 2.132 -2.548 1.00 . A A . 11 GLU CB 1 1
5 1152 1 1 11 GLU CD C -3.574 2.944 -3.078 1.00 . A A . 11 GLU CD 1 1
5 1153 1 1 11 GLU CG C -2.621 2.398 -2.010 1.00 . A A . 11 GLU CG 1 1
5 1154 1 1 11 GLU H H 2.029 1.977 -2.324 1.00 . A A . 11 GLU H 1 1
5 1155 1 1 11 GLU HA H 0.194 2.758 -1.063 1.00 . A A . 11 GLU HA 1 1
5 1156 1 1 11 GLU HB2 H -0.942 3.038 -3.140 1.00 . A A . 11 GLU HB2 1 1
5 1157 1 1 11 GLU HB3 H -1.220 1.323 -3.295 1.00 . A A . 11 GLU HB3 1 1
5 1158 1 1 11 GLU HE2 H -4.241 4.652 -3.730 1.00 . A A . 11 GLU HE2 1 1
5 1159 1 1 11 GLU HG2 H -3.071 1.468 -1.619 1.00 . A A . 11 GLU HG2 1 1
5 1160 1 1 11 GLU HG3 H -2.579 3.096 -1.153 1.00 . A A . 11 GLU HG3 1 1
5 1161 1 1 11 GLU N N 1.189 1.387 -2.286 1.00 . A A . 11 GLU N 1 1
5 1162 1 1 11 GLU O O -1.515 0.419 -0.143 1.00 . A A . 11 GLU O 1 1
5 1163 1 1 11 GLU OE1 O -4.201 2.227 -3.858 1.00 . A A . 11 GLU OE1 1 1
5 1164 1 1 11 GLU OE2 O -3.643 4.313 -3.060 1.00 . A A . 11 GLU OE2 1 1
5 1165 1 1 12 CYS C C -0.289 0.827 2.964 1.00 . A A . 12 CYS C 1 1
5 1166 1 1 12 CYS CA C 0.388 -0.080 1.889 1.00 . A A . 12 CYS CA 1 1
5 1167 1 1 12 CYS CB C 1.734 -0.586 2.485 1.00 . A A . 12 CYS CB 1 1
5 1168 1 1 12 CYS H H 1.443 1.137 0.381 1.00 . A A . 12 CYS H 1 1
5 1169 1 1 12 CYS HA H -0.259 -0.958 1.732 1.00 . A A . 12 CYS HA 1 1
5 1170 1 1 12 CYS HB2 H 2.484 0.227 2.446 1.00 . A A . 12 CYS HB2 1 1
5 1171 1 1 12 CYS HB3 H 1.647 -0.861 3.553 1.00 . A A . 12 CYS HB3 1 1
5 1172 1 1 12 CYS N N 0.606 0.595 0.572 1.00 . A A . 12 CYS N 1 1
5 1173 1 1 12 CYS O O -0.999 0.293 3.823 1.00 . A A . 12 CYS O 1 1
5 1174 1 1 12 CYS SG S 2.475 -1.984 1.602 1.00 . A A . 12 CYS SG 1 1
5 1175 1 1 13 GLY C C -0.671 4.581 3.615 1.00 . A A . 13 GLY C 1 1
5 1176 1 1 13 GLY CA C -0.588 3.079 3.969 1.00 . A A . 13 GLY CA 1 1
5 1177 1 1 13 GLY H H 0.508 2.455 2.132 1.00 . A A . 13 GLY H 1 1
5 1178 1 1 13 GLY HA2 H -1.600 2.752 4.280 1.00 . A A . 13 GLY HA2 1 1
5 1179 1 1 13 GLY HA3 H 0.035 2.977 4.877 1.00 . A A . 13 GLY HA3 1 1
5 1180 1 1 13 GLY N N -0.063 2.156 2.936 1.00 . A A . 13 GLY N 1 1
5 1181 1 1 13 GLY O O -1.558 5.253 4.148 1.00 . A A . 13 GLY O 1 1
5 1182 1 1 14 ABA C C 1.993 7.015 2.820 1.00 . A A . 14 ABA C 1 1
5 1183 1 1 14 ABA CA C 0.476 6.608 2.689 1.00 . A A . 14 ABA CA 1 1
5 1184 1 1 14 ABA CB C -0.265 7.282 1.474 1.00 . A A . 14 ABA CB 1 1
5 1185 1 1 14 ABA CG C -1.649 6.732 1.077 1.00 . A A . 14 ABA CG 1 1
5 1186 1 1 14 ABA H H 0.926 4.466 2.401 1.00 . A A . 14 ABA H 1 1
5 1187 1 1 14 ABA HA H 0.022 7.078 3.584 1.00 . A A . 14 ABA HA 1 1
5 1188 1 1 14 ABA HB2 H -0.441 8.330 1.781 1.00 . A A . 14 ABA HB2 1 1
5 1189 1 1 14 ABA HG1 H -1.581 5.689 0.713 1.00 . A A . 14 ABA HG1 1 1
5 1190 1 1 14 ABA HG2 H -2.097 7.329 0.264 1.00 . A A . 14 ABA HG2 1 1
5 1191 1 1 14 ABA HG3 H -2.349 6.740 1.930 1.00 . A A . 14 ABA HG3 1 1
5 1192 1 1 14 ABA N N 0.253 5.129 2.796 1.00 . A A . 14 ABA N 1 1
5 1193 1 1 14 ABA O O 2.366 8.111 2.390 1.00 . A A . 14 ABA O 1 1
5 1194 1 1 15 VAL C C 5.245 5.333 3.510 1.00 . A A . 15 VAL C 1 1
5 1195 1 1 15 VAL CA C 4.274 6.530 3.802 1.00 . A A . 15 VAL CA 1 1
5 1196 1 1 15 VAL CB C 4.428 7.090 5.269 1.00 . A A . 15 VAL CB 1 1
5 1197 1 1 15 VAL CG1 C 5.883 7.482 5.636 1.00 . A A . 15 VAL CG1 1 1
5 1198 1 1 15 VAL CG2 C 3.539 8.320 5.584 1.00 . A A . 15 VAL CG2 1 1
5 1199 1 1 15 VAL H H 2.434 5.291 3.746 1.00 . A A . 15 VAL H 1 1
5 1200 1 1 15 VAL HA H 4.604 7.323 3.114 1.00 . A A . 15 VAL HA 1 1
5 1201 1 1 15 VAL HB H 4.126 6.290 5.971 1.00 . A A . 15 VAL HB 1 1
5 1202 1 1 15 VAL HG11 H 6.280 8.269 4.968 1.00 . A A . 15 VAL HG11 1 1
5 1203 1 1 15 VAL HG12 H 5.963 7.858 6.674 1.00 . A A . 15 VAL HG12 1 1
5 1204 1 1 15 VAL HG13 H 6.572 6.621 5.570 1.00 . A A . 15 VAL HG13 1 1
5 1205 1 1 15 VAL HG21 H 3.749 9.167 4.905 1.00 . A A . 15 VAL HG21 1 1
5 1206 1 1 15 VAL HG22 H 2.463 8.085 5.489 1.00 . A A . 15 VAL HG22 1 1
5 1207 1 1 15 VAL HG23 H 3.681 8.683 6.620 1.00 . A A . 15 VAL HG23 1 1
5 1208 1 1 15 VAL N N 2.852 6.188 3.472 1.00 . A A . 15 VAL N 1 1
5 1209 1 1 15 VAL O O 6.305 5.549 2.915 1.00 . A A . 15 VAL O 1 1
5 1210 1 1 16 ILE C C 6.316 2.419 2.695 1.00 . A A . 16 ILE C 1 1
5 1211 1 1 16 ILE CA C 5.888 2.964 4.099 1.00 . A A . 16 ILE CA 1 1
5 1212 1 1 16 ILE CB C 5.307 1.914 5.130 1.00 . A A . 16 ILE CB 1 1
5 1213 1 1 16 ILE CD1 C 4.461 1.728 7.610 1.00 . A A . 16 ILE CD1 1 1
5 1214 1 1 16 ILE CG1 C 5.363 2.452 6.596 1.00 . A A . 16 ILE CG1 1 1
5 1215 1 1 16 ILE CG2 C 5.966 0.509 5.063 1.00 . A A . 16 ILE CG2 1 1
5 1216 1 1 16 ILE H H 3.963 4.060 4.320 1.00 . A A . 16 ILE H 1 1
5 1217 1 1 16 ILE HA H 6.820 3.359 4.553 1.00 . A A . 16 ILE HA 1 1
5 1218 1 1 16 ILE HB H 4.240 1.756 4.884 1.00 . A A . 16 ILE HB 1 1
5 1219 1 1 16 ILE HD11 H 3.403 1.736 7.292 1.00 . A A . 16 ILE HD11 1 1
5 1220 1 1 16 ILE HD12 H 4.760 0.675 7.757 1.00 . A A . 16 ILE HD12 1 1
5 1221 1 1 16 ILE HD13 H 4.509 2.217 8.600 1.00 . A A . 16 ILE HD13 1 1
5 1222 1 1 16 ILE HG12 H 6.407 2.449 6.964 1.00 . A A . 16 ILE HG12 1 1
5 1223 1 1 16 ILE HG13 H 5.065 3.517 6.617 1.00 . A A . 16 ILE HG13 1 1
5 1224 1 1 16 ILE HG21 H 5.845 0.044 4.066 1.00 . A A . 16 ILE HG21 1 1
5 1225 1 1 16 ILE HG22 H 7.050 0.544 5.278 1.00 . A A . 16 ILE HG22 1 1
5 1226 1 1 16 ILE HG23 H 5.509 -0.204 5.773 1.00 . A A . 16 ILE HG23 1 1
5 1227 1 1 16 ILE N N 4.928 4.112 3.987 1.00 . A A . 16 ILE N 1 1
5 1228 1 1 16 ILE O O 7.497 2.502 2.346 1.00 . A A . 16 ILE O 1 1
5 1229 1 1 17 CYS C C 5.448 2.817 -0.439 1.00 . A A . 17 CYS C 1 1
5 1230 1 1 17 CYS CA C 5.584 1.555 0.469 1.00 . A A . 17 CYS CA 1 1
5 1231 1 1 17 CYS CB C 4.655 0.342 0.162 1.00 . A A . 17 CYS CB 1 1
5 1232 1 1 17 CYS H H 4.416 1.994 2.293 1.00 . A A . 17 CYS H 1 1
5 1233 1 1 17 CYS HA H 6.615 1.205 0.292 1.00 . A A . 17 CYS HA 1 1
5 1234 1 1 17 CYS HB2 H 3.800 0.266 0.854 1.00 . A A . 17 CYS HB2 1 1
5 1235 1 1 17 CYS HB3 H 4.167 0.397 -0.820 1.00 . A A . 17 CYS HB3 1 1
5 1236 1 1 17 CYS N N 5.361 1.902 1.902 1.00 . A A . 17 CYS N 1 1
5 1237 1 1 17 CYS O O 5.522 3.958 0.032 1.00 . A A . 17 CYS O 1 1
5 1238 1 1 17 CYS SG S 5.575 -1.211 0.268 1.00 . A A . 17 CYS SG 1 1
5 1239 1 1 18 ALA C C 3.296 3.894 -2.708 1.00 . A A . 18 ALA C 1 1
5 1240 1 1 18 ALA CA C 4.835 3.691 -2.692 1.00 . A A . 18 ALA CA 1 1
5 1241 1 1 18 ALA CB C 5.445 3.435 -4.084 1.00 . A A . 18 ALA CB 1 1
5 1242 1 1 18 ALA H H 5.348 1.617 -1.999 1.00 . A A . 18 ALA H 1 1
5 1243 1 1 18 ALA HA H 5.201 4.687 -2.360 1.00 . A A . 18 ALA HA 1 1
5 1244 1 1 18 ALA HB1 H 6.547 3.345 -4.044 1.00 . A A . 18 ALA HB1 1 1
5 1245 1 1 18 ALA HB2 H 5.053 2.512 -4.551 1.00 . A A . 18 ALA HB2 1 1
5 1246 1 1 18 ALA HB3 H 5.221 4.266 -4.779 1.00 . A A . 18 ALA HB3 1 1
5 1247 1 1 18 ALA N N 5.284 2.612 -1.757 1.00 . A A . 18 ALA N 1 1
5 1248 1 1 18 ALA O O 2.620 3.894 -3.741 1.00 . A A . 18 ALA O 1 1
5 1249 1 1 19 CYS C C 3.451 6.212 -0.302 1.00 . A A . 19 CYS C 1 1
5 1250 1 1 19 CYS CA C 2.413 5.662 -1.296 1.00 . A A . 19 CYS CA 1 1
5 1251 1 1 19 CYS CB C 0.992 5.765 -0.664 1.00 . A A . 19 CYS CB 1 1
5 1252 1 1 19 CYS H H 3.374 3.887 -0.788 1.00 . A A . 19 CYS H 1 1
5 1253 1 1 19 CYS HXT H 4.169 5.899 1.505 1.00 . A A . 19 CYS HXT 1 1
5 1254 1 1 19 CYS HA H 2.581 6.224 -2.241 1.00 . A A . 19 CYS HA 1 1
5 1255 1 1 19 CYS HB2 H 0.128 5.487 -1.313 1.00 . A A . 19 CYS HB2 1 1
5 1256 1 1 19 CYS HB3 H 0.920 5.065 0.189 1.00 . A A . 19 CYS HB3 1 1
5 1257 1 1 19 CYS N N 2.771 4.259 -1.529 1.00 . A A . 19 CYS N 1 1
5 1258 1 1 19 CYS O O 4.176 7.176 -0.545 1.00 . A A . 19 CYS O 1 1
5 1259 1 1 19 CYS OXT O 3.504 5.503 0.937 1.00 . A A . 19 CYS OXT 1 1
5 1260 1 1 19 CYS SG S 0.736 7.445 -0.038 1.00 . A A . 19 CYS SG 1 1
6 1261 1 1 1 DAL C C -6.044 -0.323 1.787 1.00 . A A . 1 DAL C 1 1
6 1262 1 1 1 DAL CA C -5.025 -1.419 2.232 1.00 . A A . 1 DAL CA 1 1
6 1263 1 1 1 DAL CB C -3.543 -1.061 1.984 1.00 . A A . 1 DAL CB 1 1
6 1264 1 1 1 DAL H1 H -4.558 -2.592 3.872 1.00 . A A . 1 DAL H1 1 1
6 1265 1 1 1 DAL H2 H -6.130 -2.149 3.823 1.00 . A A . 1 DAL H2 1 1
6 1266 1 1 1 DAL HA H -5.251 -2.321 1.633 1.00 . A A . 1 DAL HA 1 1
6 1267 1 1 1 DAL HB1 H -3.203 -0.239 2.643 1.00 . A A . 1 DAL HB1 1 1
6 1268 1 1 1 DAL HB2 H -3.416 -0.698 0.951 1.00 . A A . 1 DAL HB2 1 1
6 1269 1 1 1 DAL N N -5.178 -1.805 3.653 1.00 . A A . 1 DAL N 1 1
6 1270 1 1 1 DAL O O -6.911 0.121 2.549 1.00 . A A . 1 DAL O 1 1
6 1271 1 1 2 SER C C -7.866 -0.507 -1.023 1.00 . A A . 2 SER C 1 1
6 1272 1 1 2 SER CA C -7.127 0.636 -0.255 1.00 . A A . 2 SER CA 1 1
6 1273 1 1 2 SER CB C -6.598 1.748 -1.190 1.00 . A A . 2 SER CB 1 1
6 1274 1 1 2 SER H H -5.190 -0.373 -0.009 1.00 . A A . 2 SER H 1 1
6 1275 1 1 2 SER HA H -7.839 1.127 0.439 1.00 . A A . 2 SER HA 1 1
6 1276 1 1 2 SER HB2 H -5.855 1.347 -1.906 1.00 . A A . 2 SER HB2 1 1
6 1277 1 1 2 SER HB3 H -7.423 2.154 -1.806 1.00 . A A . 2 SER HB3 1 1
6 1278 1 1 2 SER HG H -6.712 3.155 0.117 1.00 . A A . 2 SER HG 1 1
6 1279 1 1 2 SER N N -5.986 0.029 0.487 1.00 . A A . 2 SER N 1 1
6 1280 1 1 2 SER O O -7.749 -0.663 -2.244 1.00 . A A . 2 SER O 1 1
6 1281 1 1 2 SER OG O -6.016 2.818 -0.453 1.00 . A A . 2 SER OG 1 1
6 1282 1 1 3 GLY C C -7.866 -3.706 -0.384 1.00 . A A . 3 GLY C 1 1
6 1283 1 1 3 GLY CA C -8.999 -2.696 -0.695 1.00 . A A . 3 GLY CA 1 1
6 1284 1 1 3 GLY H H -8.348 -1.180 0.743 1.00 . A A . 3 GLY H 1 1
6 1285 1 1 3 GLY HA2 H -9.909 -2.973 -0.122 1.00 . A A . 3 GLY HA2 1 1
6 1286 1 1 3 GLY HA3 H -9.326 -2.697 -1.753 1.00 . A A . 3 GLY HA3 1 1
6 1287 1 1 3 GLY N N -8.573 -1.348 -0.246 1.00 . A A . 3 GLY N 1 1
6 1288 1 1 3 GLY O O -7.544 -3.875 0.797 1.00 . A A . 3 GLY O 1 1
6 1289 1 1 4 TRP C C -5.082 -4.670 -2.591 1.00 . A A . 4 TRP C 1 1
6 1290 1 1 4 TRP CA C -5.841 -4.871 -1.246 1.00 . A A . 4 TRP CA 1 1
6 1291 1 1 4 TRP CB C -5.773 -6.341 -0.780 1.00 . A A . 4 TRP CB 1 1
6 1292 1 1 4 TRP CD1 C -5.385 -6.419 1.807 1.00 . A A . 4 TRP CD1 1 1
6 1293 1 1 4 TRP CD2 C -7.405 -7.083 1.146 1.00 . A A . 4 TRP CD2 1 1
6 1294 1 1 4 TRP CE2 C -7.328 -7.133 2.562 1.00 . A A . 4 TRP CE2 1 1
6 1295 1 1 4 TRP CE3 C -8.612 -7.419 0.480 1.00 . A A . 4 TRP CE3 1 1
6 1296 1 1 4 TRP CG C -6.189 -6.630 0.667 1.00 . A A . 4 TRP CG 1 1
6 1297 1 1 4 TRP CH2 C -9.636 -7.858 2.646 1.00 . A A . 4 TRP CH2 1 1
6 1298 1 1 4 TRP CZ2 C -8.460 -7.525 3.320 1.00 . A A . 4 TRP CZ2 1 1
6 1299 1 1 4 TRP CZ3 C -9.710 -7.805 1.248 1.00 . A A . 4 TRP CZ3 1 1
6 1300 1 1 4 TRP H H -7.520 -4.123 -2.363 1.00 . A A . 4 TRP H 1 1
6 1301 1 1 4 TRP HA H -5.310 -4.301 -0.468 1.00 . A A . 4 TRP HA 1 1
6 1302 1 1 4 TRP HB2 H -6.386 -6.889 -1.490 1.00 . A A . 4 TRP HB2 1 1
6 1303 1 1 4 TRP HB3 H -4.749 -6.744 -0.917 1.00 . A A . 4 TRP HB3 1 1
6 1304 1 1 4 TRP HD1 H -4.374 -6.040 1.781 1.00 . A A . 4 TRP HD1 1 1
6 1305 1 1 4 TRP HE1 H -5.725 -6.640 3.957 1.00 . A A . 4 TRP HE1 1 1
6 1306 1 1 4 TRP HE3 H -8.688 -7.368 -0.597 1.00 . A A . 4 TRP HE3 1 1
6 1307 1 1 4 TRP HH2 H -10.506 -8.157 3.212 1.00 . A A . 4 TRP HH2 1 1
6 1308 1 1 4 TRP HZ2 H -8.428 -7.564 4.400 1.00 . A A . 4 TRP HZ2 1 1
6 1309 1 1 4 TRP HZ3 H -10.637 -8.062 0.756 1.00 . A A . 4 TRP HZ3 1 1
6 1310 1 1 4 TRP N N -7.214 -4.315 -1.404 1.00 . A A . 4 TRP N 1 1
6 1311 1 1 4 TRP NE1 N -6.073 -6.727 2.995 1.00 . A A . 4 TRP NE1 1 1
6 1312 1 1 4 TRP O O -4.836 -5.594 -3.375 1.00 . A A . 4 TRP O 1 1
6 1313 1 1 5 VAL C C -2.190 -3.406 -2.719 1.00 . A A . 5 VAL C 1 1
6 1314 1 1 5 VAL CA C -3.435 -3.080 -3.597 1.00 . A A . 5 VAL CA 1 1
6 1315 1 1 5 VAL CB C -3.510 -1.672 -4.292 1.00 . A A . 5 VAL CB 1 1
6 1316 1 1 5 VAL CG1 C -2.270 -1.396 -5.175 1.00 . A A . 5 VAL CG1 1 1
6 1317 1 1 5 VAL CG2 C -4.771 -1.486 -5.169 1.00 . A A . 5 VAL CG2 1 1
6 1318 1 1 5 VAL H H -5.036 -2.831 -2.046 1.00 . A A . 5 VAL H 1 1
6 1319 1 1 5 VAL HA H -3.367 -3.788 -4.423 1.00 . A A . 5 VAL HA 1 1
6 1320 1 1 5 VAL HB H -3.551 -0.878 -3.526 1.00 . A A . 5 VAL HB 1 1
6 1321 1 1 5 VAL HG11 H -1.334 -1.421 -4.587 1.00 . A A . 5 VAL HG11 1 1
6 1322 1 1 5 VAL HG12 H -2.162 -2.139 -5.987 1.00 . A A . 5 VAL HG12 1 1
6 1323 1 1 5 VAL HG13 H -2.312 -0.397 -5.648 1.00 . A A . 5 VAL HG13 1 1
6 1324 1 1 5 VAL HG21 H -4.829 -2.236 -5.980 1.00 . A A . 5 VAL HG21 1 1
6 1325 1 1 5 VAL HG22 H -5.700 -1.577 -4.575 1.00 . A A . 5 VAL HG22 1 1
6 1326 1 1 5 VAL HG23 H -4.801 -0.486 -5.640 1.00 . A A . 5 VAL HG23 1 1
6 1327 1 1 5 VAL N N -4.633 -3.423 -2.770 1.00 . A A . 5 VAL N 1 1
6 1328 1 1 5 VAL O O -1.578 -4.455 -2.931 1.00 . A A . 5 VAL O 1 1
6 1329 1 1 6 CYS C C -0.303 -4.073 -0.265 1.00 . A A . 6 CYS C 1 1
6 1330 1 1 6 CYS CA C -1.421 -2.990 -0.363 1.00 . A A . 6 CYS CA 1 1
6 1331 1 1 6 CYS CB C -2.579 -3.346 0.602 1.00 . A A . 6 CYS CB 1 1
6 1332 1 1 6 CYS H H -2.361 -1.664 -1.824 1.00 . A A . 6 CYS H 1 1
6 1333 1 1 6 CYS HA H -1.054 -2.027 0.042 1.00 . A A . 6 CYS HA 1 1
6 1334 1 1 6 CYS HB2 H -3.566 -3.132 0.167 1.00 . A A . 6 CYS HB2 1 1
6 1335 1 1 6 CYS HB3 H -2.564 -4.424 0.806 1.00 . A A . 6 CYS HB3 1 1
6 1336 1 1 6 CYS N N -1.908 -2.571 -1.705 1.00 . A A . 6 CYS N 1 1
6 1337 1 1 6 CYS O O -0.443 -5.244 -0.631 1.00 . A A . 6 CYS O 1 1
6 1338 1 1 6 CYS SG S -2.461 -2.497 2.199 1.00 . A A . 6 CYS SG 1 1
6 1339 1 1 7 ABA C C 2.984 -4.948 0.434 1.00 . A A . 7 ABA C 1 1
6 1340 1 1 7 ABA CA C 1.673 -4.506 1.166 1.00 . A A . 7 ABA CA 1 1
6 1341 1 1 7 ABA CB C 1.941 -3.657 2.450 1.00 . A A . 7 ABA CB 1 1
6 1342 1 1 7 ABA CG C 0.713 -3.609 3.396 1.00 . A A . 7 ABA CG 1 1
6 1343 1 1 7 ABA H H 0.437 -2.763 0.839 1.00 . A A . 7 ABA H 1 1
6 1344 1 1 7 ABA HA H 1.159 -5.441 1.467 1.00 . A A . 7 ABA HA 1 1
6 1345 1 1 7 ABA HB2 H 2.766 -4.102 3.039 1.00 . A A . 7 ABA HB2 1 1
6 1346 1 1 7 ABA HG1 H 0.923 -3.082 4.339 1.00 . A A . 7 ABA HG1 1 1
6 1347 1 1 7 ABA HG2 H -0.147 -3.105 2.923 1.00 . A A . 7 ABA HG2 1 1
6 1348 1 1 7 ABA HG3 H 0.361 -4.626 3.652 1.00 . A A . 7 ABA HG3 1 1
6 1349 1 1 7 ABA N N 0.748 -3.632 0.395 1.00 . A A . 7 ABA N 1 1
6 1350 1 1 7 ABA O O 4.010 -5.153 1.092 1.00 . A A . 7 ABA O 1 1
6 1351 1 1 8 LEU C C 4.840 -4.322 -2.430 1.00 . A A . 8 LEU C 1 1
6 1352 1 1 8 LEU CA C 4.153 -5.524 -1.709 1.00 . A A . 8 LEU CA 1 1
6 1353 1 1 8 LEU CB C 3.789 -6.730 -2.633 1.00 . A A . 8 LEU CB 1 1
6 1354 1 1 8 LEU CD1 C 2.867 -7.800 -4.751 1.00 . A A . 8 LEU CD1 1 1
6 1355 1 1 8 LEU CD2 C 1.419 -6.117 -3.565 1.00 . A A . 8 LEU CD2 1 1
6 1356 1 1 8 LEU CG C 2.873 -6.525 -3.884 1.00 . A A . 8 LEU CG 1 1
6 1357 1 1 8 LEU H H 2.121 -4.751 -1.360 1.00 . A A . 8 LEU H 1 1
6 1358 1 1 8 LEU HA H 4.951 -5.893 -1.031 1.00 . A A . 8 LEU HA 1 1
6 1359 1 1 8 LEU HB2 H 4.753 -7.143 -2.989 1.00 . A A . 8 LEU HB2 1 1
6 1360 1 1 8 LEU HB3 H 3.373 -7.547 -2.011 1.00 . A A . 8 LEU HB3 1 1
6 1361 1 1 8 LEU HD11 H 3.889 -8.084 -5.066 1.00 . A A . 8 LEU HD11 1 1
6 1362 1 1 8 LEU HD12 H 2.438 -8.667 -4.214 1.00 . A A . 8 LEU HD12 1 1
6 1363 1 1 8 LEU HD13 H 2.279 -7.664 -5.678 1.00 . A A . 8 LEU HD13 1 1
6 1364 1 1 8 LEU HD21 H 0.927 -6.830 -2.877 1.00 . A A . 8 LEU HD21 1 1
6 1365 1 1 8 LEU HD22 H 1.366 -5.117 -3.098 1.00 . A A . 8 LEU HD22 1 1
6 1366 1 1 8 LEU HD23 H 0.798 -6.057 -4.478 1.00 . A A . 8 LEU HD23 1 1
6 1367 1 1 8 LEU HG H 3.306 -5.723 -4.508 1.00 . A A . 8 LEU HG 1 1
6 1368 1 1 8 LEU N N 2.951 -5.146 -0.903 1.00 . A A . 8 LEU N 1 1
6 1369 1 1 8 LEU O O 5.291 -4.430 -3.575 1.00 . A A . 8 LEU O 1 1
6 1370 1 1 9 ABA C C 4.767 -0.950 -2.964 1.00 . A A . 9 ABA C 1 1
6 1371 1 1 9 ABA CA C 5.663 -1.974 -2.194 1.00 . A A . 9 ABA CA 1 1
6 1372 1 1 9 ABA CB C 6.437 -1.349 -0.991 1.00 . A A . 9 ABA CB 1 1
6 1373 1 1 9 ABA CG C 7.653 -2.198 -0.569 1.00 . A A . 9 ABA CG 1 1
6 1374 1 1 9 ABA H H 4.579 -3.248 -0.764 1.00 . A A . 9 ABA H 1 1
6 1375 1 1 9 ABA HA H 6.434 -2.272 -2.933 1.00 . A A . 9 ABA HA 1 1
6 1376 1 1 9 ABA HB2 H 6.818 -0.350 -1.275 1.00 . A A . 9 ABA HB2 1 1
6 1377 1 1 9 ABA HG1 H 8.207 -1.724 0.259 1.00 . A A . 9 ABA HG1 1 1
6 1378 1 1 9 ABA HG2 H 8.357 -2.354 -1.406 1.00 . A A . 9 ABA HG2 1 1
6 1379 1 1 9 ABA HG3 H 7.343 -3.201 -0.215 1.00 . A A . 9 ABA HG3 1 1
6 1380 1 1 9 ABA N N 4.979 -3.198 -1.708 1.00 . A A . 9 ABA N 1 1
6 1381 1 1 9 ABA O O 5.344 -0.079 -3.621 1.00 . A A . 9 ABA O 1 1
6 1382 1 1 10 ILE C C 1.315 0.110 -2.661 1.00 . A A . 10 ILE C 1 1
6 1383 1 1 10 ILE CA C 2.517 -0.079 -3.635 1.00 . A A . 10 ILE CA 1 1
6 1384 1 1 10 ILE CB C 2.020 -0.523 -5.070 1.00 . A A . 10 ILE CB 1 1
6 1385 1 1 10 ILE CD1 C 3.315 -2.640 -5.896 1.00 . A A . 10 ILE CD1 1 1
6 1386 1 1 10 ILE CG1 C 3.060 -1.134 -6.067 1.00 . A A . 10 ILE CG1 1 1
6 1387 1 1 10 ILE CG2 C 1.320 0.668 -5.774 1.00 . A A . 10 ILE CG2 1 1
6 1388 1 1 10 ILE H H 3.024 -1.780 -2.344 1.00 . A A . 10 ILE H 1 1
6 1389 1 1 10 ILE HA H 3.048 0.895 -3.725 1.00 . A A . 10 ILE HA 1 1
6 1390 1 1 10 ILE HB H 1.241 -1.296 -4.926 1.00 . A A . 10 ILE HB 1 1
6 1391 1 1 10 ILE HD11 H 2.388 -3.228 -6.029 1.00 . A A . 10 ILE HD11 1 1
6 1392 1 1 10 ILE HD12 H 4.044 -3.007 -6.641 1.00 . A A . 10 ILE HD12 1 1
6 1393 1 1 10 ILE HD13 H 3.719 -2.888 -4.901 1.00 . A A . 10 ILE HD13 1 1
6 1394 1 1 10 ILE HG12 H 2.716 -1.019 -7.116 1.00 . A A . 10 ILE HG12 1 1
6 1395 1 1 10 ILE HG13 H 4.018 -0.584 -6.032 1.00 . A A . 10 ILE HG13 1 1
6 1396 1 1 10 ILE HG21 H 0.494 1.085 -5.168 1.00 . A A . 10 ILE HG21 1 1
6 1397 1 1 10 ILE HG22 H 2.022 1.498 -5.980 1.00 . A A . 10 ILE HG22 1 1
6 1398 1 1 10 ILE HG23 H 0.868 0.371 -6.740 1.00 . A A . 10 ILE HG23 1 1
6 1399 1 1 10 ILE N N 3.413 -1.038 -2.938 1.00 . A A . 10 ILE N 1 1
6 1400 1 1 10 ILE O O 0.477 -0.784 -2.510 1.00 . A A . 10 ILE O 1 1
6 1401 1 1 11 GLU C C -0.325 0.791 -0.035 1.00 . A A . 11 GLU C 1 1
6 1402 1 1 11 GLU CA C 0.102 1.758 -1.192 1.00 . A A . 11 GLU CA 1 1
6 1403 1 1 11 GLU CB C -1.018 2.405 -2.076 1.00 . A A . 11 GLU CB 1 1
6 1404 1 1 11 GLU CD C -2.995 2.213 -3.687 1.00 . A A . 11 GLU CD 1 1
6 1405 1 1 11 GLU CG C -1.972 1.460 -2.832 1.00 . A A . 11 GLU CG 1 1
6 1406 1 1 11 GLU H H 2.055 1.903 -2.152 1.00 . A A . 11 GLU H 1 1
6 1407 1 1 11 GLU HA H 0.515 2.628 -0.630 1.00 . A A . 11 GLU HA 1 1
6 1408 1 1 11 GLU HB2 H -1.612 3.066 -1.421 1.00 . A A . 11 GLU HB2 1 1
6 1409 1 1 11 GLU HB3 H -0.587 3.090 -2.845 1.00 . A A . 11 GLU HB3 1 1
6 1410 1 1 11 GLU HE2 H -3.259 2.765 -5.535 1.00 . A A . 11 GLU HE2 1 1
6 1411 1 1 11 GLU HG2 H -1.385 0.783 -3.476 1.00 . A A . 11 GLU HG2 1 1
6 1412 1 1 11 GLU HG3 H -2.513 0.808 -2.125 1.00 . A A . 11 GLU HG3 1 1
6 1413 1 1 11 GLU N N 1.237 1.299 -2.036 1.00 . A A . 11 GLU N 1 1
6 1414 1 1 11 GLU O O -1.501 0.473 0.130 1.00 . A A . 11 GLU O 1 1
6 1415 1 1 11 GLU OE1 O -4.033 2.694 -3.234 1.00 . A A . 11 GLU OE1 1 1
6 1416 1 1 11 GLU OE2 O -2.616 2.290 -5.003 1.00 . A A . 11 GLU OE2 1 1
6 1417 1 1 12 CYS C C -0.174 0.820 3.221 1.00 . A A . 12 CYS C 1 1
6 1418 1 1 12 CYS CA C 0.416 -0.170 2.165 1.00 . A A . 12 CYS CA 1 1
6 1419 1 1 12 CYS CB C 1.768 -0.672 2.760 1.00 . A A . 12 CYS CB 1 1
6 1420 1 1 12 CYS H H 1.559 0.814 0.565 1.00 . A A . 12 CYS H 1 1
6 1421 1 1 12 CYS HA H -0.269 -1.028 2.058 1.00 . A A . 12 CYS HA 1 1
6 1422 1 1 12 CYS HB2 H 2.518 0.143 2.735 1.00 . A A . 12 CYS HB2 1 1
6 1423 1 1 12 CYS HB3 H 1.677 -0.963 3.823 1.00 . A A . 12 CYS HB3 1 1
6 1424 1 1 12 CYS N N 0.652 0.441 0.826 1.00 . A A . 12 CYS N 1 1
6 1425 1 1 12 CYS O O -0.835 0.359 4.157 1.00 . A A . 12 CYS O 1 1
6 1426 1 1 12 CYS SG S 2.553 -2.028 1.861 1.00 . A A . 12 CYS SG 1 1
6 1427 1 1 13 GLY C C -0.542 4.582 3.648 1.00 . A A . 13 GLY C 1 1
6 1428 1 1 13 GLY CA C -0.291 3.134 4.121 1.00 . A A . 13 GLY CA 1 1
6 1429 1 1 13 GLY H H 0.601 2.352 2.222 1.00 . A A . 13 GLY H 1 1
6 1430 1 1 13 GLY HA2 H -1.192 2.798 4.671 1.00 . A A . 13 GLY HA2 1 1
6 1431 1 1 13 GLY HA3 H 0.510 3.157 4.883 1.00 . A A . 13 GLY HA3 1 1
6 1432 1 1 13 GLY N N 0.079 2.139 3.088 1.00 . A A . 13 GLY N 1 1
6 1433 1 1 13 GLY O O -1.482 5.208 4.146 1.00 . A A . 13 GLY O 1 1
6 1434 1 1 14 ABA C C 1.988 7.086 2.734 1.00 . A A . 14 ABA C 1 1
6 1435 1 1 14 ABA CA C 0.483 6.630 2.641 1.00 . A A . 14 ABA CA 1 1
6 1436 1 1 14 ABA CB C -0.309 7.256 1.432 1.00 . A A . 14 ABA CB 1 1
6 1437 1 1 14 ABA CG C -1.681 6.646 1.087 1.00 . A A . 14 ABA CG 1 1
6 1438 1 1 14 ABA H H 1.028 4.509 2.402 1.00 . A A . 14 ABA H 1 1
6 1439 1 1 14 ABA HA H 0.030 7.099 3.538 1.00 . A A . 14 ABA HA 1 1
6 1440 1 1 14 ABA HB2 H -0.513 8.303 1.723 1.00 . A A . 14 ABA HB2 1 1
6 1441 1 1 14 ABA HG1 H -1.584 5.596 0.750 1.00 . A A . 14 ABA HG1 1 1
6 1442 1 1 14 ABA HG2 H -2.172 7.205 0.272 1.00 . A A . 14 ABA HG2 1 1
6 1443 1 1 14 ABA HG3 H -2.357 6.650 1.960 1.00 . A A . 14 ABA HG3 1 1
6 1444 1 1 14 ABA N N 0.321 5.145 2.779 1.00 . A A . 14 ABA N 1 1
6 1445 1 1 14 ABA O O 2.336 8.159 2.231 1.00 . A A . 14 ABA O 1 1
6 1446 1 1 15 VAL C C 5.260 5.474 3.476 1.00 . A A . 15 VAL C 1 1
6 1447 1 1 15 VAL CA C 4.295 6.690 3.703 1.00 . A A . 15 VAL CA 1 1
6 1448 1 1 15 VAL CB C 4.481 7.356 5.121 1.00 . A A . 15 VAL CB 1 1
6 1449 1 1 15 VAL CG1 C 5.942 7.775 5.425 1.00 . A A . 15 VAL CG1 1 1
6 1450 1 1 15 VAL CG2 C 3.596 8.604 5.364 1.00 . A A . 15 VAL CG2 1 1
6 1451 1 1 15 VAL H H 2.469 5.434 3.761 1.00 . A A . 15 VAL H 1 1
6 1452 1 1 15 VAL HA H 4.605 7.430 2.949 1.00 . A A . 15 VAL HA 1 1
6 1453 1 1 15 VAL HB H 4.197 6.608 5.886 1.00 . A A . 15 VAL HB 1 1
6 1454 1 1 15 VAL HG11 H 6.323 8.511 4.691 1.00 . A A . 15 VAL HG11 1 1
6 1455 1 1 15 VAL HG12 H 6.046 8.227 6.429 1.00 . A A . 15 VAL HG12 1 1
6 1456 1 1 15 VAL HG13 H 6.632 6.912 5.406 1.00 . A A . 15 VAL HG13 1 1
6 1457 1 1 15 VAL HG21 H 3.789 9.400 4.621 1.00 . A A . 15 VAL HG21 1 1
6 1458 1 1 15 VAL HG22 H 2.519 8.362 5.310 1.00 . A A . 15 VAL HG22 1 1
6 1459 1 1 15 VAL HG23 H 3.759 9.042 6.368 1.00 . A A . 15 VAL HG23 1 1
6 1460 1 1 15 VAL N N 2.867 6.322 3.433 1.00 . A A . 15 VAL N 1 1
6 1461 1 1 15 VAL O O 6.316 5.651 2.861 1.00 . A A . 15 VAL O 1 1
6 1462 1 1 16 ILE C C 6.283 2.524 2.765 1.00 . A A . 16 ILE C 1 1
6 1463 1 1 16 ILE CA C 5.888 3.123 4.157 1.00 . A A . 16 ILE CA 1 1
6 1464 1 1 16 ILE CB C 5.311 2.113 5.229 1.00 . A A . 16 ILE CB 1 1
6 1465 1 1 16 ILE CD1 C 4.494 2.016 7.724 1.00 . A A . 16 ILE CD1 1 1
6 1466 1 1 16 ILE CG1 C 5.390 2.698 6.676 1.00 . A A . 16 ILE CG1 1 1
6 1467 1 1 16 ILE CG2 C 5.956 0.699 5.200 1.00 . A A . 16 ILE CG2 1 1
6 1468 1 1 16 ILE H H 3.981 4.253 4.368 1.00 . A A . 16 ILE H 1 1
6 1469 1 1 16 ILE HA H 6.832 3.519 4.583 1.00 . A A . 16 ILE HA 1 1
6 1470 1 1 16 ILE HB H 4.239 1.958 5.002 1.00 . A A . 16 ILE HB 1 1
6 1471 1 1 16 ILE HD11 H 3.432 2.025 7.419 1.00 . A A . 16 ILE HD11 1 1
6 1472 1 1 16 ILE HD12 H 4.784 0.965 7.902 1.00 . A A . 16 ILE HD12 1 1
6 1473 1 1 16 ILE HD13 H 4.558 2.536 8.697 1.00 . A A . 16 ILE HD13 1 1
6 1474 1 1 16 ILE HG12 H 6.438 2.696 7.031 1.00 . A A . 16 ILE HG12 1 1
6 1475 1 1 16 ILE HG13 H 5.102 3.766 6.667 1.00 . A A . 16 ILE HG13 1 1
6 1476 1 1 16 ILE HG21 H 5.817 0.203 4.222 1.00 . A A . 16 ILE HG21 1 1
6 1477 1 1 16 ILE HG22 H 7.043 0.731 5.400 1.00 . A A . 16 ILE HG22 1 1
6 1478 1 1 16 ILE HG23 H 5.503 0.014 5.940 1.00 . A A . 16 ILE HG23 1 1
6 1479 1 1 16 ILE N N 4.944 4.282 4.023 1.00 . A A . 16 ILE N 1 1
6 1480 1 1 16 ILE O O 7.460 2.574 2.395 1.00 . A A . 16 ILE O 1 1
6 1481 1 1 17 CYS C C 5.376 2.815 -0.373 1.00 . A A . 17 CYS C 1 1
6 1482 1 1 17 CYS CA C 5.501 1.588 0.586 1.00 . A A . 17 CYS CA 1 1
6 1483 1 1 17 CYS CB C 4.539 0.386 0.342 1.00 . A A . 17 CYS CB 1 1
6 1484 1 1 17 CYS H H 4.369 2.117 2.407 1.00 . A A . 17 CYS H 1 1
6 1485 1 1 17 CYS HA H 6.523 1.210 0.415 1.00 . A A . 17 CYS HA 1 1
6 1486 1 1 17 CYS HB2 H 3.687 0.367 1.042 1.00 . A A . 17 CYS HB2 1 1
6 1487 1 1 17 CYS HB3 H 4.046 0.407 -0.638 1.00 . A A . 17 CYS HB3 1 1
6 1488 1 1 17 CYS N N 5.307 1.997 2.006 1.00 . A A . 17 CYS N 1 1
6 1489 1 1 17 CYS O O 5.447 3.974 0.053 1.00 . A A . 17 CYS O 1 1
6 1490 1 1 17 CYS SG S 5.409 -1.192 0.506 1.00 . A A . 17 CYS SG 1 1
6 1491 1 1 18 ALA C C 3.239 3.808 -2.686 1.00 . A A . 18 ALA C 1 1
6 1492 1 1 18 ALA CA C 4.776 3.598 -2.664 1.00 . A A . 18 ALA CA 1 1
6 1493 1 1 18 ALA CB C 5.381 3.278 -4.045 1.00 . A A . 18 ALA CB 1 1
6 1494 1 1 18 ALA H H 5.257 1.551 -1.879 1.00 . A A . 18 ALA H 1 1
6 1495 1 1 18 ALA HA H 5.143 4.609 -2.380 1.00 . A A . 18 ALA HA 1 1
6 1496 1 1 18 ALA HB1 H 6.482 3.181 -4.002 1.00 . A A . 18 ALA HB1 1 1
6 1497 1 1 18 ALA HB2 H 4.980 2.340 -4.471 1.00 . A A . 18 ALA HB2 1 1
6 1498 1 1 18 ALA HB3 H 5.162 4.080 -4.774 1.00 . A A . 18 ALA HB3 1 1
6 1499 1 1 18 ALA N N 5.219 2.557 -1.682 1.00 . A A . 18 ALA N 1 1
6 1500 1 1 18 ALA O O 2.558 3.761 -3.714 1.00 . A A . 18 ALA O 1 1
6 1501 1 1 19 CYS C C 3.382 6.256 -0.413 1.00 . A A . 19 CYS C 1 1
6 1502 1 1 19 CYS CA C 2.340 5.636 -1.360 1.00 . A A . 19 CYS CA 1 1
6 1503 1 1 19 CYS CB C 0.924 5.736 -0.713 1.00 . A A . 19 CYS CB 1 1
6 1504 1 1 19 CYS H H 3.337 3.907 -0.766 1.00 . A A . 19 CYS H 1 1
6 1505 1 1 19 CYS HXT H 4.136 6.052 1.395 1.00 . A A . 19 CYS HXT 1 1
6 1506 1 1 19 CYS HA H 2.487 6.142 -2.338 1.00 . A A . 19 CYS HA 1 1
6 1507 1 1 19 CYS HB2 H 0.057 5.431 -1.347 1.00 . A A . 19 CYS HB2 1 1
6 1508 1 1 19 CYS HB3 H 0.865 5.055 0.155 1.00 . A A . 19 CYS HB3 1 1
6 1509 1 1 19 CYS N N 2.725 4.232 -1.522 1.00 . A A . 19 CYS N 1 1
6 1510 1 1 19 CYS O O 4.084 7.220 -0.718 1.00 . A A . 19 CYS O 1 1
6 1511 1 1 19 CYS OXT O 3.469 5.614 0.861 1.00 . A A . 19 CYS OXT 1 1
6 1512 1 1 19 CYS SG S 0.645 7.420 -0.111 1.00 . A A . 19 CYS SG 1 1
7 1513 1 1 1 DAL C C -6.044 -0.180 1.589 1.00 . A A . 1 DAL C 1 1
7 1514 1 1 1 DAL CA C -5.130 -1.392 1.958 1.00 . A A . 1 DAL CA 1 1
7 1515 1 1 1 DAL CB C -3.617 -1.103 1.864 1.00 . A A . 1 DAL CB 1 1
7 1516 1 1 1 DAL H1 H -4.866 -2.788 3.463 1.00 . A A . 1 DAL H1 1 1
7 1517 1 1 1 DAL H2 H -6.401 -2.236 3.356 1.00 . A A . 1 DAL H2 1 1
7 1518 1 1 1 DAL HA H -5.360 -2.196 1.234 1.00 . A A . 1 DAL HA 1 1
7 1519 1 1 1 DAL HB1 H -3.312 -0.335 2.599 1.00 . A A . 1 DAL HB1 1 1
7 1520 1 1 1 DAL HB2 H -3.379 -0.686 0.873 1.00 . A A . 1 DAL HB2 1 1
7 1521 1 1 1 DAL N N -5.420 -1.940 3.302 1.00 . A A . 1 DAL N 1 1
7 1522 1 1 1 DAL O O -6.923 0.239 2.350 1.00 . A A . 1 DAL O 1 1
7 1523 1 1 2 SER C C -7.765 -0.002 -1.243 1.00 . A A . 2 SER C 1 1
7 1524 1 1 2 SER CA C -6.960 1.038 -0.395 1.00 . A A . 2 SER CA 1 1
7 1525 1 1 2 SER CB C -6.298 2.158 -1.230 1.00 . A A . 2 SER CB 1 1
7 1526 1 1 2 SER H H -5.092 -0.086 -0.156 1.00 . A A . 2 SER H 1 1
7 1527 1 1 2 SER HA H -7.643 1.548 0.315 1.00 . A A . 2 SER HA 1 1
7 1528 1 1 2 SER HB2 H -5.689 2.820 -0.586 1.00 . A A . 2 SER HB2 1 1
7 1529 1 1 2 SER HB3 H -5.606 1.741 -1.986 1.00 . A A . 2 SER HB3 1 1
7 1530 1 1 2 SER HG H -6.802 3.621 -2.371 1.00 . A A . 2 SER HG 1 1
7 1531 1 1 2 SER N N -5.889 0.309 0.341 1.00 . A A . 2 SER N 1 1
7 1532 1 1 2 SER O O -7.620 -0.108 -2.466 1.00 . A A . 2 SER O 1 1
7 1533 1 1 2 SER OG O -7.283 2.949 -1.883 1.00 . A A . 2 SER OG 1 1
7 1534 1 1 3 GLY C C -8.106 -3.225 -0.648 1.00 . A A . 3 GLY C 1 1
7 1535 1 1 3 GLY CA C -9.094 -2.097 -1.042 1.00 . A A . 3 GLY CA 1 1
7 1536 1 1 3 GLY H H -8.333 -0.719 0.471 1.00 . A A . 3 GLY H 1 1
7 1537 1 1 3 GLY HA2 H -10.076 -2.276 -0.557 1.00 . A A . 3 GLY HA2 1 1
7 1538 1 1 3 GLY HA3 H -9.319 -2.050 -2.125 1.00 . A A . 3 GLY HA3 1 1
7 1539 1 1 3 GLY N N -8.565 -0.812 -0.526 1.00 . A A . 3 GLY N 1 1
7 1540 1 1 3 GLY O O -7.892 -3.418 0.554 1.00 . A A . 3 GLY O 1 1
7 1541 1 1 4 TRP C C -5.293 -4.410 -2.683 1.00 . A A . 4 TRP C 1 1
7 1542 1 1 4 TRP CA C -6.118 -4.533 -1.369 1.00 . A A . 4 TRP CA 1 1
7 1543 1 1 4 TRP CB C -6.140 -5.990 -0.860 1.00 . A A . 4 TRP CB 1 1
7 1544 1 1 4 TRP CD1 C -5.882 -5.985 1.744 1.00 . A A . 4 TRP CD1 1 1
7 1545 1 1 4 TRP CD2 C -7.890 -6.603 1.007 1.00 . A A . 4 TRP CD2 1 1
7 1546 1 1 4 TRP CE2 C -7.884 -6.601 2.426 1.00 . A A . 4 TRP CE2 1 1
7 1547 1 1 4 TRP CE3 C -9.074 -6.921 0.294 1.00 . A A . 4 TRP CE3 1 1
7 1548 1 1 4 TRP CG C -6.636 -6.213 0.573 1.00 . A A . 4 TRP CG 1 1
7 1549 1 1 4 TRP CH2 C -10.219 -7.239 2.420 1.00 . A A . 4 TRP CH2 1 1
7 1550 1 1 4 TRP CZ2 C -9.065 -6.923 3.141 1.00 . A A . 4 TRP CZ2 1 1
7 1551 1 1 4 TRP CZ3 C -10.223 -7.237 1.020 1.00 . A A . 4 TRP CZ3 1 1
7 1552 1 1 4 TRP H H -7.680 -3.723 -2.594 1.00 . A A . 4 TRP H 1 1
7 1553 1 1 4 TRP HA H -5.599 -3.965 -0.580 1.00 . A A . 4 TRP HA 1 1
7 1554 1 1 4 TRP HB2 H -6.742 -6.530 -1.585 1.00 . A A . 4 TRP HB2 1 1
7 1555 1 1 4 TRP HB3 H -5.131 -6.442 -0.936 1.00 . A A . 4 TRP HB3 1 1
7 1556 1 1 4 TRP HD1 H -4.858 -5.639 1.754 1.00 . A A . 4 TRP HD1 1 1
7 1557 1 1 4 TRP HE1 H -6.334 -6.108 3.880 1.00 . A A . 4 TRP HE1 1 1
7 1558 1 1 4 TRP HE3 H -9.096 -6.909 -0.786 1.00 . A A . 4 TRP HE3 1 1
7 1559 1 1 4 TRP HH2 H -11.126 -7.485 2.953 1.00 . A A . 4 TRP HH2 1 1
7 1560 1 1 4 TRP HZ2 H -9.087 -6.920 4.221 1.00 . A A . 4 TRP HZ2 1 1
7 1561 1 1 4 TRP HZ3 H -11.133 -7.480 0.492 1.00 . A A . 4 TRP HZ3 1 1
7 1562 1 1 4 TRP N N -7.447 -3.909 -1.613 1.00 . A A . 4 TRP N 1 1
7 1563 1 1 4 TRP NE1 N -6.637 -6.222 2.906 1.00 . A A . 4 TRP NE1 1 1
7 1564 1 1 4 TRP O O -5.095 -5.357 -3.453 1.00 . A A . 4 TRP O 1 1
7 1565 1 1 5 VAL C C -2.309 -3.404 -2.780 1.00 . A A . 5 VAL C 1 1
7 1566 1 1 5 VAL CA C -3.513 -2.948 -3.661 1.00 . A A . 5 VAL CA 1 1
7 1567 1 1 5 VAL CB C -3.473 -1.513 -4.310 1.00 . A A . 5 VAL CB 1 1
7 1568 1 1 5 VAL CG1 C -2.203 -1.293 -5.162 1.00 . A A . 5 VAL CG1 1 1
7 1569 1 1 5 VAL CG2 C -4.704 -1.215 -5.201 1.00 . A A . 5 VAL CG2 1 1
7 1570 1 1 5 VAL H H -5.138 -2.578 -2.148 1.00 . A A . 5 VAL H 1 1
7 1571 1 1 5 VAL HA H -3.503 -3.637 -4.508 1.00 . A A . 5 VAL HA 1 1
7 1572 1 1 5 VAL HB H -3.468 -0.732 -3.526 1.00 . A A . 5 VAL HB 1 1
7 1573 1 1 5 VAL HG11 H -1.282 -1.414 -4.564 1.00 . A A . 5 VAL HG11 1 1
7 1574 1 1 5 VAL HG12 H -2.137 -2.007 -6.005 1.00 . A A . 5 VAL HG12 1 1
7 1575 1 1 5 VAL HG13 H -2.163 -0.273 -5.589 1.00 . A A . 5 VAL HG13 1 1
7 1576 1 1 5 VAL HG21 H -4.799 -1.938 -6.032 1.00 . A A . 5 VAL HG21 1 1
7 1577 1 1 5 VAL HG22 H -5.646 -1.256 -4.623 1.00 . A A . 5 VAL HG22 1 1
7 1578 1 1 5 VAL HG23 H -4.657 -0.203 -5.645 1.00 . A A . 5 VAL HG23 1 1
7 1579 1 1 5 VAL N N -4.740 -3.205 -2.846 1.00 . A A . 5 VAL N 1 1
7 1580 1 1 5 VAL O O -1.821 -4.521 -2.966 1.00 . A A . 5 VAL O 1 1
7 1581 1 1 6 CYS C C -0.354 -4.116 -0.352 1.00 . A A . 6 CYS C 1 1
7 1582 1 1 6 CYS CA C -1.496 -3.058 -0.436 1.00 . A A . 6 CYS CA 1 1
7 1583 1 1 6 CYS CB C -2.671 -3.429 0.495 1.00 . A A . 6 CYS CB 1 1
7 1584 1 1 6 CYS H H -2.367 -1.672 -1.875 1.00 . A A . 6 CYS H 1 1
7 1585 1 1 6 CYS HA H -1.161 -2.111 0.017 1.00 . A A . 6 CYS HA 1 1
7 1586 1 1 6 CYS HB2 H -3.643 -3.218 0.027 1.00 . A A . 6 CYS HB2 1 1
7 1587 1 1 6 CYS HB3 H -2.643 -4.507 0.683 1.00 . A A . 6 CYS HB3 1 1
7 1588 1 1 6 CYS N N -1.941 -2.595 -1.776 1.00 . A A . 6 CYS N 1 1
7 1589 1 1 6 CYS O O -0.467 -5.286 -0.728 1.00 . A A . 6 CYS O 1 1
7 1590 1 1 6 CYS SG S -2.612 -2.593 2.104 1.00 . A A . 6 CYS SG 1 1
7 1591 1 1 7 ABA C C 2.934 -4.940 0.427 1.00 . A A . 7 ABA C 1 1
7 1592 1 1 7 ABA CA C 1.607 -4.487 1.119 1.00 . A A . 7 ABA CA 1 1
7 1593 1 1 7 ABA CB C 1.843 -3.589 2.378 1.00 . A A . 7 ABA CB 1 1
7 1594 1 1 7 ABA CG C 0.590 -3.496 3.289 1.00 . A A . 7 ABA CG 1 1
7 1595 1 1 7 ABA H H 0.351 -2.789 0.745 1.00 . A A . 7 ABA H 1 1
7 1596 1 1 7 ABA HA H 1.094 -5.415 1.443 1.00 . A A . 7 ABA HA 1 1
7 1597 1 1 7 ABA HB2 H 2.642 -4.028 3.006 1.00 . A A . 7 ABA HB2 1 1
7 1598 1 1 7 ABA HG1 H 0.778 -2.935 4.217 1.00 . A A . 7 ABA HG1 1 1
7 1599 1 1 7 ABA HG2 H -0.252 -3.004 2.775 1.00 . A A . 7 ABA HG2 1 1
7 1600 1 1 7 ABA HG3 H 0.220 -4.500 3.572 1.00 . A A . 7 ABA HG3 1 1
7 1601 1 1 7 ABA N N 0.690 -3.648 0.305 1.00 . A A . 7 ABA N 1 1
7 1602 1 1 7 ABA O O 3.952 -5.100 1.109 1.00 . A A . 7 ABA O 1 1
7 1603 1 1 8 LEU C C 4.793 -4.383 -2.415 1.00 . A A . 8 LEU C 1 1
7 1604 1 1 8 LEU CA C 4.145 -5.589 -1.671 1.00 . A A . 8 LEU CA 1 1
7 1605 1 1 8 LEU CB C 3.839 -6.844 -2.548 1.00 . A A . 8 LEU CB 1 1
7 1606 1 1 8 LEU CD1 C 2.965 -8.056 -4.608 1.00 . A A . 8 LEU CD1 1 1
7 1607 1 1 8 LEU CD2 C 1.414 -6.443 -3.456 1.00 . A A . 8 LEU CD2 1 1
7 1608 1 1 8 LEU CG C 2.890 -6.751 -3.788 1.00 . A A . 8 LEU CG 1 1
7 1609 1 1 8 LEU H H 2.091 -4.850 -1.386 1.00 . A A . 8 LEU H 1 1
7 1610 1 1 8 LEU HA H 4.940 -5.916 -0.966 1.00 . A A . 8 LEU HA 1 1
7 1611 1 1 8 LEU HB2 H 4.820 -7.212 -2.904 1.00 . A A . 8 LEU HB2 1 1
7 1612 1 1 8 LEU HB3 H 3.482 -7.658 -1.886 1.00 . A A . 8 LEU HB3 1 1
7 1613 1 1 8 LEU HD11 H 3.999 -8.275 -4.933 1.00 . A A . 8 LEU HD11 1 1
7 1614 1 1 8 LEU HD12 H 2.610 -8.931 -4.032 1.00 . A A . 8 LEU HD12 1 1
7 1615 1 1 8 LEU HD13 H 2.353 -7.998 -5.527 1.00 . A A . 8 LEU HD13 1 1
7 1616 1 1 8 LEU HD21 H 0.991 -7.160 -2.728 1.00 . A A . 8 LEU HD21 1 1
7 1617 1 1 8 LEU HD22 H 1.291 -5.429 -3.033 1.00 . A A . 8 LEU HD22 1 1
7 1618 1 1 8 LEU HD23 H 0.773 -6.473 -4.357 1.00 . A A . 8 LEU HD23 1 1
7 1619 1 1 8 LEU HG H 3.250 -5.944 -4.450 1.00 . A A . 8 LEU HG 1 1
7 1620 1 1 8 LEU N N 2.926 -5.197 -0.900 1.00 . A A . 8 LEU N 1 1
7 1621 1 1 8 LEU O O 5.034 -4.405 -3.626 1.00 . A A . 8 LEU O 1 1
7 1622 1 1 9 ABA C C 4.934 -1.079 -2.912 1.00 . A A . 9 ABA C 1 1
7 1623 1 1 9 ABA CA C 5.805 -2.116 -2.128 1.00 . A A . 9 ABA CA 1 1
7 1624 1 1 9 ABA CB C 6.562 -1.485 -0.916 1.00 . A A . 9 ABA CB 1 1
7 1625 1 1 9 ABA CG C 7.758 -2.340 -0.453 1.00 . A A . 9 ABA CG 1 1
7 1626 1 1 9 ABA H H 4.854 -3.444 -0.650 1.00 . A A . 9 ABA H 1 1
7 1627 1 1 9 ABA HA H 6.580 -2.435 -2.854 1.00 . A A . 9 ABA HA 1 1
7 1628 1 1 9 ABA HB2 H 6.964 -0.494 -1.202 1.00 . A A . 9 ABA HB2 1 1
7 1629 1 1 9 ABA HG1 H 7.430 -3.333 -0.089 1.00 . A A . 9 ABA HG1 1 1
7 1630 1 1 9 ABA HG2 H 8.300 -1.857 0.378 1.00 . A A . 9 ABA HG2 1 1
7 1631 1 1 9 ABA HG3 H 8.479 -2.517 -1.272 1.00 . A A . 9 ABA HG3 1 1
7 1632 1 1 9 ABA N N 5.107 -3.332 -1.638 1.00 . A A . 9 ABA N 1 1
7 1633 1 1 9 ABA O O 5.527 -0.153 -3.471 1.00 . A A . 9 ABA O 1 1
7 1634 1 1 10 ILE C C 1.439 -0.135 -2.895 1.00 . A A . 10 ILE C 1 1
7 1635 1 1 10 ILE CA C 2.709 -0.309 -3.780 1.00 . A A . 10 ILE CA 1 1
7 1636 1 1 10 ILE CB C 2.343 -0.849 -5.213 1.00 . A A . 10 ILE CB 1 1
7 1637 1 1 10 ILE CD1 C 4.459 -0.162 -6.658 1.00 . A A . 10 ILE CD1 1 1
7 1638 1 1 10 ILE CG1 C 3.534 -1.272 -6.128 1.00 . A A . 10 ILE CG1 1 1
7 1639 1 1 10 ILE CG2 C 1.400 0.110 -5.988 1.00 . A A . 10 ILE CG2 1 1
7 1640 1 1 10 ILE H H 3.190 -1.976 -2.429 1.00 . A A . 10 ILE H 1 1
7 1641 1 1 10 ILE HA H 3.211 0.672 -3.913 1.00 . A A . 10 ILE HA 1 1
7 1642 1 1 10 ILE HB H 1.761 -1.774 -5.049 1.00 . A A . 10 ILE HB 1 1
7 1643 1 1 10 ILE HD11 H 4.896 0.441 -5.844 1.00 . A A . 10 ILE HD11 1 1
7 1644 1 1 10 ILE HD12 H 5.299 -0.589 -7.235 1.00 . A A . 10 ILE HD12 1 1
7 1645 1 1 10 ILE HD13 H 3.924 0.533 -7.331 1.00 . A A . 10 ILE HD13 1 1
7 1646 1 1 10 ILE HG12 H 4.152 -2.022 -5.601 1.00 . A A . 10 ILE HG12 1 1
7 1647 1 1 10 ILE HG13 H 3.135 -1.824 -7.000 1.00 . A A . 10 ILE HG13 1 1
7 1648 1 1 10 ILE HG21 H 0.451 0.282 -5.448 1.00 . A A . 10 ILE HG21 1 1
7 1649 1 1 10 ILE HG22 H 1.861 1.103 -6.147 1.00 . A A . 10 ILE HG22 1 1
7 1650 1 1 10 ILE HG23 H 1.125 -0.293 -6.980 1.00 . A A . 10 ILE HG23 1 1
7 1651 1 1 10 ILE N N 3.589 -1.220 -2.999 1.00 . A A . 10 ILE N 1 1
7 1652 1 1 10 ILE O O 0.628 -1.058 -2.756 1.00 . A A . 10 ILE O 1 1
7 1653 1 1 11 GLU C C -0.341 0.647 -0.392 1.00 . A A . 11 GLU C 1 1
7 1654 1 1 11 GLU CA C 0.022 1.528 -1.641 1.00 . A A . 11 GLU CA 1 1
7 1655 1 1 11 GLU CB C -1.104 1.827 -2.698 1.00 . A A . 11 GLU CB 1 1
7 1656 1 1 11 GLU CD C -2.672 3.282 -1.230 1.00 . A A . 11 GLU CD 1 1
7 1657 1 1 11 GLU CG C -2.543 2.129 -2.231 1.00 . A A . 11 GLU CG 1 1
7 1658 1 1 11 GLU H H 2.095 1.670 -2.418 1.00 . A A . 11 GLU H 1 1
7 1659 1 1 11 GLU HA H 0.257 2.526 -1.224 1.00 . A A . 11 GLU HA 1 1
7 1660 1 1 11 GLU HB2 H -0.851 2.691 -3.349 1.00 . A A . 11 GLU HB2 1 1
7 1661 1 1 11 GLU HB3 H -1.127 0.973 -3.393 1.00 . A A . 11 GLU HB3 1 1
7 1662 1 1 11 GLU HE2 H -2.813 5.223 -1.219 1.00 . A A . 11 GLU HE2 1 1
7 1663 1 1 11 GLU HG2 H -3.152 2.358 -3.124 1.00 . A A . 11 GLU HG2 1 1
7 1664 1 1 11 GLU HG3 H -3.005 1.220 -1.810 1.00 . A A . 11 GLU HG3 1 1
7 1665 1 1 11 GLU N N 1.261 1.081 -2.350 1.00 . A A . 11 GLU N 1 1
7 1666 1 1 11 GLU O O -1.476 0.200 -0.251 1.00 . A A . 11 GLU O 1 1
7 1667 1 1 11 GLU OE1 O -2.715 3.117 -0.010 1.00 . A A . 11 GLU OE1 1 1
7 1668 1 1 11 GLU OE2 O -2.733 4.504 -1.849 1.00 . A A . 11 GLU OE2 1 1
7 1669 1 1 12 CYS C C -0.375 0.829 2.897 1.00 . A A . 12 CYS C 1 1
7 1670 1 1 12 CYS CA C 0.349 -0.124 1.896 1.00 . A A . 12 CYS CA 1 1
7 1671 1 1 12 CYS CB C 1.682 -0.572 2.562 1.00 . A A . 12 CYS CB 1 1
7 1672 1 1 12 CYS H H 1.444 1.021 0.360 1.00 . A A . 12 CYS H 1 1
7 1673 1 1 12 CYS HA H -0.282 -1.020 1.772 1.00 . A A . 12 CYS HA 1 1
7 1674 1 1 12 CYS HB2 H 2.407 0.262 2.514 1.00 . A A . 12 CYS HB2 1 1
7 1675 1 1 12 CYS HB3 H 1.567 -0.804 3.638 1.00 . A A . 12 CYS HB3 1 1
7 1676 1 1 12 CYS N N 0.607 0.476 0.550 1.00 . A A . 12 CYS N 1 1
7 1677 1 1 12 CYS O O -1.068 0.329 3.789 1.00 . A A . 12 CYS O 1 1
7 1678 1 1 12 CYS SG S 2.491 -1.982 1.760 1.00 . A A . 12 CYS SG 1 1
7 1679 1 1 13 GLY C C -0.858 4.612 3.329 1.00 . A A . 13 GLY C 1 1
7 1680 1 1 13 GLY CA C -0.784 3.125 3.743 1.00 . A A . 13 GLY CA 1 1
7 1681 1 1 13 GLY H H 0.390 2.424 1.978 1.00 . A A . 13 GLY H 1 1
7 1682 1 1 13 GLY HA2 H -1.809 2.803 4.013 1.00 . A A . 13 GLY HA2 1 1
7 1683 1 1 13 GLY HA3 H -0.210 3.065 4.686 1.00 . A A . 13 GLY HA3 1 1
7 1684 1 1 13 GLY N N -0.205 2.161 2.778 1.00 . A A . 13 GLY N 1 1
7 1685 1 1 13 GLY O O -1.768 5.299 3.803 1.00 . A A . 13 GLY O 1 1
7 1686 1 1 14 ABA C C 1.832 7.022 2.529 1.00 . A A . 14 ABA C 1 1
7 1687 1 1 14 ABA CA C 0.319 6.609 2.377 1.00 . A A . 14 ABA CA 1 1
7 1688 1 1 14 ABA CB C -0.393 7.240 1.122 1.00 . A A . 14 ABA CB 1 1
7 1689 1 1 14 ABA CG C -1.776 6.690 0.734 1.00 . A A . 14 ABA CG 1 1
7 1690 1 1 14 ABA H H 0.782 4.461 2.179 1.00 . A A . 14 ABA H 1 1
7 1691 1 1 14 ABA HA H -0.157 7.109 3.244 1.00 . A A . 14 ABA HA 1 1
7 1692 1 1 14 ABA HB2 H -0.555 8.305 1.377 1.00 . A A . 14 ABA HB2 1 1
7 1693 1 1 14 ABA HG1 H -1.712 5.627 0.439 1.00 . A A . 14 ABA HG1 1 1
7 1694 1 1 14 ABA HG2 H -2.199 7.240 -0.124 1.00 . A A . 14 ABA HG2 1 1
7 1695 1 1 14 ABA HG3 H -2.492 6.758 1.572 1.00 . A A . 14 ABA HG3 1 1
7 1696 1 1 14 ABA N N 0.095 5.134 2.529 1.00 . A A . 14 ABA N 1 1
7 1697 1 1 14 ABA O O 2.220 8.095 2.055 1.00 . A A . 14 ABA O 1 1
7 1698 1 1 15 VAL C C 5.061 5.396 3.421 1.00 . A A . 15 VAL C 1 1
7 1699 1 1 15 VAL CA C 4.073 6.596 3.623 1.00 . A A . 15 VAL CA 1 1
7 1700 1 1 15 VAL CB C 4.163 7.220 5.069 1.00 . A A . 15 VAL CB 1 1
7 1701 1 1 15 VAL CG1 C 5.600 7.628 5.485 1.00 . A A . 15 VAL CG1 1 1
7 1702 1 1 15 VAL CG2 C 3.262 8.461 5.289 1.00 . A A . 15 VAL CG2 1 1
7 1703 1 1 15 VAL H H 2.242 5.345 3.548 1.00 . A A . 15 VAL H 1 1
7 1704 1 1 15 VAL HA H 4.427 7.362 2.916 1.00 . A A . 15 VAL HA 1 1
7 1705 1 1 15 VAL HB H 3.829 6.451 5.792 1.00 . A A . 15 VAL HB 1 1
7 1706 1 1 15 VAL HG11 H 6.029 8.385 4.801 1.00 . A A . 15 VAL HG11 1 1
7 1707 1 1 15 VAL HG12 H 5.634 8.050 6.507 1.00 . A A . 15 VAL HG12 1 1
7 1708 1 1 15 VAL HG13 H 6.290 6.764 5.488 1.00 . A A . 15 VAL HG13 1 1
7 1709 1 1 15 VAL HG21 H 3.503 9.278 4.584 1.00 . A A . 15 VAL HG21 1 1
7 1710 1 1 15 VAL HG22 H 2.191 8.221 5.156 1.00 . A A . 15 VAL HG22 1 1
7 1711 1 1 15 VAL HG23 H 3.357 8.870 6.313 1.00 . A A . 15 VAL HG23 1 1
7 1712 1 1 15 VAL N N 2.668 6.230 3.249 1.00 . A A . 15 VAL N 1 1
7 1713 1 1 15 VAL O O 6.132 5.588 2.838 1.00 . A A . 15 VAL O 1 1
7 1714 1 1 16 ILE C C 6.184 2.445 2.812 1.00 . A A . 16 ILE C 1 1
7 1715 1 1 16 ILE CA C 5.712 3.076 4.165 1.00 . A A . 16 ILE CA 1 1
7 1716 1 1 16 ILE CB C 5.120 2.084 5.244 1.00 . A A . 16 ILE CB 1 1
7 1717 1 1 16 ILE CD1 C 6.316 3.093 7.386 1.00 . A A . 16 ILE CD1 1 1
7 1718 1 1 16 ILE CG1 C 5.009 2.689 6.680 1.00 . A A . 16 ILE CG1 1 1
7 1719 1 1 16 ILE CG2 C 5.794 0.688 5.310 1.00 . A A . 16 ILE CG2 1 1
7 1720 1 1 16 ILE H H 3.772 4.161 4.276 1.00 . A A . 16 ILE H 1 1
7 1721 1 1 16 ILE HA H 6.628 3.510 4.609 1.00 . A A . 16 ILE HA 1 1
7 1722 1 1 16 ILE HB H 4.076 1.867 4.954 1.00 . A A . 16 ILE HB 1 1
7 1723 1 1 16 ILE HD11 H 7.011 2.240 7.490 1.00 . A A . 16 ILE HD11 1 1
7 1724 1 1 16 ILE HD12 H 6.847 3.897 6.846 1.00 . A A . 16 ILE HD12 1 1
7 1725 1 1 16 ILE HD13 H 6.112 3.471 8.405 1.00 . A A . 16 ILE HD13 1 1
7 1726 1 1 16 ILE HG12 H 4.347 3.575 6.651 1.00 . A A . 16 ILE HG12 1 1
7 1727 1 1 16 ILE HG13 H 4.470 1.975 7.332 1.00 . A A . 16 ILE HG13 1 1
7 1728 1 1 16 ILE HG21 H 6.874 0.752 5.535 1.00 . A A . 16 ILE HG21 1 1
7 1729 1 1 16 ILE HG22 H 5.329 0.041 6.077 1.00 . A A . 16 ILE HG22 1 1
7 1730 1 1 16 ILE HG23 H 5.692 0.140 4.354 1.00 . A A . 16 ILE HG23 1 1
7 1731 1 1 16 ILE N N 4.744 4.203 3.962 1.00 . A A . 16 ILE N 1 1
7 1732 1 1 16 ILE O O 7.376 2.509 2.499 1.00 . A A . 16 ILE O 1 1
7 1733 1 1 17 CYS C C 5.380 2.732 -0.348 1.00 . A A . 17 CYS C 1 1
7 1734 1 1 17 CYS CA C 5.522 1.498 0.600 1.00 . A A . 17 CYS CA 1 1
7 1735 1 1 17 CYS CB C 4.612 0.271 0.298 1.00 . A A . 17 CYS CB 1 1
7 1736 1 1 17 CYS H H 4.299 2.002 2.366 1.00 . A A . 17 CYS H 1 1
7 1737 1 1 17 CYS HA H 6.563 1.157 0.463 1.00 . A A . 17 CYS HA 1 1
7 1738 1 1 17 CYS HB2 H 3.706 0.246 0.922 1.00 . A A . 17 CYS HB2 1 1
7 1739 1 1 17 CYS HB3 H 4.196 0.275 -0.717 1.00 . A A . 17 CYS HB3 1 1
7 1740 1 1 17 CYS N N 5.257 1.883 2.016 1.00 . A A . 17 CYS N 1 1
7 1741 1 1 17 CYS O O 5.363 3.887 0.095 1.00 . A A . 17 CYS O 1 1
7 1742 1 1 17 CYS SG S 5.499 -1.285 0.552 1.00 . A A . 17 CYS SG 1 1
7 1743 1 1 18 ALA C C 3.320 3.632 -2.764 1.00 . A A . 18 ALA C 1 1
7 1744 1 1 18 ALA CA C 4.864 3.514 -2.659 1.00 . A A . 18 ALA CA 1 1
7 1745 1 1 18 ALA CB C 5.563 3.242 -4.004 1.00 . A A . 18 ALA CB 1 1
7 1746 1 1 18 ALA H H 5.414 1.488 -1.880 1.00 . A A . 18 ALA H 1 1
7 1747 1 1 18 ALA HA H 5.169 4.536 -2.346 1.00 . A A . 18 ALA HA 1 1
7 1748 1 1 18 ALA HB1 H 6.665 3.221 -3.902 1.00 . A A . 18 ALA HB1 1 1
7 1749 1 1 18 ALA HB2 H 5.252 2.279 -4.448 1.00 . A A . 18 ALA HB2 1 1
7 1750 1 1 18 ALA HB3 H 5.329 4.029 -4.745 1.00 . A A . 18 ALA HB3 1 1
7 1751 1 1 18 ALA N N 5.305 2.486 -1.667 1.00 . A A . 18 ALA N 1 1
7 1752 1 1 18 ALA O O 2.699 3.512 -3.824 1.00 . A A . 18 ALA O 1 1
7 1753 1 1 19 CYS C C 3.339 6.120 -0.574 1.00 . A A . 19 CYS C 1 1
7 1754 1 1 19 CYS CA C 2.320 5.466 -1.525 1.00 . A A . 19 CYS CA 1 1
7 1755 1 1 19 CYS CB C 0.891 5.598 -0.911 1.00 . A A . 19 CYS CB 1 1
7 1756 1 1 19 CYS H H 3.287 3.756 -0.849 1.00 . A A . 19 CYS H 1 1
7 1757 1 1 19 CYS HXT H 4.031 5.993 1.265 1.00 . A A . 19 CYS HXT 1 1
7 1758 1 1 19 CYS HA H 2.481 5.948 -2.513 1.00 . A A . 19 CYS HA 1 1
7 1759 1 1 19 CYS HB2 H 0.031 5.278 -1.548 1.00 . A A . 19 CYS HB2 1 1
7 1760 1 1 19 CYS HB3 H 0.810 4.951 -0.020 1.00 . A A . 19 CYS HB3 1 1
7 1761 1 1 19 CYS N N 2.714 4.057 -1.644 1.00 . A A . 19 CYS N 1 1
7 1762 1 1 19 CYS O O 4.062 7.061 -0.901 1.00 . A A . 19 CYS O 1 1
7 1763 1 1 19 CYS OXT O 3.377 5.538 0.730 1.00 . A A . 19 CYS OXT 1 1
7 1764 1 1 19 CYS SG S 0.624 7.311 -0.387 1.00 . A A . 19 CYS SG 1 1
8 1765 1 1 1 DAL C C -6.007 -0.154 1.693 1.00 . A A . 1 DAL C 1 1
8 1766 1 1 1 DAL CA C -5.085 -1.358 2.064 1.00 . A A . 1 DAL CA 1 1
8 1767 1 1 1 DAL CB C -3.574 -1.068 1.938 1.00 . A A . 1 DAL CB 1 1
8 1768 1 1 1 DAL H1 H -4.790 -2.729 3.587 1.00 . A A . 1 DAL H1 1 1
8 1769 1 1 1 DAL H2 H -6.328 -2.182 3.499 1.00 . A A . 1 DAL H2 1 1
8 1770 1 1 1 DAL HA H -5.326 -2.174 1.358 1.00 . A A . 1 DAL HA 1 1
8 1771 1 1 1 DAL HB1 H -3.256 -0.289 2.657 1.00 . A A . 1 DAL HB1 1 1
8 1772 1 1 1 DAL HB2 H -3.356 -0.665 0.937 1.00 . A A . 1 DAL HB2 1 1
8 1773 1 1 1 DAL N N -5.349 -1.884 3.422 1.00 . A A . 1 DAL N 1 1
8 1774 1 1 1 DAL O O -6.875 0.275 2.463 1.00 . A A . 1 DAL O 1 1
8 1775 1 1 2 SER C C -7.774 -0.021 -1.115 1.00 . A A . 2 SER C 1 1
8 1776 1 1 2 SER CA C -6.961 1.032 -0.293 1.00 . A A . 2 SER CA 1 1
8 1777 1 1 2 SER CB C -6.318 2.145 -1.152 1.00 . A A . 2 SER CB 1 1
8 1778 1 1 2 SER H H -5.086 -0.083 -0.069 1.00 . A A . 2 SER H 1 1
8 1779 1 1 2 SER HA H -7.635 1.549 0.421 1.00 . A A . 2 SER HA 1 1
8 1780 1 1 2 SER HB2 H -5.702 2.818 -0.525 1.00 . A A . 2 SER HB2 1 1
8 1781 1 1 2 SER HB3 H -5.634 1.723 -1.913 1.00 . A A . 2 SER HB3 1 1
8 1782 1 1 2 SER HG H -7.855 3.298 -1.100 1.00 . A A . 2 SER HG 1 1
8 1783 1 1 2 SER N N -5.875 0.318 0.435 1.00 . A A . 2 SER N 1 1
8 1784 1 1 2 SER O O -7.647 -0.142 -2.339 1.00 . A A . 2 SER O 1 1
8 1785 1 1 2 SER OG O -7.316 2.923 -1.800 1.00 . A A . 2 SER OG 1 1
8 1786 1 1 3 GLY C C -8.094 -3.238 -0.480 1.00 . A A . 3 GLY C 1 1
8 1787 1 1 3 GLY CA C -9.092 -2.118 -0.869 1.00 . A A . 3 GLY CA 1 1
8 1788 1 1 3 GLY H H -8.313 -0.720 0.616 1.00 . A A . 3 GLY H 1 1
8 1789 1 1 3 GLY HA2 H -10.065 -2.295 -0.365 1.00 . A A . 3 GLY HA2 1 1
8 1790 1 1 3 GLY HA3 H -9.336 -2.084 -1.948 1.00 . A A . 3 GLY HA3 1 1
8 1791 1 1 3 GLY N N -8.559 -0.825 -0.376 1.00 . A A . 3 GLY N 1 1
8 1792 1 1 3 GLY O O -7.859 -3.419 0.720 1.00 . A A . 3 GLY O 1 1
8 1793 1 1 4 TRP C C -5.309 -4.435 -2.548 1.00 . A A . 4 TRP C 1 1
8 1794 1 1 4 TRP CA C -6.114 -4.548 -1.220 1.00 . A A . 4 TRP CA 1 1
8 1795 1 1 4 TRP CB C -6.125 -6.000 -0.698 1.00 . A A . 4 TRP CB 1 1
8 1796 1 1 4 TRP CD1 C -5.829 -5.971 1.902 1.00 . A A . 4 TRP CD1 1 1
8 1797 1 1 4 TRP CD2 C -7.845 -6.602 1.199 1.00 . A A . 4 TRP CD2 1 1
8 1798 1 1 4 TRP CE2 C -7.819 -6.588 2.618 1.00 . A A . 4 TRP CE2 1 1
8 1799 1 1 4 TRP CE3 C -9.038 -6.930 0.506 1.00 . A A . 4 TRP CE3 1 1
8 1800 1 1 4 TRP CG C -6.599 -6.212 0.744 1.00 . A A . 4 TRP CG 1 1
8 1801 1 1 4 TRP CH2 C -10.151 -7.234 2.651 1.00 . A A . 4 TRP CH2 1 1
8 1802 1 1 4 TRP CZ2 C -8.989 -6.907 3.352 1.00 . A A . 4 TRP CZ2 1 1
8 1803 1 1 4 TRP CZ3 C -10.176 -7.244 1.251 1.00 . A A . 4 TRP CZ3 1 1
8 1804 1 1 4 TRP H H -7.697 -3.753 -2.428 1.00 . A A . 4 TRP H 1 1
8 1805 1 1 4 TRP HA H -5.584 -3.972 -0.445 1.00 . A A . 4 TRP HA 1 1
8 1806 1 1 4 TRP HB2 H -6.736 -6.549 -1.409 1.00 . A A . 4 TRP HB2 1 1
8 1807 1 1 4 TRP HB3 H -5.115 -6.450 -0.785 1.00 . A A . 4 TRP HB3 1 1
8 1808 1 1 4 TRP HD1 H -4.806 -5.622 1.894 1.00 . A A . 4 TRP HD1 1 1
8 1809 1 1 4 TRP HE1 H -6.250 -6.078 4.045 1.00 . A A . 4 TRP HE1 1 1
8 1810 1 1 4 TRP HE3 H -9.076 -6.928 -0.574 1.00 . A A . 4 TRP HE3 1 1
8 1811 1 1 4 TRP HH2 H -11.050 -7.478 3.199 1.00 . A A . 4 TRP HH2 1 1
8 1812 1 1 4 TRP HZ2 H -8.995 -6.895 4.433 1.00 . A A . 4 TRP HZ2 1 1
8 1813 1 1 4 TRP HZ3 H -11.093 -7.495 0.738 1.00 . A A . 4 TRP HZ3 1 1
8 1814 1 1 4 TRP N N -7.448 -3.929 -1.449 1.00 . A A . 4 TRP N 1 1
8 1815 1 1 4 TRP NE1 N -6.567 -6.201 3.077 1.00 . A A . 4 TRP NE1 1 1
8 1816 1 1 4 TRP O O -5.120 -5.388 -3.312 1.00 . A A . 4 TRP O 1 1
8 1817 1 1 5 VAL C C -2.331 -3.419 -2.699 1.00 . A A . 5 VAL C 1 1
8 1818 1 1 5 VAL CA C -3.549 -2.976 -3.566 1.00 . A A . 5 VAL CA 1 1
8 1819 1 1 5 VAL CB C -3.523 -1.548 -4.230 1.00 . A A . 5 VAL CB 1 1
8 1820 1 1 5 VAL CG1 C -2.266 -1.333 -5.104 1.00 . A A . 5 VAL CG1 1 1
8 1821 1 1 5 VAL CG2 C -4.767 -1.263 -5.106 1.00 . A A . 5 VAL CG2 1 1
8 1822 1 1 5 VAL H H -5.151 -2.597 -2.033 1.00 . A A . 5 VAL H 1 1
8 1823 1 1 5 VAL HA H -3.549 -3.674 -4.406 1.00 . A A . 5 VAL HA 1 1
8 1824 1 1 5 VAL HB H -3.509 -0.759 -3.455 1.00 . A A . 5 VAL HB 1 1
8 1825 1 1 5 VAL HG11 H -1.336 -1.445 -4.517 1.00 . A A . 5 VAL HG11 1 1
8 1826 1 1 5 VAL HG12 H -2.210 -2.055 -5.940 1.00 . A A . 5 VAL HG12 1 1
8 1827 1 1 5 VAL HG13 H -2.236 -0.318 -5.541 1.00 . A A . 5 VAL HG13 1 1
8 1828 1 1 5 VAL HG21 H -4.873 -1.995 -5.929 1.00 . A A . 5 VAL HG21 1 1
8 1829 1 1 5 VAL HG22 H -5.701 -1.301 -4.515 1.00 . A A . 5 VAL HG22 1 1
8 1830 1 1 5 VAL HG23 H -4.730 -0.256 -5.562 1.00 . A A . 5 VAL HG23 1 1
8 1831 1 1 5 VAL N N -4.763 -3.229 -2.731 1.00 . A A . 5 VAL N 1 1
8 1832 1 1 5 VAL O O -1.840 -4.536 -2.882 1.00 . A A . 5 VAL O 1 1
8 1833 1 1 6 CYS C C -0.343 -4.108 -0.291 1.00 . A A . 6 CYS C 1 1
8 1834 1 1 6 CYS CA C -1.485 -3.049 -0.369 1.00 . A A . 6 CYS CA 1 1
8 1835 1 1 6 CYS CB C -2.646 -3.409 0.582 1.00 . A A . 6 CYS CB 1 1
8 1836 1 1 6 CYS H H -2.380 -1.677 -1.810 1.00 . A A . 6 CYS H 1 1
8 1837 1 1 6 CYS HA H -1.142 -2.096 0.067 1.00 . A A . 6 CYS HA 1 1
8 1838 1 1 6 CYS HB2 H -3.625 -3.203 0.128 1.00 . A A . 6 CYS HB2 1 1
8 1839 1 1 6 CYS HB3 H -2.616 -4.484 0.782 1.00 . A A . 6 CYS HB3 1 1
8 1840 1 1 6 CYS N N -1.951 -2.599 -1.708 1.00 . A A . 6 CYS N 1 1
8 1841 1 1 6 CYS O O -0.464 -5.282 -0.650 1.00 . A A . 6 CYS O 1 1
8 1842 1 1 6 CYS SG S -2.564 -2.554 2.180 1.00 . A A . 6 CYS SG 1 1
8 1843 1 1 7 ABA C C 2.957 -4.929 0.461 1.00 . A A . 7 ABA C 1 1
8 1844 1 1 7 ABA CA C 1.637 -4.463 1.158 1.00 . A A . 7 ABA CA 1 1
8 1845 1 1 7 ABA CB C 1.891 -3.544 2.398 1.00 . A A . 7 ABA CB 1 1
8 1846 1 1 7 ABA CG C 0.652 -3.437 3.326 1.00 . A A . 7 ABA CG 1 1
8 1847 1 1 7 ABA H H 0.381 -2.768 0.774 1.00 . A A . 7 ABA H 1 1
8 1848 1 1 7 ABA HA H 1.126 -5.384 1.503 1.00 . A A . 7 ABA HA 1 1
8 1849 1 1 7 ABA HB2 H 2.698 -3.973 3.021 1.00 . A A . 7 ABA HB2 1 1
8 1850 1 1 7 ABA HG1 H 0.286 -4.437 3.629 1.00 . A A . 7 ABA HG1 1 1
8 1851 1 1 7 ABA HG2 H 0.854 -2.863 4.243 1.00 . A A . 7 ABA HG2 1 1
8 1852 1 1 7 ABA HG3 H -0.197 -2.952 2.817 1.00 . A A . 7 ABA HG3 1 1
8 1853 1 1 7 ABA N N 0.712 -3.634 0.342 1.00 . A A . 7 ABA N 1 1
8 1854 1 1 7 ABA O O 3.979 -5.089 1.138 1.00 . A A . 7 ABA O 1 1
8 1855 1 1 8 LEU C C 4.795 -4.387 -2.397 1.00 . A A . 8 LEU C 1 1
8 1856 1 1 8 LEU CA C 4.156 -5.589 -1.639 1.00 . A A . 8 LEU CA 1 1
8 1857 1 1 8 LEU CB C 3.848 -6.853 -2.503 1.00 . A A . 8 LEU CB 1 1
8 1858 1 1 8 LEU CD1 C 2.966 -8.082 -4.549 1.00 . A A . 8 LEU CD1 1 1
8 1859 1 1 8 LEU CD2 C 1.413 -6.476 -3.392 1.00 . A A . 8 LEU CD2 1 1
8 1860 1 1 8 LEU CG C 2.888 -6.774 -3.735 1.00 . A A . 8 LEU CG 1 1
8 1861 1 1 8 LEU H H 2.099 -4.859 -1.346 1.00 . A A . 8 LEU H 1 1
8 1862 1 1 8 LEU HA H 4.957 -5.906 -0.937 1.00 . A A . 8 LEU HA 1 1
8 1863 1 1 8 LEU HB2 H 4.829 -7.219 -2.865 1.00 . A A . 8 LEU HB2 1 1
8 1864 1 1 8 LEU HB3 H 3.502 -7.664 -1.832 1.00 . A A . 8 LEU HB3 1 1
8 1865 1 1 8 LEU HD11 H 3.999 -8.294 -4.882 1.00 . A A . 8 LEU HD11 1 1
8 1866 1 1 8 LEU HD12 H 2.624 -8.958 -3.965 1.00 . A A . 8 LEU HD12 1 1
8 1867 1 1 8 LEU HD13 H 2.345 -8.035 -5.463 1.00 . A A . 8 LEU HD13 1 1
8 1868 1 1 8 LEU HD21 H 1.002 -7.192 -2.656 1.00 . A A . 8 LEU HD21 1 1
8 1869 1 1 8 LEU HD22 H 1.285 -5.461 -2.974 1.00 . A A . 8 LEU HD22 1 1
8 1870 1 1 8 LEU HD23 H 0.764 -6.517 -4.287 1.00 . A A . 8 LEU HD23 1 1
8 1871 1 1 8 LEU HG H 3.236 -5.968 -4.405 1.00 . A A . 8 LEU HG 1 1
8 1872 1 1 8 LEU N N 2.941 -5.194 -0.864 1.00 . A A . 8 LEU N 1 1
8 1873 1 1 8 LEU O O 5.029 -4.421 -3.610 1.00 . A A . 8 LEU O 1 1
8 1874 1 1 9 ABA C C 4.906 -1.092 -2.935 1.00 . A A . 9 ABA C 1 1
8 1875 1 1 9 ABA CA C 5.793 -2.111 -2.146 1.00 . A A . 9 ABA CA 1 1
8 1876 1 1 9 ABA CB C 6.559 -1.453 -0.954 1.00 . A A . 9 ABA CB 1 1
8 1877 1 1 9 ABA CG C 7.754 -2.302 -0.474 1.00 . A A . 9 ABA CG 1 1
8 1878 1 1 9 ABA H H 4.859 -3.426 -0.644 1.00 . A A . 9 ABA H 1 1
8 1879 1 1 9 ABA HA H 6.563 -2.434 -2.874 1.00 . A A . 9 ABA HA 1 1
8 1880 1 1 9 ABA HB2 H 6.965 -0.473 -1.268 1.00 . A A . 9 ABA HB2 1 1
8 1881 1 1 9 ABA HG1 H 7.422 -3.283 -0.080 1.00 . A A . 9 ABA HG1 1 1
8 1882 1 1 9 ABA HG2 H 8.304 -1.799 0.339 1.00 . A A . 9 ABA HG2 1 1
8 1883 1 1 9 ABA HG3 H 8.468 -2.506 -1.293 1.00 . A A . 9 ABA HG3 1 1
8 1884 1 1 9 ABA N N 5.108 -3.326 -1.634 1.00 . A A . 9 ABA N 1 1
8 1885 1 1 9 ABA O O 5.487 -0.177 -3.524 1.00 . A A . 9 ABA O 1 1
8 1886 1 1 10 ILE C C 1.406 -0.161 -2.892 1.00 . A A . 10 ILE C 1 1
8 1887 1 1 10 ILE CA C 2.665 -0.352 -3.790 1.00 . A A . 10 ILE CA 1 1
8 1888 1 1 10 ILE CB C 2.281 -0.931 -5.203 1.00 . A A . 10 ILE CB 1 1
8 1889 1 1 10 ILE CD1 C 4.381 -0.295 -6.696 1.00 . A A . 10 ILE CD1 1 1
8 1890 1 1 10 ILE CG1 C 3.459 -1.385 -6.121 1.00 . A A . 10 ILE CG1 1 1
8 1891 1 1 10 ILE CG2 C 1.333 0.010 -5.991 1.00 . A A . 10 ILE CG2 1 1
8 1892 1 1 10 ILE H H 3.174 -1.988 -2.410 1.00 . A A . 10 ILE H 1 1
8 1893 1 1 10 ILE HA H 3.161 0.627 -3.954 1.00 . A A . 10 ILE HA 1 1
8 1894 1 1 10 ILE HB H 1.699 -1.850 -5.006 1.00 . A A . 10 ILE HB 1 1
8 1895 1 1 10 ILE HD11 H 4.833 0.329 -5.907 1.00 . A A . 10 ILE HD11 1 1
8 1896 1 1 10 ILE HD12 H 5.210 -0.742 -7.273 1.00 . A A . 10 ILE HD12 1 1
8 1897 1 1 10 ILE HD13 H 3.839 0.383 -7.381 1.00 . A A . 10 ILE HD13 1 1
8 1898 1 1 10 ILE HG12 H 4.082 -2.122 -5.580 1.00 . A A . 10 ILE HG12 1 1
8 1899 1 1 10 ILE HG13 H 3.046 -1.961 -6.970 1.00 . A A . 10 ILE HG13 1 1
8 1900 1 1 10 ILE HG21 H 0.392 0.203 -5.443 1.00 . A A . 10 ILE HG21 1 1
8 1901 1 1 10 ILE HG22 H 1.796 0.996 -6.184 1.00 . A A . 10 ILE HG22 1 1
8 1902 1 1 10 ILE HG23 H 1.042 -0.419 -6.968 1.00 . A A . 10 ILE HG23 1 1
8 1903 1 1 10 ILE N N 3.560 -1.239 -2.997 1.00 . A A . 10 ILE N 1 1
8 1904 1 1 10 ILE O O 0.598 -1.081 -2.725 1.00 . A A . 10 ILE O 1 1
8 1905 1 1 11 GLU C C -0.337 0.664 -0.378 1.00 . A A . 11 GLU C 1 1
8 1906 1 1 11 GLU CA C 0.006 1.524 -1.648 1.00 . A A . 11 GLU CA 1 1
8 1907 1 1 11 GLU CB C -1.136 1.802 -2.692 1.00 . A A . 11 GLU CB 1 1
8 1908 1 1 11 GLU CD C -2.698 3.260 -1.222 1.00 . A A . 11 GLU CD 1 1
8 1909 1 1 11 GLU CG C -2.573 2.096 -2.212 1.00 . A A . 11 GLU CG 1 1
8 1910 1 1 11 GLU H H 2.069 1.650 -2.458 1.00 . A A . 11 GLU H 1 1
8 1911 1 1 11 GLU HA H 0.248 2.529 -1.252 1.00 . A A . 11 GLU HA 1 1
8 1912 1 1 11 GLU HB2 H -0.897 2.660 -3.357 1.00 . A A . 11 GLU HB2 1 1
8 1913 1 1 11 GLU HB3 H -1.163 0.940 -3.378 1.00 . A A . 11 GLU HB3 1 1
8 1914 1 1 11 GLU HE2 H -2.812 5.203 -1.230 1.00 . A A . 11 GLU HE2 1 1
8 1915 1 1 11 GLU HG2 H -3.196 2.309 -3.099 1.00 . A A . 11 GLU HG2 1 1
8 1916 1 1 11 GLU HG3 H -3.022 1.188 -1.776 1.00 . A A . 11 GLU HG3 1 1
8 1917 1 1 11 GLU N N 1.235 1.065 -2.368 1.00 . A A . 11 GLU N 1 1
8 1918 1 1 11 GLU O O -1.468 0.217 -0.212 1.00 . A A . 11 GLU O 1 1
8 1919 1 1 11 GLU OE1 O -2.759 3.106 -0.002 1.00 . A A . 11 GLU OE1 1 1
8 1920 1 1 11 GLU OE2 O -2.733 4.477 -1.853 1.00 . A A . 11 GLU OE2 1 1
8 1921 1 1 12 CYS C C -0.310 0.880 2.914 1.00 . A A . 12 CYS C 1 1
8 1922 1 1 12 CYS CA C 0.394 -0.082 1.904 1.00 . A A . 12 CYS CA 1 1
8 1923 1 1 12 CYS CB C 1.739 -0.527 2.546 1.00 . A A . 12 CYS CB 1 1
8 1924 1 1 12 CYS H H 1.459 1.050 0.339 1.00 . A A . 12 CYS H 1 1
8 1925 1 1 12 CYS HA H -0.241 -0.978 1.800 1.00 . A A . 12 CYS HA 1 1
8 1926 1 1 12 CYS HB2 H 2.466 0.303 2.476 1.00 . A A . 12 CYS HB2 1 1
8 1927 1 1 12 CYS HB3 H 1.640 -0.750 3.626 1.00 . A A . 12 CYS HB3 1 1
8 1928 1 1 12 CYS N N 0.627 0.506 0.550 1.00 . A A . 12 CYS N 1 1
8 1929 1 1 12 CYS O O -0.986 0.386 3.822 1.00 . A A . 12 CYS O 1 1
8 1930 1 1 12 CYS SG S 2.529 -1.946 1.743 1.00 . A A . 12 CYS SG 1 1
8 1931 1 1 13 GLY C C -0.794 4.652 3.331 1.00 . A A . 13 GLY C 1 1
8 1932 1 1 13 GLY CA C -0.649 3.181 3.780 1.00 . A A . 13 GLY CA 1 1
8 1933 1 1 13 GLY H H 0.446 2.465 1.972 1.00 . A A . 13 GLY H 1 1
8 1934 1 1 13 GLY HA2 H -1.637 2.844 4.153 1.00 . A A . 13 GLY HA2 1 1
8 1935 1 1 13 GLY HA3 H 0.011 3.158 4.667 1.00 . A A . 13 GLY HA3 1 1
8 1936 1 1 13 GLY N N -0.134 2.210 2.785 1.00 . A A . 13 GLY N 1 1
8 1937 1 1 13 GLY O O -1.748 5.305 3.762 1.00 . A A . 13 GLY O 1 1
8 1938 1 1 14 ABA C C 1.838 7.121 2.509 1.00 . A A . 14 ABA C 1 1
8 1939 1 1 14 ABA CA C 0.335 6.672 2.367 1.00 . A A . 14 ABA CA 1 1
8 1940 1 1 14 ABA CB C -0.381 7.252 1.090 1.00 . A A . 14 ABA CB 1 1
8 1941 1 1 14 ABA CG C -1.749 6.655 0.719 1.00 . A A . 14 ABA CG 1 1
8 1942 1 1 14 ABA H H 0.901 4.554 2.262 1.00 . A A . 14 ABA H 1 1
8 1943 1 1 14 ABA HA H -0.161 7.174 3.223 1.00 . A A . 14 ABA HA 1 1
8 1944 1 1 14 ABA HB2 H -0.573 8.317 1.317 1.00 . A A . 14 ABA HB2 1 1
8 1945 1 1 14 ABA HG1 H -1.656 5.585 0.456 1.00 . A A . 14 ABA HG1 1 1
8 1946 1 1 14 ABA HG2 H -2.189 7.170 -0.151 1.00 . A A . 14 ABA HG2 1 1
8 1947 1 1 14 ABA HG3 H -2.462 6.727 1.559 1.00 . A A . 14 ABA HG3 1 1
8 1948 1 1 14 ABA N N 0.157 5.195 2.546 1.00 . A A . 14 ABA N 1 1
8 1949 1 1 14 ABA O O 2.206 8.184 1.999 1.00 . A A . 14 ABA O 1 1
8 1950 1 1 15 VAL C C 5.156 5.582 3.514 1.00 . A A . 15 VAL C 1 1
8 1951 1 1 15 VAL CA C 4.102 6.745 3.567 1.00 . A A . 15 VAL CA 1 1
8 1952 1 1 15 VAL CB C 4.106 7.571 4.901 1.00 . A A . 15 VAL CB 1 1
8 1953 1 1 15 VAL CG1 C 3.907 6.755 6.201 1.00 . A A . 15 VAL CG1 1 1
8 1954 1 1 15 VAL CG2 C 5.346 8.480 5.036 1.00 . A A . 15 VAL CG2 1 1
8 1955 1 1 15 VAL H H 2.236 5.574 3.710 1.00 . A A . 15 VAL H 1 1
8 1956 1 1 15 VAL HA H 4.435 7.424 2.762 1.00 . A A . 15 VAL HA 1 1
8 1957 1 1 15 VAL HB H 3.235 8.250 4.848 1.00 . A A . 15 VAL HB 1 1
8 1958 1 1 15 VAL HG11 H 3.018 6.101 6.142 1.00 . A A . 15 VAL HG11 1 1
8 1959 1 1 15 VAL HG12 H 4.778 6.111 6.420 1.00 . A A . 15 VAL HG12 1 1
8 1960 1 1 15 VAL HG13 H 3.762 7.414 7.077 1.00 . A A . 15 VAL HG13 1 1
8 1961 1 1 15 VAL HG21 H 5.461 9.143 4.158 1.00 . A A . 15 VAL HG21 1 1
8 1962 1 1 15 VAL HG22 H 5.279 9.138 5.922 1.00 . A A . 15 VAL HG22 1 1
8 1963 1 1 15 VAL HG23 H 6.281 7.897 5.130 1.00 . A A . 15 VAL HG23 1 1
8 1964 1 1 15 VAL N N 2.694 6.359 3.240 1.00 . A A . 15 VAL N 1 1
8 1965 1 1 15 VAL O O 6.311 5.848 3.169 1.00 . A A . 15 VAL O 1 1
8 1966 1 1 16 ILE C C 6.232 2.625 2.689 1.00 . A A . 16 ILE C 1 1
8 1967 1 1 16 ILE CA C 5.765 3.201 4.071 1.00 . A A . 16 ILE CA 1 1
8 1968 1 1 16 ILE CB C 5.184 2.176 5.126 1.00 . A A . 16 ILE CB 1 1
8 1969 1 1 16 ILE CD1 C 4.292 2.042 7.595 1.00 . A A . 16 ILE CD1 1 1
8 1970 1 1 16 ILE CG1 C 5.183 2.768 6.572 1.00 . A A . 16 ILE CG1 1 1
8 1971 1 1 16 ILE CG2 C 5.895 0.795 5.131 1.00 . A A . 16 ILE CG2 1 1
8 1972 1 1 16 ILE H H 3.794 4.237 4.062 1.00 . A A . 16 ILE H 1 1
8 1973 1 1 16 ILE HA H 6.682 3.618 4.535 1.00 . A A . 16 ILE HA 1 1
8 1974 1 1 16 ILE HB H 4.129 1.980 4.865 1.00 . A A . 16 ILE HB 1 1
8 1975 1 1 16 ILE HD11 H 3.242 1.985 7.254 1.00 . A A . 16 ILE HD11 1 1
8 1976 1 1 16 ILE HD12 H 4.637 1.012 7.794 1.00 . A A . 16 ILE HD12 1 1
8 1977 1 1 16 ILE HD13 H 4.292 2.574 8.564 1.00 . A A . 16 ILE HD13 1 1
8 1978 1 1 16 ILE HG12 H 6.217 2.829 6.961 1.00 . A A . 16 ILE HG12 1 1
8 1979 1 1 16 ILE HG13 H 4.832 3.814 6.544 1.00 . A A . 16 ILE HG13 1 1
8 1980 1 1 16 ILE HG21 H 5.821 0.290 4.150 1.00 . A A . 16 ILE HG21 1 1
8 1981 1 1 16 ILE HG22 H 6.969 0.880 5.376 1.00 . A A . 16 ILE HG22 1 1
8 1982 1 1 16 ILE HG23 H 5.443 0.092 5.855 1.00 . A A . 16 ILE HG23 1 1
8 1983 1 1 16 ILE N N 4.797 4.333 3.879 1.00 . A A . 16 ILE N 1 1
8 1984 1 1 16 ILE O O 7.409 2.766 2.346 1.00 . A A . 16 ILE O 1 1
8 1985 1 1 17 CYS C C 5.502 2.785 -0.489 1.00 . A A . 17 CYS C 1 1
8 1986 1 1 17 CYS CA C 5.596 1.581 0.503 1.00 . A A . 17 CYS CA 1 1
8 1987 1 1 17 CYS CB C 4.652 0.366 0.238 1.00 . A A . 17 CYS CB 1 1
8 1988 1 1 17 CYS H H 4.368 2.025 2.279 1.00 . A A . 17 CYS H 1 1
8 1989 1 1 17 CYS HA H 6.628 1.208 0.387 1.00 . A A . 17 CYS HA 1 1
8 1990 1 1 17 CYS HB2 H 3.752 0.371 0.873 1.00 . A A . 17 CYS HB2 1 1
8 1991 1 1 17 CYS HB3 H 4.221 0.356 -0.771 1.00 . A A . 17 CYS HB3 1 1
8 1992 1 1 17 CYS N N 5.323 2.013 1.905 1.00 . A A . 17 CYS N 1 1
8 1993 1 1 17 CYS O O 5.563 3.954 -0.091 1.00 . A A . 17 CYS O 1 1
8 1994 1 1 17 CYS SG S 5.504 -1.207 0.512 1.00 . A A . 17 CYS SG 1 1
8 1995 1 1 18 ALA C C 3.332 3.615 -2.807 1.00 . A A . 18 ALA C 1 1
8 1996 1 1 18 ALA CA C 4.877 3.496 -2.795 1.00 . A A . 18 ALA CA 1 1
8 1997 1 1 18 ALA CB C 5.493 3.178 -4.171 1.00 . A A . 18 ALA CB 1 1
8 1998 1 1 18 ALA H H 5.455 1.492 -1.972 1.00 . A A . 18 ALA H 1 1
8 1999 1 1 18 ALA HA H 5.189 4.533 -2.541 1.00 . A A . 18 ALA HA 1 1
8 2000 1 1 18 ALA HB1 H 6.598 3.155 -4.134 1.00 . A A . 18 ALA HB1 1 1
8 2001 1 1 18 ALA HB2 H 5.152 2.204 -4.564 1.00 . A A . 18 ALA HB2 1 1
8 2002 1 1 18 ALA HB3 H 5.217 3.942 -4.921 1.00 . A A . 18 ALA HB3 1 1
8 2003 1 1 18 ALA N N 5.374 2.500 -1.795 1.00 . A A . 18 ALA N 1 1
8 2004 1 1 18 ALA O O 2.644 3.460 -3.820 1.00 . A A . 18 ALA O 1 1
8 2005 1 1 19 CYS C C 3.427 6.324 -0.864 1.00 . A A . 19 CYS C 1 1
8 2006 1 1 19 CYS CA C 2.363 5.506 -1.625 1.00 . A A . 19 CYS CA 1 1
8 2007 1 1 19 CYS CB C 0.978 5.600 -0.903 1.00 . A A . 19 CYS CB 1 1
8 2008 1 1 19 CYS H H 3.468 3.886 -0.911 1.00 . A A . 19 CYS H 1 1
8 2009 1 1 19 CYS HXT H 4.614 7.876 -1.110 1.00 . A A . 19 CYS HXT 1 1
8 2010 1 1 19 CYS HA H 2.422 5.906 -2.661 1.00 . A A . 19 CYS HA 1 1
8 2011 1 1 19 CYS HB2 H 0.097 5.199 -1.459 1.00 . A A . 19 CYS HB2 1 1
8 2012 1 1 19 CYS HB3 H 1.001 4.999 0.023 1.00 . A A . 19 CYS HB3 1 1
8 2013 1 1 19 CYS N N 2.816 4.109 -1.671 1.00 . A A . 19 CYS N 1 1
8 2014 1 1 19 CYS O O 3.797 6.091 0.287 1.00 . A A . 19 CYS O 1 1
8 2015 1 1 19 CYS OXT O 3.960 7.405 -1.631 1.00 . A A . 19 CYS OXT 1 1
8 2016 1 1 19 CYS SG S 0.645 7.314 -0.418 1.00 . A A . 19 CYS SG 1 1
9 2017 1 1 1 DAL C C -5.997 0.034 1.950 1.00 . A A . 1 DAL C 1 1
9 2018 1 1 1 DAL CA C -5.066 -1.183 2.259 1.00 . A A . 1 DAL CA 1 1
9 2019 1 1 1 DAL CB C -3.560 -0.928 2.032 1.00 . A A . 1 DAL CB 1 1
9 2020 1 1 1 DAL H1 H -4.937 -0.992 4.316 1.00 . A A . 1 DAL H1 1 1
9 2021 1 1 1 DAL H2 H -4.640 -2.511 3.789 1.00 . A A . 1 DAL H2 1 1
9 2022 1 1 1 DAL HA H -5.371 -1.998 1.575 1.00 . A A . 1 DAL HA 1 1
9 2023 1 1 1 DAL HB1 H -3.173 -0.168 2.737 1.00 . A A . 1 DAL HB1 1 1
9 2024 1 1 1 DAL HB2 H -3.393 -0.520 1.023 1.00 . A A . 1 DAL HB2 1 1
9 2025 1 1 1 DAL N N -5.244 -1.696 3.636 1.00 . A A . 1 DAL N 1 1
9 2026 1 1 1 DAL O O -6.828 0.451 2.765 1.00 . A A . 1 DAL O 1 1
9 2027 1 1 2 SER C C -7.879 0.270 -0.791 1.00 . A A . 2 SER C 1 1
9 2028 1 1 2 SER CA C -7.028 1.283 0.042 1.00 . A A . 2 SER CA 1 1
9 2029 1 1 2 SER CB C -6.439 2.425 -0.818 1.00 . A A . 2 SER CB 1 1
9 2030 1 1 2 SER H H -5.153 0.151 0.147 1.00 . A A . 2 SER H 1 1
9 2031 1 1 2 SER HA H -7.677 1.772 0.797 1.00 . A A . 2 SER HA 1 1
9 2032 1 1 2 SER HB2 H -5.758 2.027 -1.593 1.00 . A A . 2 SER HB2 1 1
9 2033 1 1 2 SER HB3 H -7.246 2.948 -1.364 1.00 . A A . 2 SER HB3 1 1
9 2034 1 1 2 SER HG H -5.421 4.047 -0.627 1.00 . A A . 2 SER HG 1 1
9 2035 1 1 2 SER N N -5.921 0.531 0.698 1.00 . A A . 2 SER N 1 1
9 2036 1 1 2 SER O O -7.803 0.200 -2.023 1.00 . A A . 2 SER O 1 1
9 2037 1 1 2 SER OG O -5.743 3.377 -0.020 1.00 . A A . 2 SER OG 1 1
9 2038 1 1 3 GLY C C -8.229 -2.977 -0.276 1.00 . A A . 3 GLY C 1 1
9 2039 1 1 3 GLY CA C -9.213 -1.822 -0.589 1.00 . A A . 3 GLY CA 1 1
9 2040 1 1 3 GLY H H -8.355 -0.504 0.927 1.00 . A A . 3 GLY H 1 1
9 2041 1 1 3 GLY HA2 H -10.175 -2.000 -0.065 1.00 . A A . 3 GLY HA2 1 1
9 2042 1 1 3 GLY HA3 H -9.485 -1.738 -1.659 1.00 . A A . 3 GLY HA3 1 1
9 2043 1 1 3 GLY N N -8.640 -0.562 -0.058 1.00 . A A . 3 GLY N 1 1
9 2044 1 1 3 GLY O O -7.969 -3.216 0.908 1.00 . A A . 3 GLY O 1 1
9 2045 1 1 4 TRP C C -5.491 -4.132 -2.430 1.00 . A A . 4 TRP C 1 1
9 2046 1 1 4 TRP CA C -6.305 -4.314 -1.111 1.00 . A A . 4 TRP CA 1 1
9 2047 1 1 4 TRP CB C -6.373 -5.804 -0.700 1.00 . A A . 4 TRP CB 1 1
9 2048 1 1 4 TRP CD1 C -8.353 -6.677 0.780 1.00 . A A . 4 TRP CD1 1 1
9 2049 1 1 4 TRP CD2 C -6.578 -5.965 1.917 1.00 . A A . 4 TRP CD2 1 1
9 2050 1 1 4 TRP CE2 C -7.589 -6.372 2.824 1.00 . A A . 4 TRP CE2 1 1
9 2051 1 1 4 TRP CE3 C -5.352 -5.441 2.396 1.00 . A A . 4 TRP CE3 1 1
9 2052 1 1 4 TRP CG C -7.055 -6.147 0.630 1.00 . A A . 4 TRP CG 1 1
9 2053 1 1 4 TRP CH2 C -6.159 -5.740 4.673 1.00 . A A . 4 TRP CH2 1 1
9 2054 1 1 4 TRP CZ2 C -7.376 -6.256 4.222 1.00 . A A . 4 TRP CZ2 1 1
9 2055 1 1 4 TRP CZ3 C -5.162 -5.341 3.774 1.00 . A A . 4 TRP CZ3 1 1
9 2056 1 1 4 TRP H H -7.903 -3.433 -2.255 1.00 . A A . 4 TRP H 1 1
9 2057 1 1 4 TRP HA H -5.756 -3.807 -0.299 1.00 . A A . 4 TRP HA 1 1
9 2058 1 1 4 TRP HB2 H -6.875 -6.292 -1.530 1.00 . A A . 4 TRP HB2 1 1
9 2059 1 1 4 TRP HB3 H -5.359 -6.255 -0.690 1.00 . A A . 4 TRP HB3 1 1
9 2060 1 1 4 TRP HD1 H -9.015 -6.915 -0.040 1.00 . A A . 4 TRP HD1 1 1
9 2061 1 1 4 TRP HE1 H -9.595 -7.167 2.514 1.00 . A A . 4 TRP HE1 1 1
9 2062 1 1 4 TRP HE3 H -4.581 -5.124 1.713 1.00 . A A . 4 TRP HE3 1 1
9 2063 1 1 4 TRP HH2 H -5.985 -5.645 5.735 1.00 . A A . 4 TRP HH2 1 1
9 2064 1 1 4 TRP HZ2 H -8.134 -6.553 4.932 1.00 . A A . 4 TRP HZ2 1 1
9 2065 1 1 4 TRP HZ3 H -4.233 -4.941 4.153 1.00 . A A . 4 TRP HZ3 1 1
9 2066 1 1 4 TRP N N -7.621 -3.639 -1.291 1.00 . A A . 4 TRP N 1 1
9 2067 1 1 4 TRP NE1 N -8.705 -6.824 2.135 1.00 . A A . 4 TRP NE1 1 1
9 2068 1 1 4 TRP O O -5.285 -5.053 -3.228 1.00 . A A . 4 TRP O 1 1
9 2069 1 1 5 VAL C C -2.533 -3.081 -2.712 1.00 . A A . 5 VAL C 1 1
9 2070 1 1 5 VAL CA C -3.803 -2.599 -3.474 1.00 . A A . 5 VAL CA 1 1
9 2071 1 1 5 VAL CB C -3.821 -1.138 -4.065 1.00 . A A . 5 VAL CB 1 1
9 2072 1 1 5 VAL CG1 C -2.612 -0.863 -4.990 1.00 . A A . 5 VAL CG1 1 1
9 2073 1 1 5 VAL CG2 C -5.112 -0.826 -4.859 1.00 . A A . 5 VAL CG2 1 1
9 2074 1 1 5 VAL H H -5.365 -2.292 -1.880 1.00 . A A . 5 VAL H 1 1
9 2075 1 1 5 VAL HA H -3.852 -3.250 -4.350 1.00 . A A . 5 VAL HA 1 1
9 2076 1 1 5 VAL HB H -3.768 -0.384 -3.258 1.00 . A A . 5 VAL HB 1 1
9 2077 1 1 5 VAL HG11 H -1.653 -0.988 -4.456 1.00 . A A . 5 VAL HG11 1 1
9 2078 1 1 5 VAL HG12 H -2.590 -1.543 -5.862 1.00 . A A . 5 VAL HG12 1 1
9 2079 1 1 5 VAL HG13 H -2.617 0.174 -5.378 1.00 . A A . 5 VAL HG13 1 1
9 2080 1 1 5 VAL HG21 H -5.256 -1.520 -5.709 1.00 . A A . 5 VAL HG21 1 1
9 2081 1 1 5 VAL HG22 H -6.012 -0.901 -4.220 1.00 . A A . 5 VAL HG22 1 1
9 2082 1 1 5 VAL HG23 H -5.108 0.201 -5.269 1.00 . A A . 5 VAL HG23 1 1
9 2083 1 1 5 VAL N N -4.962 -2.911 -2.580 1.00 . A A . 5 VAL N 1 1
9 2084 1 1 5 VAL O O -2.050 -4.182 -2.989 1.00 . A A . 5 VAL O 1 1
9 2085 1 1 6 CYS C C -0.477 -3.938 -0.419 1.00 . A A . 6 CYS C 1 1
9 2086 1 1 6 CYS CA C -1.591 -2.846 -0.406 1.00 . A A . 6 CYS CA 1 1
9 2087 1 1 6 CYS CB C -2.728 -3.233 0.567 1.00 . A A . 6 CYS CB 1 1
9 2088 1 1 6 CYS H H -2.517 -1.388 -1.738 1.00 . A A . 6 CYS H 1 1
9 2089 1 1 6 CYS HA H -1.209 -1.923 0.061 1.00 . A A . 6 CYS HA 1 1
9 2090 1 1 6 CYS HB2 H -3.722 -3.002 0.162 1.00 . A A . 6 CYS HB2 1 1
9 2091 1 1 6 CYS HB3 H -2.710 -4.318 0.712 1.00 . A A . 6 CYS HB3 1 1
9 2092 1 1 6 CYS N N -2.097 -2.318 -1.700 1.00 . A A . 6 CYS N 1 1
9 2093 1 1 6 CYS O O -0.638 -5.086 -0.841 1.00 . A A . 6 CYS O 1 1
9 2094 1 1 6 CYS SG S -2.583 -2.447 2.195 1.00 . A A . 6 CYS SG 1 1
9 2095 1 1 7 ABA C C 2.785 -4.959 0.273 1.00 . A A . 7 ABA C 1 1
9 2096 1 1 7 ABA CA C 1.501 -4.431 0.993 1.00 . A A . 7 ABA CA 1 1
9 2097 1 1 7 ABA CB C 1.827 -3.558 2.251 1.00 . A A . 7 ABA CB 1 1
9 2098 1 1 7 ABA CG C 0.622 -3.447 3.220 1.00 . A A . 7 ABA CG 1 1
9 2099 1 1 7 ABA H H 0.316 -2.673 0.689 1.00 . A A . 7 ABA H 1 1
9 2100 1 1 7 ABA HA H 0.946 -5.331 1.325 1.00 . A A . 7 ABA HA 1 1
9 2101 1 1 7 ABA HB2 H 2.642 -4.024 2.837 1.00 . A A . 7 ABA HB2 1 1
9 2102 1 1 7 ABA HG1 H 0.869 -2.908 4.148 1.00 . A A . 7 ABA HG1 1 1
9 2103 1 1 7 ABA HG2 H -0.227 -2.924 2.753 1.00 . A A . 7 ABA HG2 1 1
9 2104 1 1 7 ABA HG3 H 0.238 -4.446 3.504 1.00 . A A . 7 ABA HG3 1 1
9 2105 1 1 7 ABA N N 0.605 -3.533 0.218 1.00 . A A . 7 ABA N 1 1
9 2106 1 1 7 ABA O O 3.762 -5.280 0.958 1.00 . A A . 7 ABA O 1 1
9 2107 1 1 8 LEU C C 4.554 -4.241 -2.627 1.00 . A A . 8 LEU C 1 1
9 2108 1 1 8 LEU CA C 4.024 -5.473 -1.836 1.00 . A A . 8 LEU CA 1 1
9 2109 1 1 8 LEU CB C 3.788 -6.733 -2.727 1.00 . A A . 8 LEU CB 1 1
9 2110 1 1 8 LEU CD1 C 3.012 -9.139 -3.043 1.00 . A A . 8 LEU CD1 1 1
9 2111 1 1 8 LEU CD2 C 4.480 -8.590 -1.063 1.00 . A A . 8 LEU CD2 1 1
9 2112 1 1 8 LEU CG C 3.387 -8.056 -2.011 1.00 . A A . 8 LEU CG 1 1
9 2113 1 1 8 LEU H H 1.973 -4.674 -1.527 1.00 . A A . 8 LEU H 1 1
9 2114 1 1 8 LEU HA H 4.854 -5.735 -1.146 1.00 . A A . 8 LEU HA 1 1
9 2115 1 1 8 LEU HB2 H 3.022 -6.489 -3.489 1.00 . A A . 8 LEU HB2 1 1
9 2116 1 1 8 LEU HB3 H 4.705 -6.928 -3.319 1.00 . A A . 8 LEU HB3 1 1
9 2117 1 1 8 LEU HD11 H 2.184 -8.807 -3.698 1.00 . A A . 8 LEU HD11 1 1
9 2118 1 1 8 LEU HD12 H 3.863 -9.403 -3.698 1.00 . A A . 8 LEU HD12 1 1
9 2119 1 1 8 LEU HD13 H 2.673 -10.071 -2.553 1.00 . A A . 8 LEU HD13 1 1
9 2120 1 1 8 LEU HD21 H 5.430 -8.788 -1.593 1.00 . A A . 8 LEU HD21 1 1
9 2121 1 1 8 LEU HD22 H 4.701 -7.876 -0.248 1.00 . A A . 8 LEU HD22 1 1
9 2122 1 1 8 LEU HD23 H 4.173 -9.534 -0.575 1.00 . A A . 8 LEU HD23 1 1
9 2123 1 1 8 LEU HG H 2.481 -7.865 -1.405 1.00 . A A . 8 LEU HG 1 1
9 2124 1 1 8 LEU N N 2.790 -5.100 -1.071 1.00 . A A . 8 LEU N 1 1
9 2125 1 1 8 LEU O O 4.626 -4.230 -3.860 1.00 . A A . 8 LEU O 1 1
9 2126 1 1 9 ABA C C 4.737 -0.932 -3.122 1.00 . A A . 9 ABA C 1 1
9 2127 1 1 9 ABA CA C 5.630 -1.994 -2.400 1.00 . A A . 9 ABA CA 1 1
9 2128 1 1 9 ABA CB C 6.461 -1.368 -1.234 1.00 . A A . 9 ABA CB 1 1
9 2129 1 1 9 ABA CG C 7.700 -2.205 -0.859 1.00 . A A . 9 ABA CG 1 1
9 2130 1 1 9 ABA H H 4.781 -3.323 -0.863 1.00 . A A . 9 ABA H 1 1
9 2131 1 1 9 ABA HA H 6.355 -2.324 -3.171 1.00 . A A . 9 ABA HA 1 1
9 2132 1 1 9 ABA HB2 H 6.832 -0.369 -1.532 1.00 . A A . 9 ABA HB2 1 1
9 2133 1 1 9 ABA HG1 H 7.417 -3.210 -0.493 1.00 . A A . 9 ABA HG1 1 1
9 2134 1 1 9 ABA HG2 H 8.282 -1.720 -0.056 1.00 . A A . 9 ABA HG2 1 1
9 2135 1 1 9 ABA HG3 H 8.374 -2.348 -1.723 1.00 . A A . 9 ABA HG3 1 1
9 2136 1 1 9 ABA N N 4.947 -3.202 -1.868 1.00 . A A . 9 ABA N 1 1
9 2137 1 1 9 ABA O O 5.317 -0.017 -3.712 1.00 . A A . 9 ABA O 1 1
9 2138 1 1 10 ILE C C 1.270 0.108 -2.887 1.00 . A A . 10 ILE C 1 1
9 2139 1 1 10 ILE CA C 2.485 -0.094 -3.840 1.00 . A A . 10 ILE CA 1 1
9 2140 1 1 10 ILE CB C 2.025 -0.601 -5.258 1.00 . A A . 10 ILE CB 1 1
9 2141 1 1 10 ILE CD1 C 4.065 0.063 -6.819 1.00 . A A . 10 ILE CD1 1 1
9 2142 1 1 10 ILE CG1 C 3.151 -1.036 -6.248 1.00 . A A . 10 ILE CG1 1 1
9 2143 1 1 10 ILE CG2 C 1.062 0.393 -5.961 1.00 . A A . 10 ILE CG2 1 1
9 2144 1 1 10 ILE H H 3.017 -1.805 -2.549 1.00 . A A . 10 ILE H 1 1
9 2145 1 1 10 ILE HA H 3.006 0.875 -3.990 1.00 . A A . 10 ILE HA 1 1
9 2146 1 1 10 ILE HB H 1.432 -1.514 -5.072 1.00 . A A . 10 ILE HB 1 1
9 2147 1 1 10 ILE HD11 H 4.560 0.648 -6.027 1.00 . A A . 10 ILE HD11 1 1
9 2148 1 1 10 ILE HD12 H 4.862 -0.374 -7.449 1.00 . A A . 10 ILE HD12 1 1
9 2149 1 1 10 ILE HD13 H 3.506 0.774 -7.454 1.00 . A A . 10 ILE HD13 1 1
9 2150 1 1 10 ILE HG12 H 3.783 -1.805 -5.768 1.00 . A A . 10 ILE HG12 1 1
9 2151 1 1 10 ILE HG13 H 2.688 -1.568 -7.100 1.00 . A A . 10 ILE HG13 1 1
9 2152 1 1 10 ILE HG21 H 0.148 0.574 -5.367 1.00 . A A . 10 ILE HG21 1 1
9 2153 1 1 10 ILE HG22 H 1.536 1.378 -6.127 1.00 . A A . 10 ILE HG22 1 1
9 2154 1 1 10 ILE HG23 H 0.724 0.015 -6.944 1.00 . A A . 10 ILE HG23 1 1
9 2155 1 1 10 ILE N N 3.388 -1.039 -3.124 1.00 . A A . 10 ILE N 1 1
9 2156 1 1 10 ILE O O 0.423 -0.780 -2.741 1.00 . A A . 10 ILE O 1 1
9 2157 1 1 11 GLU C C -0.354 0.857 -0.283 1.00 . A A . 11 GLU C 1 1
9 2158 1 1 11 GLU CA C -0.003 1.788 -1.502 1.00 . A A . 11 GLU CA 1 1
9 2159 1 1 11 GLU CB C -1.159 2.193 -2.482 1.00 . A A . 11 GLU CB 1 1
9 2160 1 1 11 GLU CD C -3.458 3.269 -2.893 1.00 . A A . 11 GLU CD 1 1
9 2161 1 1 11 GLU CG C -2.517 2.618 -1.874 1.00 . A A . 11 GLU CG 1 1
9 2162 1 1 11 GLU H H 2.048 1.846 -2.373 1.00 . A A . 11 GLU H 1 1
9 2163 1 1 11 GLU HA H 0.303 2.752 -1.052 1.00 . A A . 11 GLU HA 1 1
9 2164 1 1 11 GLU HB2 H -0.864 3.045 -3.132 1.00 . A A . 11 GLU HB2 1 1
9 2165 1 1 11 GLU HB3 H -1.291 1.355 -3.185 1.00 . A A . 11 GLU HB3 1 1
9 2166 1 1 11 GLU HE2 H -4.629 2.761 -4.362 1.00 . A A . 11 GLU HE2 1 1
9 2167 1 1 11 GLU HG2 H -3.040 1.753 -1.429 1.00 . A A . 11 GLU HG2 1 1
9 2168 1 1 11 GLU HG3 H -2.348 3.327 -1.042 1.00 . A A . 11 GLU HG3 1 1
9 2169 1 1 11 GLU N N 1.179 1.310 -2.292 1.00 . A A . 11 GLU N 1 1
9 2170 1 1 11 GLU O O -1.496 0.430 -0.124 1.00 . A A . 11 GLU O 1 1
9 2171 1 1 11 GLU OE1 O -3.665 4.481 -2.944 1.00 . A A . 11 GLU OE1 1 1
9 2172 1 1 11 GLU OE2 O -4.039 2.348 -3.727 1.00 . A A . 11 GLU OE2 1 1
9 2173 1 1 12 CYS C C -0.237 0.878 3.012 1.00 . A A . 12 CYS C 1 1
9 2174 1 1 12 CYS CA C 0.413 -0.046 1.934 1.00 . A A . 12 CYS CA 1 1
9 2175 1 1 12 CYS CB C 1.767 -0.548 2.512 1.00 . A A . 12 CYS CB 1 1
9 2176 1 1 12 CYS H H 1.478 1.124 0.401 1.00 . A A . 12 CYS H 1 1
9 2177 1 1 12 CYS HA H -0.246 -0.920 1.801 1.00 . A A . 12 CYS HA 1 1
9 2178 1 1 12 CYS HB2 H 2.514 0.266 2.450 1.00 . A A . 12 CYS HB2 1 1
9 2179 1 1 12 CYS HB3 H 1.700 -0.810 3.585 1.00 . A A . 12 CYS HB3 1 1
9 2180 1 1 12 CYS N N 0.627 0.609 0.607 1.00 . A A . 12 CYS N 1 1
9 2181 1 1 12 CYS O O -0.893 0.356 3.919 1.00 . A A . 12 CYS O 1 1
9 2182 1 1 12 CYS SG S 2.493 -1.956 1.631 1.00 . A A . 12 CYS SG 1 1
9 2183 1 1 13 GLY C C -0.673 4.641 3.554 1.00 . A A . 13 GLY C 1 1
9 2184 1 1 13 GLY CA C -0.556 3.153 3.953 1.00 . A A . 13 GLY CA 1 1
9 2185 1 1 13 GLY H H 0.518 2.486 2.114 1.00 . A A . 13 GLY H 1 1
9 2186 1 1 13 GLY HA2 H -1.554 2.818 4.301 1.00 . A A . 13 GLY HA2 1 1
9 2187 1 1 13 GLY HA3 H 0.092 3.090 4.847 1.00 . A A . 13 GLY HA3 1 1
9 2188 1 1 13 GLY N N -0.042 2.209 2.934 1.00 . A A . 13 GLY N 1 1
9 2189 1 1 13 GLY O O -1.576 5.311 4.064 1.00 . A A . 13 GLY O 1 1
9 2190 1 1 14 ABA C C 1.981 7.067 2.778 1.00 . A A . 14 ABA C 1 1
9 2191 1 1 14 ABA CA C 0.469 6.659 2.608 1.00 . A A . 14 ABA CA 1 1
9 2192 1 1 14 ABA CB C -0.240 7.318 1.365 1.00 . A A . 14 ABA CB 1 1
9 2193 1 1 14 ABA CG C -1.631 6.782 0.973 1.00 . A A . 14 ABA CG 1 1
9 2194 1 1 14 ABA H H 0.923 4.518 2.344 1.00 . A A . 14 ABA H 1 1
9 2195 1 1 14 ABA HA H -0.011 7.141 3.483 1.00 . A A . 14 ABA HA 1 1
9 2196 1 1 14 ABA HB2 H -0.403 8.375 1.649 1.00 . A A . 14 ABA HB2 1 1
9 2197 1 1 14 ABA HG1 H -1.578 5.732 0.629 1.00 . A A . 14 ABA HG1 1 1
9 2198 1 1 14 ABA HG2 H -2.069 7.374 0.151 1.00 . A A . 14 ABA HG2 1 1
9 2199 1 1 14 ABA HG3 H -2.332 6.815 1.825 1.00 . A A . 14 ABA HG3 1 1
9 2200 1 1 14 ABA N N 0.243 5.182 2.724 1.00 . A A . 14 ABA N 1 1
9 2201 1 1 14 ABA O O 2.365 8.161 2.352 1.00 . A A . 14 ABA O 1 1
9 2202 1 1 15 VAL C C 5.225 5.410 3.513 1.00 . A A . 15 VAL C 1 1
9 2203 1 1 15 VAL CA C 4.234 6.586 3.828 1.00 . A A . 15 VAL CA 1 1
9 2204 1 1 15 VAL CB C 4.347 7.098 5.315 1.00 . A A . 15 VAL CB 1 1
9 2205 1 1 15 VAL CG1 C 5.788 7.484 5.734 1.00 . A A . 15 VAL CG1 1 1
9 2206 1 1 15 VAL CG2 C 3.442 8.313 5.643 1.00 . A A . 15 VAL CG2 1 1
9 2207 1 1 15 VAL H H 2.397 5.347 3.724 1.00 . A A . 15 VAL H 1 1
9 2208 1 1 15 VAL HA H 4.571 7.406 3.176 1.00 . A A . 15 VAL HA 1 1
9 2209 1 1 15 VAL HB H 4.030 6.274 5.983 1.00 . A A . 15 VAL HB 1 1
9 2210 1 1 15 VAL HG11 H 6.200 8.294 5.103 1.00 . A A . 15 VAL HG11 1 1
9 2211 1 1 15 VAL HG12 H 5.839 7.827 6.785 1.00 . A A . 15 VAL HG12 1 1
9 2212 1 1 15 VAL HG13 H 6.483 6.628 5.660 1.00 . A A . 15 VAL HG13 1 1
9 2213 1 1 15 VAL HG21 H 3.669 9.183 4.998 1.00 . A A . 15 VAL HG21 1 1
9 2214 1 1 15 VAL HG22 H 2.371 8.077 5.507 1.00 . A A . 15 VAL HG22 1 1
9 2215 1 1 15 VAL HG23 H 3.551 8.643 6.693 1.00 . A A . 15 VAL HG23 1 1
9 2216 1 1 15 VAL N N 2.822 6.243 3.456 1.00 . A A . 15 VAL N 1 1
9 2217 1 1 15 VAL O O 6.290 5.657 2.940 1.00 . A A . 15 VAL O 1 1
9 2218 1 1 16 ILE C C 6.322 2.501 2.647 1.00 . A A . 16 ILE C 1 1
9 2219 1 1 16 ILE CA C 5.898 3.042 4.054 1.00 . A A . 16 ILE CA 1 1
9 2220 1 1 16 ILE CB C 5.347 1.986 5.094 1.00 . A A . 16 ILE CB 1 1
9 2221 1 1 16 ILE CD1 C 4.530 1.794 7.584 1.00 . A A . 16 ILE CD1 1 1
9 2222 1 1 16 ILE CG1 C 5.410 2.529 6.558 1.00 . A A . 16 ILE CG1 1 1
9 2223 1 1 16 ILE CG2 C 6.028 0.591 5.023 1.00 . A A . 16 ILE CG2 1 1
9 2224 1 1 16 ILE H H 3.952 4.099 4.275 1.00 . A A . 16 ILE H 1 1
9 2225 1 1 16 ILE HA H 6.828 3.452 4.499 1.00 . A A . 16 ILE HA 1 1
9 2226 1 1 16 ILE HB H 4.280 1.811 4.860 1.00 . A A . 16 ILE HB 1 1
9 2227 1 1 16 ILE HD11 H 3.468 1.784 7.277 1.00 . A A . 16 ILE HD11 1 1
9 2228 1 1 16 ILE HD12 H 4.847 0.745 7.731 1.00 . A A . 16 ILE HD12 1 1
9 2229 1 1 16 ILE HD13 H 4.580 2.286 8.572 1.00 . A A . 16 ILE HD13 1 1
9 2230 1 1 16 ILE HG12 H 6.457 2.543 6.915 1.00 . A A . 16 ILE HG12 1 1
9 2231 1 1 16 ILE HG13 H 5.094 3.589 6.580 1.00 . A A . 16 ILE HG13 1 1
9 2232 1 1 16 ILE HG21 H 5.903 0.122 4.030 1.00 . A A . 16 ILE HG21 1 1
9 2233 1 1 16 ILE HG22 H 7.112 0.644 5.227 1.00 . A A . 16 ILE HG22 1 1
9 2234 1 1 16 ILE HG23 H 5.589 -0.127 5.741 1.00 . A A . 16 ILE HG23 1 1
9 2235 1 1 16 ILE N N 4.919 4.173 3.948 1.00 . A A . 16 ILE N 1 1
9 2236 1 1 16 ILE O O 7.499 2.602 2.289 1.00 . A A . 16 ILE O 1 1
9 2237 1 1 17 CYS C C 5.527 2.820 -0.505 1.00 . A A . 17 CYS C 1 1
9 2238 1 1 17 CYS CA C 5.602 1.577 0.438 1.00 . A A . 17 CYS CA 1 1
9 2239 1 1 17 CYS CB C 4.632 0.392 0.143 1.00 . A A . 17 CYS CB 1 1
9 2240 1 1 17 CYS H H 4.428 2.029 2.261 1.00 . A A . 17 CYS H 1 1
9 2241 1 1 17 CYS HA H 6.622 1.185 0.287 1.00 . A A . 17 CYS HA 1 1
9 2242 1 1 17 CYS HB2 H 3.759 0.367 0.815 1.00 . A A . 17 CYS HB2 1 1
9 2243 1 1 17 CYS HB3 H 4.163 0.442 -0.849 1.00 . A A . 17 CYS HB3 1 1
9 2244 1 1 17 CYS N N 5.372 1.961 1.862 1.00 . A A . 17 CYS N 1 1
9 2245 1 1 17 CYS O O 5.629 3.970 -0.063 1.00 . A A . 17 CYS O 1 1
9 2246 1 1 17 CYS SG S 5.487 -1.196 0.299 1.00 . A A . 17 CYS SG 1 1
9 2247 1 1 18 ALA C C 3.340 3.797 -2.745 1.00 . A A . 18 ALA C 1 1
9 2248 1 1 18 ALA CA C 4.881 3.636 -2.769 1.00 . A A . 18 ALA CA 1 1
9 2249 1 1 18 ALA CB C 5.463 3.361 -4.168 1.00 . A A . 18 ALA CB 1 1
9 2250 1 1 18 ALA H H 5.407 1.585 -2.032 1.00 . A A . 18 ALA H 1 1
9 2251 1 1 18 ALA HA H 5.225 4.654 -2.479 1.00 . A A . 18 ALA HA 1 1
9 2252 1 1 18 ALA HB1 H 6.568 3.304 -4.153 1.00 . A A . 18 ALA HB1 1 1
9 2253 1 1 18 ALA HB2 H 5.087 2.415 -4.596 1.00 . A A . 18 ALA HB2 1 1
9 2254 1 1 18 ALA HB3 H 5.196 4.164 -4.880 1.00 . A A . 18 ALA HB3 1 1
9 2255 1 1 18 ALA N N 5.368 2.588 -1.818 1.00 . A A . 18 ALA N 1 1
9 2256 1 1 18 ALA O O 2.628 3.705 -3.750 1.00 . A A . 18 ALA O 1 1
9 2257 1 1 19 CYS C C 3.535 6.405 -0.671 1.00 . A A . 19 CYS C 1 1
9 2258 1 1 19 CYS CA C 2.441 5.653 -1.457 1.00 . A A . 19 CYS CA 1 1
9 2259 1 1 19 CYS CB C 1.069 5.741 -0.711 1.00 . A A . 19 CYS CB 1 1
9 2260 1 1 19 CYS H H 3.519 3.975 -0.841 1.00 . A A . 19 CYS H 1 1
9 2261 1 1 19 CYS HXT H 4.782 7.917 -0.871 1.00 . A A . 19 CYS HXT 1 1
9 2262 1 1 19 CYS HA H 2.495 6.100 -2.473 1.00 . A A . 19 CYS HA 1 1
9 2263 1 1 19 CYS HB2 H 0.171 5.386 -1.273 1.00 . A A . 19 CYS HB2 1 1
9 2264 1 1 19 CYS HB3 H 1.092 5.097 0.185 1.00 . A A . 19 CYS HB3 1 1
9 2265 1 1 19 CYS N N 2.859 4.250 -1.577 1.00 . A A . 19 CYS N 1 1
9 2266 1 1 19 CYS O O 3.895 6.123 0.472 1.00 . A A . 19 CYS O 1 1
9 2267 1 1 19 CYS OXT O 4.111 7.487 -1.406 1.00 . A A . 19 CYS OXT 1 1
9 2268 1 1 19 CYS SG S 0.781 7.436 -0.141 1.00 . A A . 19 CYS SG 1 1
10 2269 1 1 1 DAL C C -5.975 -0.219 1.998 1.00 . A A . 1 DAL C 1 1
10 2270 1 1 1 DAL CA C -5.011 -1.396 2.348 1.00 . A A . 1 DAL CA 1 1
10 2271 1 1 1 DAL CB C -3.512 -1.081 2.149 1.00 . A A . 1 DAL CB 1 1
10 2272 1 1 1 DAL H1 H -6.186 -2.154 3.874 1.00 . A A . 1 DAL H1 1 1
10 2273 1 1 1 DAL H2 H -5.002 -1.160 4.405 1.00 . A A . 1 DAL H2 1 1
10 2274 1 1 1 DAL HA H -5.269 -2.229 1.668 1.00 . A A . 1 DAL HA 1 1
10 2275 1 1 1 DAL HB1 H -3.168 -0.304 2.857 1.00 . A A . 1 DAL HB1 1 1
10 2276 1 1 1 DAL HB2 H -3.344 -0.670 1.141 1.00 . A A . 1 DAL HB2 1 1
10 2277 1 1 1 DAL N N -5.203 -1.902 3.726 1.00 . A A . 1 DAL N 1 1
10 2278 1 1 1 DAL O O -6.820 0.203 2.796 1.00 . A A . 1 DAL O 1 1
10 2279 1 1 2 SER C C -7.836 -0.147 -0.766 1.00 . A A . 2 SER C 1 1
10 2280 1 1 2 SER CA C -7.028 0.924 0.038 1.00 . A A . 2 SER CA 1 1
10 2281 1 1 2 SER CB C -6.468 2.054 -0.857 1.00 . A A . 2 SER CB 1 1
10 2282 1 1 2 SER H H -5.121 -0.152 0.203 1.00 . A A . 2 SER H 1 1
10 2283 1 1 2 SER HA H -7.702 1.416 0.769 1.00 . A A . 2 SER HA 1 1
10 2284 1 1 2 SER HB2 H -5.764 1.652 -1.610 1.00 . A A . 2 SER HB2 1 1
10 2285 1 1 2 SER HB3 H -7.286 2.528 -1.430 1.00 . A A . 2 SER HB3 1 1
10 2286 1 1 2 SER HG H -6.477 3.400 0.517 1.00 . A A . 2 SER HG 1 1
10 2287 1 1 2 SER N N -5.903 0.234 0.730 1.00 . A A . 2 SER N 1 1
10 2288 1 1 2 SER O O -7.749 -0.254 -1.995 1.00 . A A . 2 SER O 1 1
10 2289 1 1 2 SER OG O -5.814 3.057 -0.087 1.00 . A A . 2 SER OG 1 1
10 2290 1 1 3 GLY C C -8.016 -3.378 -0.213 1.00 . A A . 3 GLY C 1 1
10 2291 1 1 3 GLY CA C -9.078 -2.288 -0.505 1.00 . A A . 3 GLY CA 1 1
10 2292 1 1 3 GLY H H -8.302 -0.879 0.976 1.00 . A A . 3 GLY H 1 1
10 2293 1 1 3 GLY HA2 H -10.010 -2.519 0.051 1.00 . A A . 3 GLY HA2 1 1
10 2294 1 1 3 GLY HA3 H -9.390 -2.236 -1.566 1.00 . A A . 3 GLY HA3 1 1
10 2295 1 1 3 GLY N N -8.569 -0.986 -0.010 1.00 . A A . 3 GLY N 1 1
10 2296 1 1 3 GLY O O -7.714 -3.596 0.966 1.00 . A A . 3 GLY O 1 1
10 2297 1 1 4 TRP C C -5.290 -4.415 -2.444 1.00 . A A . 4 TRP C 1 1
10 2298 1 1 4 TRP CA C -6.046 -4.614 -1.097 1.00 . A A . 4 TRP CA 1 1
10 2299 1 1 4 TRP CB C -6.023 -6.093 -0.657 1.00 . A A . 4 TRP CB 1 1
10 2300 1 1 4 TRP CD1 C -5.646 -6.220 1.929 1.00 . A A . 4 TRP CD1 1 1
10 2301 1 1 4 TRP CD2 C -7.682 -6.816 1.253 1.00 . A A . 4 TRP CD2 1 1
10 2302 1 1 4 TRP CE2 C -7.611 -6.889 2.668 1.00 . A A . 4 TRP CE2 1 1
10 2303 1 1 4 TRP CE3 C -8.895 -7.107 0.578 1.00 . A A . 4 TRP CE3 1 1
10 2304 1 1 4 TRP CG C -6.451 -6.392 0.783 1.00 . A A . 4 TRP CG 1 1
10 2305 1 1 4 TRP CH2 C -9.939 -7.549 2.734 1.00 . A A . 4 TRP CH2 1 1
10 2306 1 1 4 TRP CZ2 C -8.756 -7.260 3.417 1.00 . A A . 4 TRP CZ2 1 1
10 2307 1 1 4 TRP CZ3 C -10.007 -7.474 1.337 1.00 . A A . 4 TRP CZ3 1 1
10 2308 1 1 4 TRP H H -7.687 -3.779 -2.199 1.00 . A A . 4 TRP H 1 1
10 2309 1 1 4 TRP HA H -5.494 -4.075 -0.310 1.00 . A A . 4 TRP HA 1 1
10 2310 1 1 4 TRP HB2 H -6.650 -6.609 -1.378 1.00 . A A . 4 TRP HB2 1 1
10 2311 1 1 4 TRP HB3 H -5.012 -6.524 -0.801 1.00 . A A . 4 TRP HB3 1 1
10 2312 1 1 4 TRP HD1 H -4.624 -5.869 1.911 1.00 . A A . 4 TRP HD1 1 1
10 2313 1 1 4 TRP HE1 H -5.999 -6.462 4.074 1.00 . A A . 4 TRP HE1 1 1
10 2314 1 1 4 TRP HE3 H -8.966 -7.039 -0.498 1.00 . A A . 4 TRP HE3 1 1
10 2315 1 1 4 TRP HH2 H -10.818 -7.832 3.293 1.00 . A A . 4 TRP HH2 1 1
10 2316 1 1 4 TRP HZ2 H -8.728 -7.316 4.496 1.00 . A A . 4 TRP HZ2 1 1
10 2317 1 1 4 TRP HZ3 H -10.939 -7.697 0.839 1.00 . A A . 4 TRP HZ3 1 1
10 2318 1 1 4 TRP N N -7.396 -4.003 -1.242 1.00 . A A . 4 TRP N 1 1
10 2319 1 1 4 TRP NE1 N -6.346 -6.526 3.110 1.00 . A A . 4 TRP NE1 1 1
10 2320 1 1 4 TRP O O -5.104 -5.324 -3.261 1.00 . A A . 4 TRP O 1 1
10 2321 1 1 5 VAL C C -2.339 -3.322 -2.589 1.00 . A A . 5 VAL C 1 1
10 2322 1 1 5 VAL CA C -3.578 -2.874 -3.423 1.00 . A A . 5 VAL CA 1 1
10 2323 1 1 5 VAL CB C -3.597 -1.421 -4.032 1.00 . A A . 5 VAL CB 1 1
10 2324 1 1 5 VAL CG1 C -2.352 -1.134 -4.903 1.00 . A A . 5 VAL CG1 1 1
10 2325 1 1 5 VAL CG2 C -4.855 -1.141 -4.890 1.00 . A A . 5 VAL CG2 1 1
10 2326 1 1 5 VAL H H -5.144 -2.607 -1.834 1.00 . A A . 5 VAL H 1 1
10 2327 1 1 5 VAL HA H -3.572 -3.538 -4.290 1.00 . A A . 5 VAL HA 1 1
10 2328 1 1 5 VAL HB H -3.599 -0.661 -3.228 1.00 . A A . 5 VAL HB 1 1
10 2329 1 1 5 VAL HG11 H -1.417 -1.243 -4.326 1.00 . A A . 5 VAL HG11 1 1
10 2330 1 1 5 VAL HG12 H -2.281 -1.820 -5.768 1.00 . A A . 5 VAL HG12 1 1
10 2331 1 1 5 VAL HG13 H -2.355 -0.101 -5.298 1.00 . A A . 5 VAL HG13 1 1
10 2332 1 1 5 VAL HG21 H -4.947 -1.848 -5.736 1.00 . A A . 5 VAL HG21 1 1
10 2333 1 1 5 VAL HG22 H -5.783 -1.225 -4.293 1.00 . A A . 5 VAL HG22 1 1
10 2334 1 1 5 VAL HG23 H -4.849 -0.119 -5.312 1.00 . A A . 5 VAL HG23 1 1
10 2335 1 1 5 VAL N N -4.775 -3.189 -2.583 1.00 . A A . 5 VAL N 1 1
10 2336 1 1 5 VAL O O -1.819 -4.414 -2.828 1.00 . A A . 5 VAL O 1 1
10 2337 1 1 6 CYS C C -0.370 -4.120 -0.217 1.00 . A A . 6 CYS C 1 1
10 2338 1 1 6 CYS CA C -1.482 -3.028 -0.251 1.00 . A A . 6 CYS CA 1 1
10 2339 1 1 6 CYS CB C -2.626 -3.387 0.723 1.00 . A A . 6 CYS CB 1 1
10 2340 1 1 6 CYS H H -2.403 -1.613 -1.638 1.00 . A A . 6 CYS H 1 1
10 2341 1 1 6 CYS HA H -1.106 -2.093 0.194 1.00 . A A . 6 CYS HA 1 1
10 2342 1 1 6 CYS HB2 H -3.613 -3.155 0.302 1.00 . A A . 6 CYS HB2 1 1
10 2343 1 1 6 CYS HB3 H -2.615 -4.467 0.899 1.00 . A A . 6 CYS HB3 1 1
10 2344 1 1 6 CYS N N -1.973 -2.536 -1.566 1.00 . A A . 6 CYS N 1 1
10 2345 1 1 6 CYS O O -0.548 -5.291 -0.563 1.00 . A A . 6 CYS O 1 1
10 2346 1 1 6 CYS SG S -2.481 -2.561 2.331 1.00 . A A . 6 CYS SG 1 1
10 2347 1 1 7 ABA C C 2.963 -4.992 0.388 1.00 . A A . 7 ABA C 1 1
10 2348 1 1 7 ABA CA C 1.663 -4.541 1.135 1.00 . A A . 7 ABA CA 1 1
10 2349 1 1 7 ABA CB C 1.953 -3.672 2.403 1.00 . A A . 7 ABA CB 1 1
10 2350 1 1 7 ABA CG C 0.742 -3.602 3.369 1.00 . A A . 7 ABA CG 1 1
10 2351 1 1 7 ABA H H 0.426 -2.815 0.827 1.00 . A A . 7 ABA H 1 1
10 2352 1 1 7 ABA HA H 1.156 -5.473 1.459 1.00 . A A . 7 ABA HA 1 1
10 2353 1 1 7 ABA HB2 H 2.778 -4.122 2.987 1.00 . A A . 7 ABA HB2 1 1
10 2354 1 1 7 ABA HG1 H 0.977 -3.076 4.308 1.00 . A A . 7 ABA HG1 1 1
10 2355 1 1 7 ABA HG2 H -0.115 -3.083 2.909 1.00 . A A . 7 ABA HG2 1 1
10 2356 1 1 7 ABA HG3 H 0.376 -4.612 3.634 1.00 . A A . 7 ABA HG3 1 1
10 2357 1 1 7 ABA N N 0.725 -3.679 0.370 1.00 . A A . 7 ABA N 1 1
10 2358 1 1 7 ABA O O 3.999 -5.178 1.035 1.00 . A A . 7 ABA O 1 1
10 2359 1 1 8 LEU C C 4.799 -4.374 -2.444 1.00 . A A . 8 LEU C 1 1
10 2360 1 1 8 LEU CA C 4.116 -5.594 -1.756 1.00 . A A . 8 LEU CA 1 1
10 2361 1 1 8 LEU CB C 3.790 -6.808 -2.690 1.00 . A A . 8 LEU CB 1 1
10 2362 1 1 8 LEU CD1 C 1.206 -6.926 -3.074 1.00 . A A . 8 LEU CD1 1 1
10 2363 1 1 8 LEU CD2 C 2.628 -5.707 -4.772 1.00 . A A . 8 LEU CD2 1 1
10 2364 1 1 8 LEU CG C 2.606 -6.826 -3.714 1.00 . A A . 8 LEU CG 1 1
10 2365 1 1 8 LEU H H 2.063 -4.871 -1.399 1.00 . A A . 8 LEU H 1 1
10 2366 1 1 8 LEU HA H 4.917 -5.963 -1.080 1.00 . A A . 8 LEU HA 1 1
10 2367 1 1 8 LEU HB2 H 4.713 -7.046 -3.253 1.00 . A A . 8 LEU HB2 1 1
10 2368 1 1 8 LEU HB3 H 3.667 -7.695 -2.038 1.00 . A A . 8 LEU HB3 1 1
10 2369 1 1 8 LEU HD11 H 1.164 -7.707 -2.293 1.00 . A A . 8 LEU HD11 1 1
10 2370 1 1 8 LEU HD12 H 0.891 -5.974 -2.611 1.00 . A A . 8 LEU HD12 1 1
10 2371 1 1 8 LEU HD13 H 0.436 -7.183 -3.825 1.00 . A A . 8 LEU HD13 1 1
10 2372 1 1 8 LEU HD21 H 3.586 -5.690 -5.324 1.00 . A A . 8 LEU HD21 1 1
10 2373 1 1 8 LEU HD22 H 1.832 -5.843 -5.528 1.00 . A A . 8 LEU HD22 1 1
10 2374 1 1 8 LEU HD23 H 2.483 -4.707 -4.323 1.00 . A A . 8 LEU HD23 1 1
10 2375 1 1 8 LEU HG H 2.731 -7.770 -4.277 1.00 . A A . 8 LEU HG 1 1
10 2376 1 1 8 LEU N N 2.917 -5.214 -0.946 1.00 . A A . 8 LEU N 1 1
10 2377 1 1 8 LEU O O 5.102 -4.379 -3.641 1.00 . A A . 8 LEU O 1 1
10 2378 1 1 9 ABA C C 4.896 -1.061 -2.849 1.00 . A A . 9 ABA C 1 1
10 2379 1 1 9 ABA CA C 5.783 -2.106 -2.095 1.00 . A A . 9 ABA CA 1 1
10 2380 1 1 9 ABA CB C 6.557 -1.503 -0.880 1.00 . A A . 9 ABA CB 1 1
10 2381 1 1 9 ABA CG C 7.738 -2.388 -0.434 1.00 . A A . 9 ABA CG 1 1
10 2382 1 1 9 ABA H H 4.806 -3.463 -0.661 1.00 . A A . 9 ABA H 1 1
10 2383 1 1 9 ABA HA H 6.554 -2.400 -2.836 1.00 . A A . 9 ABA HA 1 1
10 2384 1 1 9 ABA HB2 H 6.975 -0.518 -1.160 1.00 . A A . 9 ABA HB2 1 1
10 2385 1 1 9 ABA HG1 H 7.390 -3.377 -0.074 1.00 . A A . 9 ABA HG1 1 1
10 2386 1 1 9 ABA HG2 H 8.298 -1.925 0.396 1.00 . A A . 9 ABA HG2 1 1
10 2387 1 1 9 ABA HG3 H 8.447 -2.577 -1.261 1.00 . A A . 9 ABA HG3 1 1
10 2388 1 1 9 ABA N N 5.093 -3.339 -1.638 1.00 . A A . 9 ABA N 1 1
10 2389 1 1 9 ABA O O 5.478 -0.135 -3.418 1.00 . A A . 9 ABA O 1 1
10 2390 1 1 10 ILE C C 1.407 -0.094 -2.739 1.00 . A A . 10 ILE C 1 1
10 2391 1 1 10 ILE CA C 2.650 -0.283 -3.659 1.00 . A A . 10 ILE CA 1 1
10 2392 1 1 10 ILE CB C 2.239 -0.830 -5.077 1.00 . A A . 10 ILE CB 1 1
10 2393 1 1 10 ILE CD1 C 4.325 -0.182 -6.582 1.00 . A A . 10 ILE CD1 1 1
10 2394 1 1 10 ILE CG1 C 3.399 -1.276 -6.021 1.00 . A A . 10 ILE CG1 1 1
10 2395 1 1 10 ILE CG2 C 1.287 0.135 -5.832 1.00 . A A . 10 ILE CG2 1 1
10 2396 1 1 10 ILE H H 3.166 -1.970 -2.343 1.00 . A A . 10 ILE H 1 1
10 2397 1 1 10 ILE HA H 3.156 0.693 -3.812 1.00 . A A . 10 ILE HA 1 1
10 2398 1 1 10 ILE HB H 1.651 -1.746 -4.889 1.00 . A A . 10 ILE HB 1 1
10 2399 1 1 10 ILE HD11 H 4.790 0.420 -5.785 1.00 . A A . 10 ILE HD11 1 1
10 2400 1 1 10 ILE HD12 H 5.144 -0.624 -7.178 1.00 . A A . 10 ILE HD12 1 1
10 2401 1 1 10 ILE HD13 H 3.782 0.515 -7.246 1.00 . A A . 10 ILE HD13 1 1
10 2402 1 1 10 ILE HG12 H 4.020 -2.032 -5.506 1.00 . A A . 10 ILE HG12 1 1
10 2403 1 1 10 ILE HG13 H 2.968 -1.828 -6.878 1.00 . A A . 10 ILE HG13 1 1
10 2404 1 1 10 ILE HG21 H 0.357 0.325 -5.266 1.00 . A A . 10 ILE HG21 1 1
10 2405 1 1 10 ILE HG22 H 1.757 1.120 -6.013 1.00 . A A . 10 ILE HG22 1 1
10 2406 1 1 10 ILE HG23 H 0.978 -0.272 -6.812 1.00 . A A . 10 ILE HG23 1 1
10 2407 1 1 10 ILE N N 3.548 -1.197 -2.901 1.00 . A A . 10 ILE N 1 1
10 2408 1 1 10 ILE O O 0.582 -1.002 -2.591 1.00 . A A . 10 ILE O 1 1
10 2409 1 1 11 GLU C C -0.289 0.669 -0.174 1.00 . A A . 11 GLU C 1 1
10 2410 1 1 11 GLU CA C 0.058 1.574 -1.414 1.00 . A A . 11 GLU CA 1 1
10 2411 1 1 11 GLU CB C -1.090 1.918 -2.429 1.00 . A A . 11 GLU CB 1 1
10 2412 1 1 11 GLU CD C -3.427 2.840 -2.948 1.00 . A A . 11 GLU CD 1 1
10 2413 1 1 11 GLU CG C -2.484 2.293 -1.872 1.00 . A A . 11 GLU CG 1 1
10 2414 1 1 11 GLU H H 2.125 1.678 -2.250 1.00 . A A . 11 GLU H 1 1
10 2415 1 1 11 GLU HA H 0.326 2.555 -0.979 1.00 . A A . 11 GLU HA 1 1
10 2416 1 1 11 GLU HB2 H -0.811 2.774 -3.081 1.00 . A A . 11 GLU HB2 1 1
10 2417 1 1 11 GLU HB3 H -1.171 1.067 -3.123 1.00 . A A . 11 GLU HB3 1 1
10 2418 1 1 11 GLU HE2 H -4.075 4.548 -3.619 1.00 . A A . 11 GLU HE2 1 1
10 2419 1 1 11 GLU HG2 H -2.976 1.415 -1.419 1.00 . A A . 11 GLU HG2 1 1
10 2420 1 1 11 GLU HG3 H -2.378 3.032 -1.054 1.00 . A A . 11 GLU HG3 1 1
10 2421 1 1 11 GLU N N 1.270 1.117 -2.170 1.00 . A A . 11 GLU N 1 1
10 2422 1 1 11 GLU O O -1.429 0.242 -0.006 1.00 . A A . 11 GLU O 1 1
10 2423 1 1 11 GLU OE1 O -4.057 2.122 -3.725 1.00 . A A . 11 GLU OE1 1 1
10 2424 1 1 11 GLU OE2 O -3.483 4.210 -2.943 1.00 . A A . 11 GLU OE2 1 1
10 2425 1 1 12 CYS C C -0.202 0.781 3.118 1.00 . A A . 12 CYS C 1 1
10 2426 1 1 12 CYS CA C 0.461 -0.171 2.072 1.00 . A A . 12 CYS CA 1 1
10 2427 1 1 12 CYS CB C 1.802 -0.665 2.686 1.00 . A A . 12 CYS CB 1 1
10 2428 1 1 12 CYS H H 1.533 0.971 0.518 1.00 . A A . 12 CYS H 1 1
10 2429 1 1 12 CYS HA H -0.197 -1.049 1.954 1.00 . A A . 12 CYS HA 1 1
10 2430 1 1 12 CYS HB2 H 2.542 0.158 2.672 1.00 . A A . 12 CYS HB2 1 1
10 2431 1 1 12 CYS HB3 H 1.693 -0.951 3.749 1.00 . A A . 12 CYS HB3 1 1
10 2432 1 1 12 CYS N N 0.687 0.449 0.730 1.00 . A A . 12 CYS N 1 1
10 2433 1 1 12 CYS O O -0.875 0.284 4.026 1.00 . A A . 12 CYS O 1 1
10 2434 1 1 12 CYS SG S 2.572 -2.046 1.800 1.00 . A A . 12 CYS SG 1 1
10 2435 1 1 13 GLY C C -0.659 4.549 3.550 1.00 . A A . 13 GLY C 1 1
10 2436 1 1 13 GLY CA C -0.509 3.081 4.006 1.00 . A A . 13 GLY CA 1 1
10 2437 1 1 13 GLY H H 0.569 2.367 2.191 1.00 . A A . 13 GLY H 1 1
10 2438 1 1 13 GLY HA2 H -1.494 2.744 4.386 1.00 . A A . 13 GLY HA2 1 1
10 2439 1 1 13 GLY HA3 H 0.157 3.063 4.888 1.00 . A A . 13 GLY HA3 1 1
10 2440 1 1 13 GLY N N 0.003 2.109 3.012 1.00 . A A . 13 GLY N 1 1
10 2441 1 1 13 GLY O O -1.569 5.222 4.043 1.00 . A A . 13 GLY O 1 1
10 2442 1 1 14 ABA C C 1.937 6.988 2.610 1.00 . A A . 14 ABA C 1 1
10 2443 1 1 14 ABA CA C 0.427 6.549 2.504 1.00 . A A . 14 ABA CA 1 1
10 2444 1 1 14 ABA CB C -0.335 7.143 1.259 1.00 . A A . 14 ABA CB 1 1
10 2445 1 1 14 ABA CG C -1.701 6.531 0.892 1.00 . A A . 14 ABA CG 1 1
10 2446 1 1 14 ABA H H 0.936 4.411 2.340 1.00 . A A . 14 ABA H 1 1
10 2447 1 1 14 ABA HA H -0.034 7.056 3.375 1.00 . A A . 14 ABA HA 1 1
10 2448 1 1 14 ABA HB2 H -0.541 8.199 1.517 1.00 . A A . 14 ABA HB2 1 1
10 2449 1 1 14 ABA HG1 H -1.601 5.474 0.579 1.00 . A A . 14 ABA HG1 1 1
10 2450 1 1 14 ABA HG2 H -2.168 7.074 0.052 1.00 . A A . 14 ABA HG2 1 1
10 2451 1 1 14 ABA HG3 H -2.400 6.558 1.746 1.00 . A A . 14 ABA HG3 1 1
10 2452 1 1 14 ABA N N 0.239 5.074 2.690 1.00 . A A . 14 ABA N 1 1
10 2453 1 1 14 ABA O O 2.299 8.050 2.094 1.00 . A A . 14 ABA O 1 1
10 2454 1 1 15 VAL C C 5.208 5.399 3.469 1.00 . A A . 15 VAL C 1 1
10 2455 1 1 15 VAL CA C 4.221 6.609 3.633 1.00 . A A . 15 VAL CA 1 1
10 2456 1 1 15 VAL CB C 4.357 7.333 5.029 1.00 . A A . 15 VAL CB 1 1
10 2457 1 1 15 VAL CG1 C 5.811 7.722 5.399 1.00 . A A . 15 VAL CG1 1 1
10 2458 1 1 15 VAL CG2 C 3.501 8.616 5.170 1.00 . A A . 15 VAL CG2 1 1
10 2459 1 1 15 VAL H H 2.396 5.348 3.670 1.00 . A A . 15 VAL H 1 1
10 2460 1 1 15 VAL HA H 4.550 7.324 2.863 1.00 . A A . 15 VAL HA 1 1
10 2461 1 1 15 VAL HB H 4.006 6.632 5.808 1.00 . A A . 15 VAL HB 1 1
10 2462 1 1 15 VAL HG11 H 6.258 8.409 4.656 1.00 . A A . 15 VAL HG11 1 1
10 2463 1 1 15 VAL HG12 H 5.871 8.219 6.386 1.00 . A A . 15 VAL HG12 1 1
10 2464 1 1 15 VAL HG13 H 6.471 6.838 5.464 1.00 . A A . 15 VAL HG13 1 1
10 2465 1 1 15 VAL HG21 H 3.756 9.371 4.402 1.00 . A A . 15 VAL HG21 1 1
10 2466 1 1 15 VAL HG22 H 2.421 8.403 5.071 1.00 . A A . 15 VAL HG22 1 1
10 2467 1 1 15 VAL HG23 H 3.626 9.095 6.159 1.00 . A A . 15 VAL HG23 1 1
10 2468 1 1 15 VAL N N 2.803 6.229 3.332 1.00 . A A . 15 VAL N 1 1
10 2469 1 1 15 VAL O O 6.286 5.584 2.897 1.00 . A A . 15 VAL O 1 1
10 2470 1 1 16 ILE C C 6.306 2.467 2.835 1.00 . A A . 16 ILE C 1 1
10 2471 1 1 16 ILE CA C 5.854 3.073 4.209 1.00 . A A . 16 ILE CA 1 1
10 2472 1 1 16 ILE CB C 5.279 2.056 5.280 1.00 . A A . 16 ILE CB 1 1
10 2473 1 1 16 ILE CD1 C 4.509 3.746 7.167 1.00 . A A . 16 ILE CD1 1 1
10 2474 1 1 16 ILE CG1 C 5.380 2.548 6.761 1.00 . A A . 16 ILE CG1 1 1
10 2475 1 1 16 ILE CG2 C 5.928 0.644 5.241 1.00 . A A . 16 ILE CG2 1 1
10 2476 1 1 16 ILE H H 3.917 4.163 4.329 1.00 . A A . 16 ILE H 1 1
10 2477 1 1 16 ILE HA H 6.774 3.500 4.656 1.00 . A A . 16 ILE HA 1 1
10 2478 1 1 16 ILE HB H 4.207 1.887 5.062 1.00 . A A . 16 ILE HB 1 1
10 2479 1 1 16 ILE HD11 H 3.452 3.607 6.873 1.00 . A A . 16 ILE HD11 1 1
10 2480 1 1 16 ILE HD12 H 4.529 3.896 8.262 1.00 . A A . 16 ILE HD12 1 1
10 2481 1 1 16 ILE HD13 H 4.869 4.685 6.714 1.00 . A A . 16 ILE HD13 1 1
10 2482 1 1 16 ILE HG12 H 5.093 1.725 7.443 1.00 . A A . 16 ILE HG12 1 1
10 2483 1 1 16 ILE HG13 H 6.434 2.772 7.012 1.00 . A A . 16 ILE HG13 1 1
10 2484 1 1 16 ILE HG21 H 7.019 0.680 5.418 1.00 . A A . 16 ILE HG21 1 1
10 2485 1 1 16 ILE HG22 H 5.493 -0.039 5.995 1.00 . A A . 16 ILE HG22 1 1
10 2486 1 1 16 ILE HG23 H 5.772 0.142 4.268 1.00 . A A . 16 ILE HG23 1 1
10 2487 1 1 16 ILE N N 4.889 4.206 4.014 1.00 . A A . 16 ILE N 1 1
10 2488 1 1 16 ILE O O 7.485 2.567 2.485 1.00 . A A . 16 ILE O 1 1
10 2489 1 1 17 CYS C C 5.467 2.722 -0.303 1.00 . A A . 17 CYS C 1 1
10 2490 1 1 17 CYS CA C 5.598 1.489 0.649 1.00 . A A . 17 CYS CA 1 1
10 2491 1 1 17 CYS CB C 4.654 0.281 0.371 1.00 . A A . 17 CYS CB 1 1
10 2492 1 1 17 CYS H H 4.421 1.965 2.459 1.00 . A A . 17 CYS H 1 1
10 2493 1 1 17 CYS HA H 6.629 1.125 0.498 1.00 . A A . 17 CYS HA 1 1
10 2494 1 1 17 CYS HB2 H 3.765 0.272 1.022 1.00 . A A . 17 CYS HB2 1 1
10 2495 1 1 17 CYS HB3 H 4.209 0.293 -0.631 1.00 . A A . 17 CYS HB3 1 1
10 2496 1 1 17 CYS N N 5.368 1.884 2.068 1.00 . A A . 17 CYS N 1 1
10 2497 1 1 17 CYS O O 5.474 3.879 0.133 1.00 . A A . 17 CYS O 1 1
10 2498 1 1 17 CYS SG S 5.508 -1.299 0.596 1.00 . A A . 17 CYS SG 1 1
10 2499 1 1 18 ALA C C 3.376 3.632 -2.683 1.00 . A A . 18 ALA C 1 1
10 2500 1 1 18 ALA CA C 4.921 3.500 -2.608 1.00 . A A . 18 ALA CA 1 1
10 2501 1 1 18 ALA CB C 5.591 3.220 -3.967 1.00 . A A . 18 ALA CB 1 1
10 2502 1 1 18 ALA H H 5.445 1.468 -1.825 1.00 . A A . 18 ALA H 1 1
10 2503 1 1 18 ALA HA H 5.239 4.522 -2.306 1.00 . A A . 18 ALA HA 1 1
10 2504 1 1 18 ALA HB1 H 6.694 3.183 -3.885 1.00 . A A . 18 ALA HB1 1 1
10 2505 1 1 18 ALA HB2 H 5.257 2.264 -4.407 1.00 . A A . 18 ALA HB2 1 1
10 2506 1 1 18 ALA HB3 H 5.355 4.012 -4.702 1.00 . A A . 18 ALA HB3 1 1
10 2507 1 1 18 ALA N N 5.371 2.471 -1.620 1.00 . A A . 18 ALA N 1 1
10 2508 1 1 18 ALA O O 2.732 3.520 -3.730 1.00 . A A . 18 ALA O 1 1
10 2509 1 1 19 CYS C C 3.408 6.123 -0.478 1.00 . A A . 19 CYS C 1 1
10 2510 1 1 19 CYS CA C 2.392 5.463 -1.426 1.00 . A A . 19 CYS CA 1 1
10 2511 1 1 19 CYS CB C 0.963 5.563 -0.806 1.00 . A A . 19 CYS CB 1 1
10 2512 1 1 19 CYS H H 3.399 3.775 -0.767 1.00 . A A . 19 CYS H 1 1
10 2513 1 1 19 CYS HXT H 4.139 5.972 1.345 1.00 . A A . 19 CYS HXT 1 1
10 2514 1 1 19 CYS HA H 2.548 5.950 -2.413 1.00 . A A . 19 CYS HA 1 1
10 2515 1 1 19 CYS HB2 H 0.110 5.229 -1.443 1.00 . A A . 19 CYS HB2 1 1
10 2516 1 1 19 CYS HB3 H 0.898 4.910 0.083 1.00 . A A . 19 CYS HB3 1 1
10 2517 1 1 19 CYS N N 2.801 4.060 -1.549 1.00 . A A . 19 CYS N 1 1
10 2518 1 1 19 CYS O O 4.096 7.094 -0.793 1.00 . A A . 19 CYS O 1 1
10 2519 1 1 19 CYS OXT O 3.489 5.510 0.810 1.00 . A A . 19 CYS OXT 1 1
10 2520 1 1 19 CYS SG S 0.656 7.263 -0.265 1.00 . A A . 19 CYS SG 1 1
11 2521 1 1 1 DAL C C -6.028 -0.142 1.623 1.00 . A A . 1 DAL C 1 1
11 2522 1 1 1 DAL CA C -5.112 -1.350 1.998 1.00 . A A . 1 DAL CA 1 1
11 2523 1 1 1 DAL CB C -3.599 -1.062 1.890 1.00 . A A . 1 DAL CB 1 1
11 2524 1 1 1 DAL H1 H -5.153 -1.186 4.061 1.00 . A A . 1 DAL H1 1 1
11 2525 1 1 1 DAL H2 H -4.789 -2.692 3.540 1.00 . A A . 1 DAL H2 1 1
11 2526 1 1 1 DAL HA H -5.347 -2.161 1.284 1.00 . A A . 1 DAL HA 1 1
11 2527 1 1 1 DAL HB1 H -3.290 -0.286 2.615 1.00 . A A . 1 DAL HB1 1 1
11 2528 1 1 1 DAL HB2 H -3.369 -0.655 0.893 1.00 . A A . 1 DAL HB2 1 1
11 2529 1 1 1 DAL N N -5.392 -1.885 3.349 1.00 . A A . 1 DAL N 1 1
11 2530 1 1 1 DAL O O -6.902 0.285 2.387 1.00 . A A . 1 DAL O 1 1
11 2531 1 1 2 SER C C -7.772 0.007 -1.195 1.00 . A A . 2 SER C 1 1
11 2532 1 1 2 SER CA C -6.959 1.056 -0.365 1.00 . A A . 2 SER CA 1 1
11 2533 1 1 2 SER CB C -6.303 2.166 -1.218 1.00 . A A . 2 SER CB 1 1
11 2534 1 1 2 SER H H -5.089 -0.065 -0.129 1.00 . A A . 2 SER H 1 1
11 2535 1 1 2 SER HA H -7.636 1.575 0.344 1.00 . A A . 2 SER HA 1 1
11 2536 1 1 2 SER HB2 H -5.688 2.835 -0.587 1.00 . A A . 2 SER HB2 1 1
11 2537 1 1 2 SER HB3 H -5.617 1.741 -1.976 1.00 . A A . 2 SER HB3 1 1
11 2538 1 1 2 SER HG H -6.815 3.616 -2.372 1.00 . A A . 2 SER HG 1 1
11 2539 1 1 2 SER N N -5.883 0.335 0.370 1.00 . A A . 2 SER N 1 1
11 2540 1 1 2 SER O O -7.637 -0.112 -2.418 1.00 . A A . 2 SER O 1 1
11 2541 1 1 2 SER OG O -7.293 2.950 -1.872 1.00 . A A . 2 SER OG 1 1
11 2542 1 1 3 GLY C C -8.110 -3.209 -0.561 1.00 . A A . 3 GLY C 1 1
11 2543 1 1 3 GLY CA C -9.100 -2.085 -0.960 1.00 . A A . 3 GLY CA 1 1
11 2544 1 1 3 GLY H H -8.325 -0.691 0.531 1.00 . A A . 3 GLY H 1 1
11 2545 1 1 3 GLY HA2 H -10.078 -2.257 -0.465 1.00 . A A . 3 GLY HA2 1 1
11 2546 1 1 3 GLY HA3 H -9.333 -2.050 -2.042 1.00 . A A . 3 GLY HA3 1 1
11 2547 1 1 3 GLY N N -8.565 -0.794 -0.463 1.00 . A A . 3 GLY N 1 1
11 2548 1 1 3 GLY O O -7.887 -3.389 0.641 1.00 . A A . 3 GLY O 1 1
11 2549 1 1 4 TRP C C -5.312 -4.416 -2.605 1.00 . A A . 4 TRP C 1 1
11 2550 1 1 4 TRP CA C -6.127 -4.525 -1.283 1.00 . A A . 4 TRP CA 1 1
11 2551 1 1 4 TRP CB C -6.145 -5.976 -0.758 1.00 . A A . 4 TRP CB 1 1
11 2552 1 1 4 TRP CD1 C -5.865 -5.940 1.843 1.00 . A A . 4 TRP CD1 1 1
11 2553 1 1 4 TRP CD2 C -7.878 -6.571 1.130 1.00 . A A . 4 TRP CD2 1 1
11 2554 1 1 4 TRP CE2 C -7.860 -6.553 2.548 1.00 . A A . 4 TRP CE2 1 1
11 2555 1 1 4 TRP CE3 C -9.067 -6.899 0.430 1.00 . A A . 4 TRP CE3 1 1
11 2556 1 1 4 TRP CG C -6.628 -6.183 0.681 1.00 . A A . 4 TRP CG 1 1
11 2557 1 1 4 TRP CH2 C -10.194 -7.196 2.569 1.00 . A A . 4 TRP CH2 1 1
11 2558 1 1 4 TRP CZ2 C -9.035 -6.869 3.276 1.00 . A A . 4 TRP CZ2 1 1
11 2559 1 1 4 TRP CZ3 C -10.209 -7.210 1.168 1.00 . A A . 4 TRP CZ3 1 1
11 2560 1 1 4 TRP H H -7.698 -3.728 -2.505 1.00 . A A . 4 TRP H 1 1
11 2561 1 1 4 TRP HA H -5.602 -3.948 -0.505 1.00 . A A . 4 TRP HA 1 1
11 2562 1 1 4 TRP HB2 H -6.752 -6.524 -1.473 1.00 . A A . 4 TRP HB2 1 1
11 2563 1 1 4 TRP HB3 H -5.136 -6.428 -0.838 1.00 . A A . 4 TRP HB3 1 1
11 2564 1 1 4 TRP HD1 H -4.842 -5.593 1.841 1.00 . A A . 4 TRP HD1 1 1
11 2565 1 1 4 TRP HE1 H -6.300 -6.041 3.984 1.00 . A A . 4 TRP HE1 1 1
11 2566 1 1 4 TRP HE3 H -9.098 -6.899 -0.650 1.00 . A A . 4 TRP HE3 1 1
11 2567 1 1 4 TRP HH2 H -11.096 -7.438 3.112 1.00 . A A . 4 TRP HH2 1 1
11 2568 1 1 4 TRP HZ2 H -9.049 -6.855 4.357 1.00 . A A . 4 TRP HZ2 1 1
11 2569 1 1 4 TRP HZ3 H -11.124 -7.461 0.650 1.00 . A A . 4 TRP HZ3 1 1
11 2570 1 1 4 TRP N N -7.458 -3.903 -1.524 1.00 . A A . 4 TRP N 1 1
11 2571 1 1 4 TRP NE1 N -6.611 -6.166 3.014 1.00 . A A . 4 TRP NE1 1 1
11 2572 1 1 4 TRP O O -5.121 -5.371 -3.367 1.00 . A A . 4 TRP O 1 1
11 2573 1 1 5 VAL C C -2.329 -3.413 -2.737 1.00 . A A . 5 VAL C 1 1
11 2574 1 1 5 VAL CA C -3.539 -2.965 -3.612 1.00 . A A . 5 VAL CA 1 1
11 2575 1 1 5 VAL CB C -3.504 -1.537 -4.276 1.00 . A A . 5 VAL CB 1 1
11 2576 1 1 5 VAL CG1 C -2.241 -1.327 -5.142 1.00 . A A . 5 VAL CG1 1 1
11 2577 1 1 5 VAL CG2 C -4.742 -1.247 -5.159 1.00 . A A . 5 VAL CG2 1 1
11 2578 1 1 5 VAL H H -5.153 -2.578 -2.092 1.00 . A A . 5 VAL H 1 1
11 2579 1 1 5 VAL HA H -3.537 -3.663 -4.452 1.00 . A A . 5 VAL HA 1 1
11 2580 1 1 5 VAL HB H -3.491 -0.748 -3.501 1.00 . A A . 5 VAL HB 1 1
11 2581 1 1 5 VAL HG11 H -1.315 -1.444 -4.550 1.00 . A A . 5 VAL HG11 1 1
11 2582 1 1 5 VAL HG12 H -2.183 -2.049 -5.978 1.00 . A A . 5 VAL HG12 1 1
11 2583 1 1 5 VAL HG13 H -2.204 -0.311 -5.579 1.00 . A A . 5 VAL HG13 1 1
11 2584 1 1 5 VAL HG21 H -4.846 -1.978 -5.983 1.00 . A A . 5 VAL HG21 1 1
11 2585 1 1 5 VAL HG22 H -5.679 -1.280 -4.573 1.00 . A A . 5 VAL HG22 1 1
11 2586 1 1 5 VAL HG23 H -4.697 -0.239 -5.615 1.00 . A A . 5 VAL HG23 1 1
11 2587 1 1 5 VAL N N -4.760 -3.213 -2.785 1.00 . A A . 5 VAL N 1 1
11 2588 1 1 5 VAL O O -1.843 -4.532 -2.916 1.00 . A A . 5 VAL O 1 1
11 2589 1 1 6 CYS C C -0.354 -4.101 -0.317 1.00 . A A . 6 CYS C 1 1
11 2590 1 1 6 CYS CA C -1.496 -3.044 -0.403 1.00 . A A . 6 CYS CA 1 1
11 2591 1 1 6 CYS CB C -2.664 -3.404 0.541 1.00 . A A . 6 CYS CB 1 1
11 2592 1 1 6 CYS H H -2.377 -1.671 -1.849 1.00 . A A . 6 CYS H 1 1
11 2593 1 1 6 CYS HA H -1.157 -2.093 0.037 1.00 . A A . 6 CYS HA 1 1
11 2594 1 1 6 CYS HB2 H -3.639 -3.199 0.078 1.00 . A A . 6 CYS HB2 1 1
11 2595 1 1 6 CYS HB3 H -2.634 -4.480 0.741 1.00 . A A . 6 CYS HB3 1 1
11 2596 1 1 6 CYS N N -1.952 -2.594 -1.744 1.00 . A A . 6 CYS N 1 1
11 2597 1 1 6 CYS O O -0.471 -5.275 -0.680 1.00 . A A . 6 CYS O 1 1
11 2598 1 1 6 CYS SG S -2.592 -2.549 2.139 1.00 . A A . 6 CYS SG 1 1
11 2599 1 1 7 ABA C C 2.937 -4.925 0.449 1.00 . A A . 7 ABA C 1 1
11 2600 1 1 7 ABA CA C 1.616 -4.460 1.145 1.00 . A A . 7 ABA CA 1 1
11 2601 1 1 7 ABA CB C 1.864 -3.548 2.391 1.00 . A A . 7 ABA CB 1 1
11 2602 1 1 7 ABA CG C 0.619 -3.440 3.310 1.00 . A A . 7 ABA CG 1 1
11 2603 1 1 7 ABA H H 0.361 -2.764 0.759 1.00 . A A . 7 ABA H 1 1
11 2604 1 1 7 ABA HA H 1.102 -5.382 1.483 1.00 . A A . 7 ABA HA 1 1
11 2605 1 1 7 ABA HB2 H 2.665 -3.984 3.017 1.00 . A A . 7 ABA HB2 1 1
11 2606 1 1 7 ABA HG1 H 0.815 -2.864 4.228 1.00 . A A . 7 ABA HG1 1 1
11 2607 1 1 7 ABA HG2 H -0.228 -2.957 2.796 1.00 . A A . 7 ABA HG2 1 1
11 2608 1 1 7 ABA HG3 H 0.252 -4.440 3.612 1.00 . A A . 7 ABA HG3 1 1
11 2609 1 1 7 ABA N N 0.696 -3.628 0.327 1.00 . A A . 7 ABA N 1 1
11 2610 1 1 7 ABA O O 3.960 -5.079 1.126 1.00 . A A . 7 ABA O 1 1
11 2611 1 1 8 LEU C C 4.781 -4.399 -2.404 1.00 . A A . 8 LEU C 1 1
11 2612 1 1 8 LEU CA C 4.135 -5.598 -1.648 1.00 . A A . 8 LEU CA 1 1
11 2613 1 1 8 LEU CB C 3.821 -6.859 -2.514 1.00 . A A . 8 LEU CB 1 1
11 2614 1 1 8 LEU CD1 C 2.934 -8.083 -4.561 1.00 . A A . 8 LEU CD1 1 1
11 2615 1 1 8 LEU CD2 C 1.393 -6.458 -3.415 1.00 . A A . 8 LEU CD2 1 1
11 2616 1 1 8 LEU CG C 2.867 -6.773 -3.750 1.00 . A A . 8 LEU CG 1 1
11 2617 1 1 8 LEU H H 2.080 -4.860 -1.358 1.00 . A A . 8 LEU H 1 1
11 2618 1 1 8 LEU HA H 4.932 -5.921 -0.945 1.00 . A A . 8 LEU HA 1 1
11 2619 1 1 8 LEU HB2 H 4.800 -7.232 -2.872 1.00 . A A . 8 LEU HB2 1 1
11 2620 1 1 8 LEU HB3 H 3.466 -7.668 -1.845 1.00 . A A . 8 LEU HB3 1 1
11 2621 1 1 8 LEU HD11 H 3.966 -8.307 -4.890 1.00 . A A . 8 LEU HD11 1 1
11 2622 1 1 8 LEU HD12 H 2.580 -8.954 -3.977 1.00 . A A . 8 LEU HD12 1 1
11 2623 1 1 8 LEU HD13 H 2.318 -8.031 -5.479 1.00 . A A . 8 LEU HD13 1 1
11 2624 1 1 8 LEU HD21 H 0.972 -7.168 -2.679 1.00 . A A . 8 LEU HD21 1 1
11 2625 1 1 8 LEU HD22 H 1.275 -5.441 -2.999 1.00 . A A . 8 LEU HD22 1 1
11 2626 1 1 8 LEU HD23 H 0.748 -6.493 -4.312 1.00 . A A . 8 LEU HD23 1 1
11 2627 1 1 8 LEU HG H 3.226 -5.972 -4.421 1.00 . A A . 8 LEU HG 1 1
11 2628 1 1 8 LEU N N 2.920 -5.198 -0.874 1.00 . A A . 8 LEU N 1 1
11 2629 1 1 8 LEU O O 5.021 -4.434 -3.615 1.00 . A A . 8 LEU O 1 1
11 2630 1 1 9 ABA C C 4.912 -1.102 -2.937 1.00 . A A . 9 ABA C 1 1
11 2631 1 1 9 ABA CA C 5.788 -2.127 -2.144 1.00 . A A . 9 ABA CA 1 1
11 2632 1 1 9 ABA CB C 6.546 -1.478 -0.942 1.00 . A A . 9 ABA CB 1 1
11 2633 1 1 9 ABA CG C 7.738 -2.329 -0.460 1.00 . A A . 9 ABA CG 1 1
11 2634 1 1 9 ABA H H 4.844 -3.441 -0.649 1.00 . A A . 9 ABA H 1 1
11 2635 1 1 9 ABA HA H 6.564 -2.452 -2.867 1.00 . A A . 9 ABA HA 1 1
11 2636 1 1 9 ABA HB2 H 6.953 -0.495 -1.246 1.00 . A A . 9 ABA HB2 1 1
11 2637 1 1 9 ABA HG1 H 7.405 -3.313 -0.076 1.00 . A A . 9 ABA HG1 1 1
11 2638 1 1 9 ABA HG2 H 8.281 -1.831 0.362 1.00 . A A . 9 ABA HG2 1 1
11 2639 1 1 9 ABA HG3 H 8.459 -2.526 -1.274 1.00 . A A . 9 ABA HG3 1 1
11 2640 1 1 9 ABA N N 5.095 -3.340 -1.639 1.00 . A A . 9 ABA N 1 1
11 2641 1 1 9 ABA O O 5.501 -0.186 -3.516 1.00 . A A . 9 ABA O 1 1
11 2642 1 1 10 ILE C C 1.417 -0.155 -2.913 1.00 . A A . 10 ILE C 1 1
11 2643 1 1 10 ILE CA C 2.681 -0.347 -3.803 1.00 . A A . 10 ILE CA 1 1
11 2644 1 1 10 ILE CB C 2.304 -0.916 -5.222 1.00 . A A . 10 ILE CB 1 1
11 2645 1 1 10 ILE CD1 C 4.415 -0.271 -6.696 1.00 . A A . 10 ILE CD1 1 1
11 2646 1 1 10 ILE CG1 C 3.488 -1.365 -6.135 1.00 . A A . 10 ILE CG1 1 1
11 2647 1 1 10 ILE CG2 C 1.361 0.031 -6.012 1.00 . A A . 10 ILE CG2 1 1
11 2648 1 1 10 ILE H H 3.172 -1.993 -2.429 1.00 . A A . 10 ILE H 1 1
11 2649 1 1 10 ILE HA H 3.183 0.631 -3.958 1.00 . A A . 10 ILE HA 1 1
11 2650 1 1 10 ILE HB H 1.719 -1.835 -5.034 1.00 . A A . 10 ILE HB 1 1
11 2651 1 1 10 ILE HD11 H 4.861 0.347 -5.899 1.00 . A A . 10 ILE HD11 1 1
11 2652 1 1 10 ILE HD12 H 5.248 -0.715 -7.270 1.00 . A A . 10 ILE HD12 1 1
11 2653 1 1 10 ILE HD13 H 3.878 0.412 -7.380 1.00 . A A . 10 ILE HD13 1 1
11 2654 1 1 10 ILE HG12 H 4.106 -2.106 -5.596 1.00 . A A . 10 ILE HG12 1 1
11 2655 1 1 10 ILE HG13 H 3.080 -1.934 -6.992 1.00 . A A . 10 ILE HG13 1 1
11 2656 1 1 10 ILE HG21 H 0.417 0.220 -5.469 1.00 . A A . 10 ILE HG21 1 1
11 2657 1 1 10 ILE HG22 H 1.826 1.017 -6.197 1.00 . A A . 10 ILE HG22 1 1
11 2658 1 1 10 ILE HG23 H 1.076 -0.393 -6.992 1.00 . A A . 10 ILE HG23 1 1
11 2659 1 1 10 ILE N N 3.566 -1.243 -3.010 1.00 . A A . 10 ILE N 1 1
11 2660 1 1 10 ILE O O 0.604 -1.073 -2.756 1.00 . A A . 10 ILE O 1 1
11 2661 1 1 11 GLU C C -0.338 0.662 -0.406 1.00 . A A . 11 GLU C 1 1
11 2662 1 1 11 GLU CA C 0.016 1.529 -1.668 1.00 . A A . 11 GLU CA 1 1
11 2663 1 1 11 GLU CB C -1.119 1.816 -2.718 1.00 . A A . 11 GLU CB 1 1
11 2664 1 1 11 GLU CD C -2.671 3.291 -1.255 1.00 . A A . 11 GLU CD 1 1
11 2665 1 1 11 GLU CG C -2.554 2.124 -2.241 1.00 . A A . 11 GLU CG 1 1
11 2666 1 1 11 GLU H H 2.084 1.651 -2.463 1.00 . A A . 11 GLU H 1 1
11 2667 1 1 11 GLU HA H 0.259 2.532 -1.267 1.00 . A A . 11 GLU HA 1 1
11 2668 1 1 11 GLU HB2 H -0.871 2.671 -3.382 1.00 . A A . 11 GLU HB2 1 1
11 2669 1 1 11 GLU HB3 H -1.150 0.953 -3.402 1.00 . A A . 11 GLU HB3 1 1
11 2670 1 1 11 GLU HE2 H -2.790 5.234 -1.270 1.00 . A A . 11 GLU HE2 1 1
11 2671 1 1 11 GLU HG2 H -3.174 2.340 -3.130 1.00 . A A . 11 GLU HG2 1 1
11 2672 1 1 11 GLU HG3 H -3.013 1.221 -1.803 1.00 . A A . 11 GLU HG3 1 1
11 2673 1 1 11 GLU N N 1.247 1.069 -2.383 1.00 . A A . 11 GLU N 1 1
11 2674 1 1 11 GLU O O -1.471 0.214 -0.253 1.00 . A A . 11 GLU O 1 1
11 2675 1 1 11 GLU OE1 O -2.716 3.143 -0.033 1.00 . A A . 11 GLU OE1 1 1
11 2676 1 1 11 GLU OE2 O -2.717 4.505 -1.890 1.00 . A A . 11 GLU OE2 1 1
11 2677 1 1 12 CYS C C -0.355 0.858 2.882 1.00 . A A . 12 CYS C 1 1
11 2678 1 1 12 CYS CA C 0.371 -0.095 1.881 1.00 . A A . 12 CYS CA 1 1
11 2679 1 1 12 CYS CB C 1.713 -0.527 2.538 1.00 . A A . 12 CYS CB 1 1
11 2680 1 1 12 CYS H H 1.450 1.048 0.331 1.00 . A A . 12 CYS H 1 1
11 2681 1 1 12 CYS HA H -0.253 -0.996 1.765 1.00 . A A . 12 CYS HA 1 1
11 2682 1 1 12 CYS HB2 H 2.433 0.309 2.466 1.00 . A A . 12 CYS HB2 1 1
11 2683 1 1 12 CYS HB3 H 1.615 -0.741 3.620 1.00 . A A . 12 CYS HB3 1 1
11 2684 1 1 12 CYS N N 0.617 0.501 0.530 1.00 . A A . 12 CYS N 1 1
11 2685 1 1 12 CYS O O -1.032 0.355 3.784 1.00 . A A . 12 CYS O 1 1
11 2686 1 1 12 CYS SG S 2.515 -1.949 1.750 1.00 . A A . 12 CYS SG 1 1
11 2687 1 1 13 GLY C C -0.889 4.638 3.278 1.00 . A A . 13 GLY C 1 1
11 2688 1 1 13 GLY CA C -0.799 3.155 3.703 1.00 . A A . 13 GLY CA 1 1
11 2689 1 1 13 GLY H H 0.386 2.452 1.945 1.00 . A A . 13 GLY H 1 1
11 2690 1 1 13 GLY HA2 H -1.821 2.822 3.972 1.00 . A A . 13 GLY HA2 1 1
11 2691 1 1 13 GLY HA3 H -0.228 3.109 4.649 1.00 . A A . 13 GLY HA3 1 1
11 2692 1 1 13 GLY N N -0.205 2.190 2.748 1.00 . A A . 13 GLY N 1 1
11 2693 1 1 13 GLY O O -1.819 5.314 3.726 1.00 . A A . 13 GLY O 1 1
11 2694 1 1 14 ABA C C 1.801 7.068 2.583 1.00 . A A . 14 ABA C 1 1
11 2695 1 1 14 ABA CA C 0.299 6.645 2.365 1.00 . A A . 14 ABA CA 1 1
11 2696 1 1 14 ABA CB C -0.361 7.280 1.085 1.00 . A A . 14 ABA CB 1 1
11 2697 1 1 14 ABA CG C -1.744 6.749 0.668 1.00 . A A . 14 ABA CG 1 1
11 2698 1 1 14 ABA H H 0.771 4.501 2.156 1.00 . A A . 14 ABA H 1 1
11 2699 1 1 14 ABA HA H -0.216 7.139 3.213 1.00 . A A . 14 ABA HA 1 1
11 2700 1 1 14 ABA HB2 H -0.517 8.347 1.332 1.00 . A A . 14 ABA HB2 1 1
11 2701 1 1 14 ABA HG1 H -1.691 5.685 0.374 1.00 . A A . 14 ABA HG1 1 1
11 2702 1 1 14 ABA HG2 H -2.145 7.307 -0.196 1.00 . A A . 14 ABA HG2 1 1
11 2703 1 1 14 ABA HG3 H -2.474 6.827 1.493 1.00 . A A . 14 ABA HG3 1 1
11 2704 1 1 14 ABA N N 0.076 5.169 2.499 1.00 . A A . 14 ABA N 1 1
11 2705 1 1 14 ABA O O 2.191 8.159 2.154 1.00 . A A . 14 ABA O 1 1
11 2706 1 1 15 VAL C C 5.030 5.463 3.461 1.00 . A A . 15 VAL C 1 1
11 2707 1 1 15 VAL CA C 4.015 6.628 3.727 1.00 . A A . 15 VAL CA 1 1
11 2708 1 1 15 VAL CB C 4.061 7.156 5.213 1.00 . A A . 15 VAL CB 1 1
11 2709 1 1 15 VAL CG1 C 5.481 7.552 5.691 1.00 . A A . 15 VAL CG1 1 1
11 2710 1 1 15 VAL CG2 C 3.137 8.369 5.487 1.00 . A A . 15 VAL CG2 1 1
11 2711 1 1 15 VAL H H 2.197 5.365 3.566 1.00 . A A . 15 VAL H 1 1
11 2712 1 1 15 VAL HA H 4.368 7.448 3.083 1.00 . A A . 15 VAL HA 1 1
11 2713 1 1 15 VAL HB H 3.719 6.337 5.874 1.00 . A A . 15 VAL HB 1 1
11 2714 1 1 15 VAL HG11 H 5.918 8.357 5.069 1.00 . A A . 15 VAL HG11 1 1
11 2715 1 1 15 VAL HG12 H 5.484 7.906 6.739 1.00 . A A . 15 VAL HG12 1 1
11 2716 1 1 15 VAL HG13 H 6.182 6.698 5.656 1.00 . A A . 15 VAL HG13 1 1
11 2717 1 1 15 VAL HG21 H 3.388 9.234 4.844 1.00 . A A . 15 VAL HG21 1 1
11 2718 1 1 15 VAL HG22 H 2.074 8.127 5.306 1.00 . A A . 15 VAL HG22 1 1
11 2719 1 1 15 VAL HG23 H 3.197 8.711 6.537 1.00 . A A . 15 VAL HG23 1 1
11 2720 1 1 15 VAL N N 2.624 6.261 3.303 1.00 . A A . 15 VAL N 1 1
11 2721 1 1 15 VAL O O 6.101 5.711 2.898 1.00 . A A . 15 VAL O 1 1
11 2722 1 1 16 ILE C C 6.207 2.535 2.735 1.00 . A A . 16 ILE C 1 1
11 2723 1 1 16 ILE CA C 5.735 3.133 4.103 1.00 . A A . 16 ILE CA 1 1
11 2724 1 1 16 ILE CB C 5.180 2.112 5.174 1.00 . A A . 16 ILE CB 1 1
11 2725 1 1 16 ILE CD1 C 6.383 3.112 7.316 1.00 . A A . 16 ILE CD1 1 1
11 2726 1 1 16 ILE CG1 C 5.076 2.691 6.621 1.00 . A A . 16 ILE CG1 1 1
11 2727 1 1 16 ILE CG2 C 5.881 0.729 5.207 1.00 . A A . 16 ILE CG2 1 1
11 2728 1 1 16 ILE H H 3.766 4.159 4.245 1.00 . A A . 16 ILE H 1 1
11 2729 1 1 16 ILE HA H 6.647 3.581 4.544 1.00 . A A . 16 ILE HA 1 1
11 2730 1 1 16 ILE HB H 4.137 1.879 4.894 1.00 . A A . 16 ILE HB 1 1
11 2731 1 1 16 ILE HD11 H 7.098 2.273 7.395 1.00 . A A . 16 ILE HD11 1 1
11 2732 1 1 16 ILE HD12 H 6.890 3.936 6.782 1.00 . A A . 16 ILE HD12 1 1
11 2733 1 1 16 ILE HD13 H 6.186 3.468 8.343 1.00 . A A . 16 ILE HD13 1 1
11 2734 1 1 16 ILE HG12 H 4.395 3.563 6.616 1.00 . A A . 16 ILE HG12 1 1
11 2735 1 1 16 ILE HG13 H 4.561 1.956 7.269 1.00 . A A . 16 ILE HG13 1 1
11 2736 1 1 16 ILE HG21 H 6.962 0.811 5.421 1.00 . A A . 16 ILE HG21 1 1
11 2737 1 1 16 ILE HG22 H 5.438 0.060 5.970 1.00 . A A . 16 ILE HG22 1 1
11 2738 1 1 16 ILE HG23 H 5.777 0.195 4.244 1.00 . A A . 16 ILE HG23 1 1
11 2739 1 1 16 ILE N N 4.737 4.236 3.931 1.00 . A A . 16 ILE N 1 1
11 2740 1 1 16 ILE O O 7.395 2.630 2.412 1.00 . A A . 16 ILE O 1 1
11 2741 1 1 17 CYS C C 5.481 2.754 -0.446 1.00 . A A . 17 CYS C 1 1
11 2742 1 1 17 CYS CA C 5.565 1.539 0.534 1.00 . A A . 17 CYS CA 1 1
11 2743 1 1 17 CYS CB C 4.626 0.328 0.246 1.00 . A A . 17 CYS CB 1 1
11 2744 1 1 17 CYS H H 4.329 2.043 2.299 1.00 . A A . 17 CYS H 1 1
11 2745 1 1 17 CYS HA H 6.597 1.166 0.420 1.00 . A A . 17 CYS HA 1 1
11 2746 1 1 17 CYS HB2 H 3.719 0.329 0.870 1.00 . A A . 17 CYS HB2 1 1
11 2747 1 1 17 CYS HB3 H 4.209 0.328 -0.768 1.00 . A A . 17 CYS HB3 1 1
11 2748 1 1 17 CYS N N 5.288 1.958 1.939 1.00 . A A . 17 CYS N 1 1
11 2749 1 1 17 CYS O O 5.532 3.918 -0.033 1.00 . A A . 17 CYS O 1 1
11 2750 1 1 17 CYS SG S 5.478 -1.245 0.518 1.00 . A A . 17 CYS SG 1 1
11 2751 1 1 18 ALA C C 3.353 3.615 -2.791 1.00 . A A . 18 ALA C 1 1
11 2752 1 1 18 ALA CA C 4.898 3.488 -2.756 1.00 . A A . 18 ALA CA 1 1
11 2753 1 1 18 ALA CB C 5.532 3.177 -4.124 1.00 . A A . 18 ALA CB 1 1
11 2754 1 1 18 ALA H H 5.456 1.476 -1.945 1.00 . A A . 18 ALA H 1 1
11 2755 1 1 18 ALA HA H 5.214 4.520 -2.488 1.00 . A A . 18 ALA HA 1 1
11 2756 1 1 18 ALA HB1 H 6.637 3.147 -4.072 1.00 . A A . 18 ALA HB1 1 1
11 2757 1 1 18 ALA HB2 H 5.192 2.208 -4.531 1.00 . A A . 18 ALA HB2 1 1
11 2758 1 1 18 ALA HB3 H 5.272 3.949 -4.873 1.00 . A A . 18 ALA HB3 1 1
11 2759 1 1 18 ALA N N 5.374 2.481 -1.757 1.00 . A A . 18 ALA N 1 1
11 2760 1 1 18 ALA O O 2.680 3.467 -3.815 1.00 . A A . 18 ALA O 1 1
11 2761 1 1 19 CYS C C 3.462 6.295 -0.824 1.00 . A A . 19 CYS C 1 1
11 2762 1 1 19 CYS CA C 2.391 5.507 -1.606 1.00 . A A . 19 CYS CA 1 1
11 2763 1 1 19 CYS CB C 0.999 5.622 -0.900 1.00 . A A . 19 CYS CB 1 1
11 2764 1 1 19 CYS H H 3.452 3.859 -0.889 1.00 . A A . 19 CYS H 1 1
11 2765 1 1 19 CYS HXT H 4.736 7.778 -1.065 1.00 . A A . 19 CYS HXT 1 1
11 2766 1 1 19 CYS HA H 2.468 5.913 -2.637 1.00 . A A . 19 CYS HA 1 1
11 2767 1 1 19 CYS HB2 H 0.114 5.249 -1.471 1.00 . A A . 19 CYS HB2 1 1
11 2768 1 1 19 CYS HB3 H 0.996 5.007 0.017 1.00 . A A . 19 CYS HB3 1 1
11 2769 1 1 19 CYS N N 2.819 4.102 -1.659 1.00 . A A . 19 CYS N 1 1
11 2770 1 1 19 CYS O O 3.772 6.081 0.348 1.00 . A A . 19 CYS O 1 1
11 2771 1 1 19 CYS OXT O 4.081 7.323 -1.600 1.00 . A A . 19 CYS OXT 1 1
11 2772 1 1 19 CYS SG S 0.703 7.337 -0.394 1.00 . A A . 19 CYS SG 1 1
12 2773 1 1 1 DAL C C -6.083 -0.077 1.787 1.00 . A A . 1 DAL C 1 1
12 2774 1 1 1 DAL CA C -5.120 -1.265 2.103 1.00 . A A . 1 DAL CA 1 1
12 2775 1 1 1 DAL CB C -3.621 -0.946 1.915 1.00 . A A . 1 DAL CB 1 1
12 2776 1 1 1 DAL H1 H -6.298 -2.069 3.603 1.00 . A A . 1 DAL H1 1 1
12 2777 1 1 1 DAL H2 H -5.115 -1.092 4.165 1.00 . A A . 1 DAL H2 1 1
12 2778 1 1 1 DAL HA H -5.377 -2.077 1.397 1.00 . A A . 1 DAL HA 1 1
12 2779 1 1 1 DAL HB1 H -3.277 -0.188 2.643 1.00 . A A . 1 DAL HB1 1 1
12 2780 1 1 1 DAL HB2 H -3.451 -0.510 0.918 1.00 . A A . 1 DAL HB2 1 1
12 2781 1 1 1 DAL N N -5.314 -1.813 3.464 1.00 . A A . 1 DAL N 1 1
12 2782 1 1 1 DAL O O -6.930 0.318 2.597 1.00 . A A . 1 DAL O 1 1
12 2783 1 1 2 SER C C -7.933 0.086 -0.983 1.00 . A A . 2 SER C 1 1
12 2784 1 1 2 SER CA C -7.133 1.129 -0.136 1.00 . A A . 2 SER CA 1 1
12 2785 1 1 2 SER CB C -6.573 2.294 -0.985 1.00 . A A . 2 SER CB 1 1
12 2786 1 1 2 SER H H -5.224 0.049 -0.004 1.00 . A A . 2 SER H 1 1
12 2787 1 1 2 SER HA H -7.812 1.591 0.610 1.00 . A A . 2 SER HA 1 1
12 2788 1 1 2 SER HB2 H -5.867 1.923 -1.750 1.00 . A A . 2 SER HB2 1 1
12 2789 1 1 2 SER HB3 H -7.391 2.788 -1.542 1.00 . A A . 2 SER HB3 1 1
12 2790 1 1 2 SER HG H -6.591 3.587 0.440 1.00 . A A . 2 SER HG 1 1
12 2791 1 1 2 SER N N -6.008 0.416 0.535 1.00 . A A . 2 SER N 1 1
12 2792 1 1 2 SER O O -7.839 0.026 -2.215 1.00 . A A . 2 SER O 1 1
12 2793 1 1 2 SER OG O -5.925 3.269 -0.174 1.00 . A A . 2 SER OG 1 1
12 2794 1 1 3 GLY C C -8.104 -3.163 -0.549 1.00 . A A . 3 GLY C 1 1
12 2795 1 1 3 GLY CA C -9.168 -2.067 -0.809 1.00 . A A . 3 GLY CA 1 1
12 2796 1 1 3 GLY H H -8.407 -0.711 0.728 1.00 . A A . 3 GLY H 1 1
12 2797 1 1 3 GLY HA2 H -10.103 -2.322 -0.268 1.00 . A A . 3 GLY HA2 1 1
12 2798 1 1 3 GLY HA3 H -9.474 -1.977 -1.870 1.00 . A A . 3 GLY HA3 1 1
12 2799 1 1 3 GLY N N -8.667 -0.782 -0.264 1.00 . A A . 3 GLY N 1 1
12 2800 1 1 3 GLY O O -7.810 -3.422 0.622 1.00 . A A . 3 GLY O 1 1
12 2801 1 1 4 TRP C C -5.361 -4.115 -2.799 1.00 . A A . 4 TRP C 1 1
12 2802 1 1 4 TRP CA C -6.124 -4.361 -1.464 1.00 . A A . 4 TRP CA 1 1
12 2803 1 1 4 TRP CB C -6.101 -5.854 -1.076 1.00 . A A . 4 TRP CB 1 1
12 2804 1 1 4 TRP CD1 C -5.734 -6.072 1.506 1.00 . A A . 4 TRP CD1 1 1
12 2805 1 1 4 TRP CD2 C -7.767 -6.644 0.801 1.00 . A A . 4 TRP CD2 1 1
12 2806 1 1 4 TRP CE2 C -7.701 -6.767 2.213 1.00 . A A . 4 TRP CE2 1 1
12 2807 1 1 4 TRP CE3 C -8.978 -6.912 0.112 1.00 . A A . 4 TRP CE3 1 1
12 2808 1 1 4 TRP CG C -6.535 -6.204 0.352 1.00 . A A . 4 TRP CG 1 1
12 2809 1 1 4 TRP CH2 C -10.030 -7.428 2.247 1.00 . A A . 4 TRP CH2 1 1
12 2810 1 1 4 TRP CZ2 C -8.850 -7.163 2.944 1.00 . A A . 4 TRP CZ2 1 1
12 2811 1 1 4 TRP CZ3 C -10.093 -7.303 0.854 1.00 . A A . 4 TRP CZ3 1 1
12 2812 1 1 4 TRP H H -7.758 -3.488 -2.546 1.00 . A A . 4 TRP H 1 1
12 2813 1 1 4 TRP HA H -5.579 -3.848 -0.656 1.00 . A A . 4 TRP HA 1 1
12 2814 1 1 4 TRP HB2 H -6.724 -6.346 -1.817 1.00 . A A . 4 TRP HB2 1 1
12 2815 1 1 4 TRP HB3 H -5.088 -6.278 -1.229 1.00 . A A . 4 TRP HB3 1 1
12 2816 1 1 4 TRP HD1 H -4.712 -5.720 1.504 1.00 . A A . 4 TRP HD1 1 1
12 2817 1 1 4 TRP HE1 H -6.095 -6.390 3.640 1.00 . A A . 4 TRP HE1 1 1
12 2818 1 1 4 TRP HE3 H -9.044 -6.805 -0.961 1.00 . A A . 4 TRP HE3 1 1
12 2819 1 1 4 TRP HH2 H -10.912 -7.730 2.793 1.00 . A A . 4 TRP HH2 1 1
12 2820 1 1 4 TRP HZ2 H -8.826 -7.257 4.021 1.00 . A A . 4 TRP HZ2 1 1
12 2821 1 1 4 TRP HZ3 H -11.023 -7.509 0.344 1.00 . A A . 4 TRP HZ3 1 1
12 2822 1 1 4 TRP N N -7.475 -3.748 -1.597 1.00 . A A . 4 TRP N 1 1
12 2823 1 1 4 TRP NE1 N -6.439 -6.419 2.673 1.00 . A A . 4 TRP NE1 1 1
12 2824 1 1 4 TRP O O -5.174 -4.994 -3.648 1.00 . A A . 4 TRP O 1 1
12 2825 1 1 5 VAL C C -2.407 -3.028 -2.875 1.00 . A A . 5 VAL C 1 1
12 2826 1 1 5 VAL CA C -3.635 -2.546 -3.706 1.00 . A A . 5 VAL CA 1 1
12 2827 1 1 5 VAL CB C -3.641 -1.073 -4.264 1.00 . A A . 5 VAL CB 1 1
12 2828 1 1 5 VAL CG1 C -2.390 -0.762 -5.118 1.00 . A A . 5 VAL CG1 1 1
12 2829 1 1 5 VAL CG2 C -4.893 -0.756 -5.118 1.00 . A A . 5 VAL CG2 1 1
12 2830 1 1 5 VAL H H -5.215 -2.330 -2.124 1.00 . A A . 5 VAL H 1 1
12 2831 1 1 5 VAL HA H -3.622 -3.180 -4.595 1.00 . A A . 5 VAL HA 1 1
12 2832 1 1 5 VAL HB H -3.645 -0.343 -3.432 1.00 . A A . 5 VAL HB 1 1
12 2833 1 1 5 VAL HG11 H -1.457 -0.897 -4.543 1.00 . A A . 5 VAL HG11 1 1
12 2834 1 1 5 VAL HG12 H -2.319 -1.417 -6.007 1.00 . A A . 5 VAL HG12 1 1
12 2835 1 1 5 VAL HG13 H -2.385 0.284 -5.476 1.00 . A A . 5 VAL HG13 1 1
12 2836 1 1 5 VAL HG21 H -4.984 -1.433 -5.989 1.00 . A A . 5 VAL HG21 1 1
12 2837 1 1 5 VAL HG22 H -5.824 -0.853 -4.530 1.00 . A A . 5 VAL HG22 1 1
12 2838 1 1 5 VAL HG23 H -4.878 0.280 -5.506 1.00 . A A . 5 VAL HG23 1 1
12 2839 1 1 5 VAL N N -4.842 -2.886 -2.890 1.00 . A A . 5 VAL N 1 1
12 2840 1 1 5 VAL O O -1.889 -4.113 -3.149 1.00 . A A . 5 VAL O 1 1
12 2841 1 1 6 CYS C C -0.450 -3.916 -0.515 1.00 . A A . 6 CYS C 1 1
12 2842 1 1 6 CYS CA C -1.563 -2.822 -0.522 1.00 . A A . 6 CYS CA 1 1
12 2843 1 1 6 CYS CB C -2.717 -3.211 0.431 1.00 . A A . 6 CYS CB 1 1
12 2844 1 1 6 CYS H H -2.480 -1.356 -1.860 1.00 . A A . 6 CYS H 1 1
12 2845 1 1 6 CYS HA H -1.187 -1.902 -0.045 1.00 . A A . 6 CYS HA 1 1
12 2846 1 1 6 CYS HB2 H -3.701 -2.970 0.008 1.00 . A A . 6 CYS HB2 1 1
12 2847 1 1 6 CYS HB3 H -2.707 -4.296 0.577 1.00 . A A . 6 CYS HB3 1 1
12 2848 1 1 6 CYS N N -2.049 -2.283 -1.820 1.00 . A A . 6 CYS N 1 1
12 2849 1 1 6 CYS O O -0.607 -5.065 -0.938 1.00 . A A . 6 CYS O 1 1
12 2850 1 1 6 CYS SG S -2.592 -2.431 2.063 1.00 . A A . 6 CYS SG 1 1
12 2851 1 1 7 ABA C C 2.808 -4.931 0.234 1.00 . A A . 7 ABA C 1 1
12 2852 1 1 7 ABA CA C 1.507 -4.410 0.927 1.00 . A A . 7 ABA CA 1 1
12 2853 1 1 7 ABA CB C 1.806 -3.541 2.195 1.00 . A A . 7 ABA CB 1 1
12 2854 1 1 7 ABA CG C 0.584 -3.445 3.144 1.00 . A A . 7 ABA CG 1 1
12 2855 1 1 7 ABA H H 0.326 -2.653 0.606 1.00 . A A . 7 ABA H 1 1
12 2856 1 1 7 ABA HA H 0.948 -5.313 1.245 1.00 . A A . 7 ABA HA 1 1
12 2857 1 1 7 ABA HB2 H 2.613 -4.006 2.792 1.00 . A A . 7 ABA HB2 1 1
12 2858 1 1 7 ABA HG1 H 0.810 -2.906 4.077 1.00 . A A . 7 ABA HG1 1 1
12 2859 1 1 7 ABA HG2 H -0.261 -2.928 2.664 1.00 . A A . 7 ABA HG2 1 1
12 2860 1 1 7 ABA HG3 H 0.205 -4.448 3.419 1.00 . A A . 7 ABA HG3 1 1
12 2861 1 1 7 ABA N N 0.623 -3.512 0.138 1.00 . A A . 7 ABA N 1 1
12 2862 1 1 7 ABA O O 3.762 -5.276 0.941 1.00 . A A . 7 ABA O 1 1
12 2863 1 1 8 LEU C C 4.627 -4.180 -2.646 1.00 . A A . 8 LEU C 1 1
12 2864 1 1 8 LEU CA C 4.108 -5.409 -1.847 1.00 . A A . 8 LEU CA 1 1
12 2865 1 1 8 LEU CB C 3.907 -6.685 -2.723 1.00 . A A . 8 LEU CB 1 1
12 2866 1 1 8 LEU CD1 C 3.179 -9.109 -3.013 1.00 . A A . 8 LEU CD1 1 1
12 2867 1 1 8 LEU CD2 C 4.629 -8.508 -1.034 1.00 . A A . 8 LEU CD2 1 1
12 2868 1 1 8 LEU CG C 3.528 -8.007 -1.993 1.00 . A A . 8 LEU CG 1 1
12 2869 1 1 8 LEU H H 2.053 -4.608 -1.585 1.00 . A A . 8 LEU H 1 1
12 2870 1 1 8 LEU HA H 4.931 -5.644 -1.139 1.00 . A A . 8 LEU HA 1 1
12 2871 1 1 8 LEU HB2 H 3.142 -6.467 -3.494 1.00 . A A . 8 LEU HB2 1 1
12 2872 1 1 8 LEU HB3 H 4.833 -6.868 -3.305 1.00 . A A . 8 LEU HB3 1 1
12 2873 1 1 8 LEU HD11 H 2.348 -8.802 -3.675 1.00 . A A . 8 LEU HD11 1 1
12 2874 1 1 8 LEU HD12 H 4.038 -9.364 -3.662 1.00 . A A . 8 LEU HD12 1 1
12 2875 1 1 8 LEU HD13 H 2.856 -10.041 -2.513 1.00 . A A . 8 LEU HD13 1 1
12 2876 1 1 8 LEU HD21 H 5.584 -8.695 -1.559 1.00 . A A . 8 LEU HD21 1 1
12 2877 1 1 8 LEU HD22 H 4.833 -7.780 -0.228 1.00 . A A . 8 LEU HD22 1 1
12 2878 1 1 8 LEU HD23 H 4.338 -9.452 -0.536 1.00 . A A . 8 LEU HD23 1 1
12 2879 1 1 8 LEU HG H 2.617 -7.826 -1.393 1.00 . A A . 8 LEU HG 1 1
12 2880 1 1 8 LEU N N 2.854 -5.044 -1.112 1.00 . A A . 8 LEU N 1 1
12 2881 1 1 8 LEU O O 4.695 -4.176 -3.880 1.00 . A A . 8 LEU O 1 1
12 2882 1 1 9 ABA C C 4.788 -0.877 -3.160 1.00 . A A . 9 ABA C 1 1
12 2883 1 1 9 ABA CA C 5.689 -1.926 -2.431 1.00 . A A . 9 ABA CA 1 1
12 2884 1 1 9 ABA CB C 6.524 -1.290 -1.273 1.00 . A A . 9 ABA CB 1 1
12 2885 1 1 9 ABA CG C 7.783 -2.109 -0.930 1.00 . A A . 9 ABA CG 1 1
12 2886 1 1 9 ABA H H 4.857 -3.258 -0.887 1.00 . A A . 9 ABA H 1 1
12 2887 1 1 9 ABA HA H 6.412 -2.258 -3.203 1.00 . A A . 9 ABA HA 1 1
12 2888 1 1 9 ABA HB2 H 6.868 -0.281 -1.567 1.00 . A A . 9 ABA HB2 1 1
12 2889 1 1 9 ABA HG1 H 7.522 -3.125 -0.574 1.00 . A A . 9 ABA HG1 1 1
12 2890 1 1 9 ABA HG2 H 8.367 -1.627 -0.128 1.00 . A A . 9 ABA HG2 1 1
12 2891 1 1 9 ABA HG3 H 8.446 -2.229 -1.805 1.00 . A A . 9 ABA HG3 1 1
12 2892 1 1 9 ABA N N 5.013 -3.135 -1.893 1.00 . A A . 9 ABA N 1 1
12 2893 1 1 9 ABA O O 5.356 -0.022 -3.845 1.00 . A A . 9 ABA O 1 1
12 2894 1 1 10 ILE C C 1.292 0.172 -2.900 1.00 . A A . 10 ILE C 1 1
12 2895 1 1 10 ILE CA C 2.536 -0.021 -3.822 1.00 . A A . 10 ILE CA 1 1
12 2896 1 1 10 ILE CB C 2.110 -0.547 -5.257 1.00 . A A . 10 ILE CB 1 1
12 2897 1 1 10 ILE CD1 C 2.621 -2.002 -7.390 1.00 . A A . 10 ILE CD1 1 1
12 2898 1 1 10 ILE CG1 C 3.169 -1.317 -6.126 1.00 . A A . 10 ILE CG1 1 1
12 2899 1 1 10 ILE CG2 C 1.497 0.631 -6.060 1.00 . A A . 10 ILE CG2 1 1
12 2900 1 1 10 ILE H H 3.066 -1.692 -2.490 1.00 . A A . 10 ILE H 1 1
12 2901 1 1 10 ILE HA H 3.032 0.977 -3.909 1.00 . A A . 10 ILE HA 1 1
12 2902 1 1 10 ILE HB H 1.302 -1.287 -5.097 1.00 . A A . 10 ILE HB 1 1
12 2903 1 1 10 ILE HD11 H 1.785 -2.686 -7.155 1.00 . A A . 10 ILE HD11 1 1
12 2904 1 1 10 ILE HD12 H 2.260 -1.273 -8.137 1.00 . A A . 10 ILE HD12 1 1
12 2905 1 1 10 ILE HD13 H 3.406 -2.604 -7.885 1.00 . A A . 10 ILE HD13 1 1
12 2906 1 1 10 ILE HG12 H 4.015 -0.670 -6.421 1.00 . A A . 10 ILE HG12 1 1
12 2907 1 1 10 ILE HG13 H 3.629 -2.136 -5.538 1.00 . A A . 10 ILE HG13 1 1
12 2908 1 1 10 ILE HG21 H 0.696 1.145 -5.496 1.00 . A A . 10 ILE HG21 1 1
12 2909 1 1 10 ILE HG22 H 2.256 1.395 -6.313 1.00 . A A . 10 ILE HG22 1 1
12 2910 1 1 10 ILE HG23 H 1.034 0.300 -7.006 1.00 . A A . 10 ILE HG23 1 1
12 2911 1 1 10 ILE N N 3.438 -0.938 -3.077 1.00 . A A . 10 ILE N 1 1
12 2912 1 1 10 ILE O O 0.459 -0.731 -2.768 1.00 . A A . 10 ILE O 1 1
12 2913 1 1 11 GLU C C -0.383 0.880 -0.307 1.00 . A A . 11 GLU C 1 1
12 2914 1 1 11 GLU CA C -0.040 1.816 -1.523 1.00 . A A . 11 GLU CA 1 1
12 2915 1 1 11 GLU CB C -1.190 2.191 -2.525 1.00 . A A . 11 GLU CB 1 1
12 2916 1 1 11 GLU CD C -3.525 3.134 -3.011 1.00 . A A . 11 GLU CD 1 1
12 2917 1 1 11 GLU CG C -2.582 2.552 -1.953 1.00 . A A . 11 GLU CG 1 1
12 2918 1 1 11 GLU H H 2.022 1.935 -2.345 1.00 . A A . 11 GLU H 1 1
12 2919 1 1 11 GLU HA H 0.236 2.786 -1.067 1.00 . A A . 11 GLU HA 1 1
12 2920 1 1 11 GLU HB2 H -0.911 3.063 -3.154 1.00 . A A . 11 GLU HB2 1 1
12 2921 1 1 11 GLU HB3 H -1.275 1.359 -3.242 1.00 . A A . 11 GLU HB3 1 1
12 2922 1 1 11 GLU HE2 H -4.192 4.861 -3.610 1.00 . A A . 11 GLU HE2 1 1
12 2923 1 1 11 GLU HG2 H -3.074 1.661 -1.525 1.00 . A A . 11 GLU HG2 1 1
12 2924 1 1 11 GLU HG3 H -2.471 3.266 -1.114 1.00 . A A . 11 GLU HG3 1 1
12 2925 1 1 11 GLU N N 1.165 1.372 -2.297 1.00 . A A . 11 GLU N 1 1
12 2926 1 1 11 GLU O O -1.521 0.444 -0.148 1.00 . A A . 11 GLU O 1 1
12 2927 1 1 11 GLU OE1 O -4.140 2.443 -3.823 1.00 . A A . 11 GLU OE1 1 1
12 2928 1 1 11 GLU OE2 O -3.600 4.501 -2.945 1.00 . A A . 11 GLU OE2 1 1
12 2929 1 1 12 CYS C C -0.281 0.891 2.986 1.00 . A A . 12 CYS C 1 1
12 2930 1 1 12 CYS CA C 0.381 -0.026 1.909 1.00 . A A . 12 CYS CA 1 1
12 2931 1 1 12 CYS CB C 1.733 -0.531 2.491 1.00 . A A . 12 CYS CB 1 1
12 2932 1 1 12 CYS H H 1.441 1.169 0.394 1.00 . A A . 12 CYS H 1 1
12 2933 1 1 12 CYS HA H -0.275 -0.902 1.766 1.00 . A A . 12 CYS HA 1 1
12 2934 1 1 12 CYS HB2 H 2.479 0.285 2.444 1.00 . A A . 12 CYS HB2 1 1
12 2935 1 1 12 CYS HB3 H 1.661 -0.805 3.561 1.00 . A A . 12 CYS HB3 1 1
12 2936 1 1 12 CYS N N 0.597 0.637 0.587 1.00 . A A . 12 CYS N 1 1
12 2937 1 1 12 CYS O O -0.960 0.364 3.872 1.00 . A A . 12 CYS O 1 1
12 2938 1 1 12 CYS SG S 2.467 -1.928 1.597 1.00 . A A . 12 CYS SG 1 1
12 2939 1 1 13 GLY C C -0.685 4.650 3.579 1.00 . A A . 13 GLY C 1 1
12 2940 1 1 13 GLY CA C -0.580 3.156 3.961 1.00 . A A . 13 GLY CA 1 1
12 2941 1 1 13 GLY H H 0.494 2.510 2.118 1.00 . A A . 13 GLY H 1 1
12 2942 1 1 13 GLY HA2 H -1.580 2.824 4.303 1.00 . A A . 13 GLY HA2 1 1
12 2943 1 1 13 GLY HA3 H 0.067 3.077 4.855 1.00 . A A . 13 GLY HA3 1 1
12 2944 1 1 13 GLY N N -0.070 2.222 2.930 1.00 . A A . 13 GLY N 1 1
12 2945 1 1 13 GLY O O -1.596 5.315 4.081 1.00 . A A . 13 GLY O 1 1
12 2946 1 1 14 ABA C C 1.980 7.091 2.861 1.00 . A A . 14 ABA C 1 1
12 2947 1 1 14 ABA CA C 0.472 6.678 2.672 1.00 . A A . 14 ABA CA 1 1
12 2948 1 1 14 ABA CB C -0.223 7.344 1.426 1.00 . A A . 14 ABA CB 1 1
12 2949 1 1 14 ABA CG C -1.610 6.812 1.016 1.00 . A A . 14 ABA CG 1 1
12 2950 1 1 14 ABA H H 0.935 4.539 2.398 1.00 . A A . 14 ABA H 1 1
12 2951 1 1 14 ABA HA H -0.020 7.151 3.546 1.00 . A A . 14 ABA HA 1 1
12 2952 1 1 14 ABA HB2 H -0.387 8.400 1.713 1.00 . A A . 14 ABA HB2 1 1
12 2953 1 1 14 ABA HG1 H -1.556 5.763 0.670 1.00 . A A . 14 ABA HG1 1 1
12 2954 1 1 14 ABA HG2 H -2.038 7.407 0.191 1.00 . A A . 14 ABA HG2 1 1
12 2955 1 1 14 ABA HG3 H -2.321 6.844 1.861 1.00 . A A . 14 ABA HG3 1 1
12 2956 1 1 14 ABA N N 0.249 5.199 2.775 1.00 . A A . 14 ABA N 1 1
12 2957 1 1 14 ABA O O 2.365 8.189 2.446 1.00 . A A . 14 ABA O 1 1
12 2958 1 1 15 VAL C C 5.224 5.443 3.595 1.00 . A A . 15 VAL C 1 1
12 2959 1 1 15 VAL CA C 4.226 6.608 3.924 1.00 . A A . 15 VAL CA 1 1
12 2960 1 1 15 VAL CB C 4.330 7.096 5.421 1.00 . A A . 15 VAL CB 1 1
12 2961 1 1 15 VAL CG1 C 5.768 7.479 5.854 1.00 . A A . 15 VAL CG1 1 1
12 2962 1 1 15 VAL CG2 C 3.420 8.304 5.762 1.00 . A A . 15 VAL CG2 1 1
12 2963 1 1 15 VAL H H 2.392 5.367 3.798 1.00 . A A . 15 VAL H 1 1
12 2964 1 1 15 VAL HA H 4.563 7.441 3.288 1.00 . A A . 15 VAL HA 1 1
12 2965 1 1 15 VAL HB H 4.012 6.260 6.073 1.00 . A A . 15 VAL HB 1 1
12 2966 1 1 15 VAL HG11 H 6.182 8.300 5.238 1.00 . A A . 15 VAL HG11 1 1
12 2967 1 1 15 VAL HG12 H 5.811 7.805 6.911 1.00 . A A . 15 VAL HG12 1 1
12 2968 1 1 15 VAL HG13 H 6.465 6.626 5.770 1.00 . A A . 15 VAL HG13 1 1
12 2969 1 1 15 VAL HG21 H 3.649 9.185 5.134 1.00 . A A . 15 VAL HG21 1 1
12 2970 1 1 15 VAL HG22 H 2.351 8.067 5.616 1.00 . A A . 15 VAL HG22 1 1
12 2971 1 1 15 VAL HG23 H 3.521 8.616 6.819 1.00 . A A . 15 VAL HG23 1 1
12 2972 1 1 15 VAL N N 2.817 6.266 3.543 1.00 . A A . 15 VAL N 1 1
12 2973 1 1 15 VAL O O 6.297 5.706 3.045 1.00 . A A . 15 VAL O 1 1
12 2974 1 1 16 ILE C C 6.325 2.548 2.665 1.00 . A A . 16 ILE C 1 1
12 2975 1 1 16 ILE CA C 5.891 3.061 4.080 1.00 . A A . 16 ILE CA 1 1
12 2976 1 1 16 ILE CB C 5.328 1.987 5.095 1.00 . A A . 16 ILE CB 1 1
12 2977 1 1 16 ILE CD1 C 4.493 1.750 7.575 1.00 . A A . 16 ILE CD1 1 1
12 2978 1 1 16 ILE CG1 C 5.384 2.501 6.570 1.00 . A A . 16 ILE CG1 1 1
12 2979 1 1 16 ILE CG2 C 6.002 0.590 5.001 1.00 . A A . 16 ILE CG2 1 1
12 2980 1 1 16 ILE H H 3.942 4.111 4.303 1.00 . A A . 16 ILE H 1 1
12 2981 1 1 16 ILE HA H 6.818 3.461 4.540 1.00 . A A . 16 ILE HA 1 1
12 2982 1 1 16 ILE HB H 4.262 1.821 4.851 1.00 . A A . 16 ILE HB 1 1
12 2983 1 1 16 ILE HD11 H 3.433 1.752 7.261 1.00 . A A . 16 ILE HD11 1 1
12 2984 1 1 16 ILE HD12 H 4.803 0.697 7.703 1.00 . A A . 16 ILE HD12 1 1
12 2985 1 1 16 ILE HD13 H 4.539 2.223 8.573 1.00 . A A . 16 ILE HD13 1 1
12 2986 1 1 16 ILE HG12 H 6.429 2.502 6.934 1.00 . A A . 16 ILE HG12 1 1
12 2987 1 1 16 ILE HG13 H 5.074 3.562 6.611 1.00 . A A . 16 ILE HG13 1 1
12 2988 1 1 16 ILE HG21 H 5.881 0.142 3.998 1.00 . A A . 16 ILE HG21 1 1
12 2989 1 1 16 ILE HG22 H 7.086 0.634 5.213 1.00 . A A . 16 ILE HG22 1 1
12 2990 1 1 16 ILE HG23 H 5.555 -0.139 5.701 1.00 . A A . 16 ILE HG23 1 1
12 2991 1 1 16 ILE N N 4.912 4.194 3.990 1.00 . A A . 16 ILE N 1 1
12 2992 1 1 16 ILE O O 7.505 2.653 2.318 1.00 . A A . 16 ILE O 1 1
12 2993 1 1 17 CYS C C 5.551 2.841 -0.509 1.00 . A A . 17 CYS C 1 1
12 2994 1 1 17 CYS CA C 5.628 1.612 0.451 1.00 . A A . 17 CYS CA 1 1
12 2995 1 1 17 CYS CB C 4.679 0.404 0.174 1.00 . A A . 17 CYS CB 1 1
12 2996 1 1 17 CYS H H 4.433 2.078 2.257 1.00 . A A . 17 CYS H 1 1
12 2997 1 1 17 CYS HA H 6.652 1.232 0.309 1.00 . A A . 17 CYS HA 1 1
12 2998 1 1 17 CYS HB2 H 3.837 0.340 0.883 1.00 . A A . 17 CYS HB2 1 1
12 2999 1 1 17 CYS HB3 H 4.171 0.456 -0.798 1.00 . A A . 17 CYS HB3 1 1
12 3000 1 1 17 CYS N N 5.381 2.018 1.866 1.00 . A A . 17 CYS N 1 1
12 3001 1 1 17 CYS O O 5.697 3.994 -0.089 1.00 . A A . 17 CYS O 1 1
12 3002 1 1 17 CYS SG S 5.578 -1.162 0.280 1.00 . A A . 17 CYS SG 1 1
12 3003 1 1 18 ALA C C 3.328 3.844 -2.721 1.00 . A A . 18 ALA C 1 1
12 3004 1 1 18 ALA CA C 4.865 3.642 -2.767 1.00 . A A . 18 ALA CA 1 1
12 3005 1 1 18 ALA CB C 5.414 3.339 -4.175 1.00 . A A . 18 ALA CB 1 1
12 3006 1 1 18 ALA H H 5.382 1.588 -2.012 1.00 . A A . 18 ALA H 1 1
12 3007 1 1 18 ALA HA H 5.236 4.653 -2.491 1.00 . A A . 18 ALA HA 1 1
12 3008 1 1 18 ALA HB1 H 6.516 3.242 -4.178 1.00 . A A . 18 ALA HB1 1 1
12 3009 1 1 18 ALA HB2 H 4.996 2.408 -4.597 1.00 . A A . 18 ALA HB2 1 1
12 3010 1 1 18 ALA HB3 H 5.167 4.151 -4.884 1.00 . A A . 18 ALA HB3 1 1
12 3011 1 1 18 ALA N N 5.348 2.594 -1.813 1.00 . A A . 18 ALA N 1 1
12 3012 1 1 18 ALA O O 2.606 3.801 -3.722 1.00 . A A . 18 ALA O 1 1
12 3013 1 1 19 CYS C C 3.569 6.387 -0.552 1.00 . A A . 19 CYS C 1 1
12 3014 1 1 19 CYS CA C 2.474 5.686 -1.382 1.00 . A A . 19 CYS CA 1 1
12 3015 1 1 19 CYS CB C 1.093 5.778 -0.656 1.00 . A A . 19 CYS CB 1 1
12 3016 1 1 19 CYS H H 3.515 3.963 -0.809 1.00 . A A . 19 CYS H 1 1
12 3017 1 1 19 CYS HXT H 4.850 7.877 -0.676 1.00 . A A . 19 CYS HXT 1 1
12 3018 1 1 19 CYS HA H 2.554 6.168 -2.381 1.00 . A A . 19 CYS HA 1 1
12 3019 1 1 19 CYS HB2 H 0.200 5.443 -1.238 1.00 . A A . 19 CYS HB2 1 1
12 3020 1 1 19 CYS HB3 H 1.097 5.118 0.229 1.00 . A A . 19 CYS HB3 1 1
12 3021 1 1 19 CYS N N 2.866 4.278 -1.539 1.00 . A A . 19 CYS N 1 1
12 3022 1 1 19 CYS O O 3.900 6.057 0.587 1.00 . A A . 19 CYS O 1 1
12 3023 1 1 19 CYS OXT O 4.180 7.481 -1.238 1.00 . A A . 19 CYS OXT 1 1
12 3024 1 1 19 CYS SG S 0.817 7.468 -0.066 1.00 . A A . 19 CYS SG 1 1
13 3025 1 1 1 DAL C C -5.967 -0.198 2.015 1.00 . A A . 1 DAL C 1 1
13 3026 1 1 1 DAL CA C -4.979 -1.336 2.423 1.00 . A A . 1 DAL CA 1 1
13 3027 1 1 1 DAL CB C -3.489 -1.017 2.166 1.00 . A A . 1 DAL CB 1 1
13 3028 1 1 1 DAL H1 H -4.530 -2.558 4.032 1.00 . A A . 1 DAL H1 1 1
13 3029 1 1 1 DAL H2 H -6.089 -2.066 4.009 1.00 . A A . 1 DAL H2 1 1
13 3030 1 1 1 DAL HA H -5.240 -2.217 1.807 1.00 . A A . 1 DAL HA 1 1
13 3031 1 1 1 DAL HB1 H -3.125 -0.207 2.826 1.00 . A A . 1 DAL HB1 1 1
13 3032 1 1 1 DAL HB2 H -3.361 -0.652 1.135 1.00 . A A . 1 DAL HB2 1 1
13 3033 1 1 1 DAL N N -5.129 -1.748 3.836 1.00 . A A . 1 DAL N 1 1
13 3034 1 1 1 DAL O O -6.811 0.255 2.796 1.00 . A A . 1 DAL O 1 1
13 3035 1 1 2 SER C C -7.853 -0.269 -0.743 1.00 . A A . 2 SER C 1 1
13 3036 1 1 2 SER CA C -7.042 0.839 0.006 1.00 . A A . 2 SER CA 1 1
13 3037 1 1 2 SER CB C -6.451 1.924 -0.922 1.00 . A A . 2 SER CB 1 1
13 3038 1 1 2 SER H H -5.141 -0.239 0.204 1.00 . A A . 2 SER H 1 1
13 3039 1 1 2 SER HA H -7.706 1.368 0.720 1.00 . A A . 2 SER HA 1 1
13 3040 1 1 2 SER HB2 H -5.827 2.637 -0.350 1.00 . A A . 2 SER HB2 1 1
13 3041 1 1 2 SER HB3 H -5.786 1.476 -1.685 1.00 . A A . 2 SER HB3 1 1
13 3042 1 1 2 SER HG H -8.009 3.050 -0.873 1.00 . A A . 2 SER HG 1 1
13 3043 1 1 2 SER N N -5.913 0.182 0.722 1.00 . A A . 2 SER N 1 1
13 3044 1 1 2 SER O O -7.769 -0.433 -1.965 1.00 . A A . 2 SER O 1 1
13 3045 1 1 2 SER OG O -7.486 2.651 -1.573 1.00 . A A . 2 SER OG 1 1
13 3046 1 1 3 GLY C C -8.003 -3.460 -0.036 1.00 . A A . 3 GLY C 1 1
13 3047 1 1 3 GLY CA C -9.082 -2.399 -0.372 1.00 . A A . 3 GLY CA 1 1
13 3048 1 1 3 GLY H H -8.319 -0.910 1.035 1.00 . A A . 3 GLY H 1 1
13 3049 1 1 3 GLY HA2 H -10.007 -2.614 0.204 1.00 . A A . 3 GLY HA2 1 1
13 3050 1 1 3 GLY HA3 H -9.404 -2.402 -1.431 1.00 . A A . 3 GLY HA3 1 1
13 3051 1 1 3 GLY N N -8.584 -1.069 0.055 1.00 . A A . 3 GLY N 1 1
13 3052 1 1 3 GLY O O -7.684 -3.610 1.148 1.00 . A A . 3 GLY O 1 1
13 3053 1 1 4 TRP C C -5.287 -4.608 -2.237 1.00 . A A . 4 TRP C 1 1
13 3054 1 1 4 TRP CA C -6.033 -4.729 -0.875 1.00 . A A . 4 TRP CA 1 1
13 3055 1 1 4 TRP CB C -6.005 -6.181 -0.351 1.00 . A A . 4 TRP CB 1 1
13 3056 1 1 4 TRP CD1 C -5.591 -6.157 2.233 1.00 . A A . 4 TRP CD1 1 1
13 3057 1 1 4 TRP CD2 C -7.633 -6.801 1.621 1.00 . A A . 4 TRP CD2 1 1
13 3058 1 1 4 TRP CE2 C -7.541 -6.791 3.037 1.00 . A A . 4 TRP CE2 1 1
13 3059 1 1 4 TRP CE3 C -8.854 -7.136 0.983 1.00 . A A . 4 TRP CE3 1 1
13 3060 1 1 4 TRP CG C -6.411 -6.399 1.110 1.00 . A A . 4 TRP CG 1 1
13 3061 1 1 4 TRP CH2 C -9.864 -7.456 3.175 1.00 . A A . 4 TRP CH2 1 1
13 3062 1 1 4 TRP CZ2 C -8.673 -7.123 3.823 1.00 . A A . 4 TRP CZ2 1 1
13 3063 1 1 4 TRP CZ3 C -9.953 -7.462 1.778 1.00 . A A . 4 TRP CZ3 1 1
13 3064 1 1 4 TRP H H -7.701 -3.970 -2.001 1.00 . A A . 4 TRP H 1 1
13 3065 1 1 4 TRP HA H -5.473 -4.145 -0.127 1.00 . A A . 4 TRP HA 1 1
13 3066 1 1 4 TRP HB2 H -6.644 -6.736 -1.033 1.00 . A A . 4 TRP HB2 1 1
13 3067 1 1 4 TRP HB3 H -4.997 -6.621 -0.484 1.00 . A A . 4 TRP HB3 1 1
13 3068 1 1 4 TRP HD1 H -4.572 -5.801 2.179 1.00 . A A . 4 TRP HD1 1 1
13 3069 1 1 4 TRP HE1 H -5.912 -6.275 4.393 1.00 . A A . 4 TRP HE1 1 1
13 3070 1 1 4 TRP HE3 H -8.941 -7.130 -0.095 1.00 . A A . 4 TRP HE3 1 1
13 3071 1 1 4 TRP HH2 H -10.735 -7.709 3.763 1.00 . A A . 4 TRP HH2 1 1
13 3072 1 1 4 TRP HZ2 H -8.630 -7.115 4.903 1.00 . A A . 4 TRP HZ2 1 1
13 3073 1 1 4 TRP HZ3 H -10.891 -7.717 1.306 1.00 . A A . 4 TRP HZ3 1 1
13 3074 1 1 4 TRP N N -7.388 -4.132 -1.038 1.00 . A A . 4 TRP N 1 1
13 3075 1 1 4 TRP NE1 N -6.272 -6.396 3.440 1.00 . A A . 4 TRP NE1 1 1
13 3076 1 1 4 TRP O O -5.087 -5.570 -2.987 1.00 . A A . 4 TRP O 1 1
13 3077 1 1 5 VAL C C -2.356 -3.453 -2.529 1.00 . A A . 5 VAL C 1 1
13 3078 1 1 5 VAL CA C -3.628 -3.110 -3.360 1.00 . A A . 5 VAL CA 1 1
13 3079 1 1 5 VAL CB C -3.686 -1.724 -4.098 1.00 . A A . 5 VAL CB 1 1
13 3080 1 1 5 VAL CG1 C -2.480 -1.523 -5.046 1.00 . A A . 5 VAL CG1 1 1
13 3081 1 1 5 VAL CG2 C -4.980 -1.517 -4.921 1.00 . A A . 5 VAL CG2 1 1
13 3082 1 1 5 VAL H H -5.176 -2.747 -1.775 1.00 . A A . 5 VAL H 1 1
13 3083 1 1 5 VAL HA H -3.622 -3.845 -4.165 1.00 . A A . 5 VAL HA 1 1
13 3084 1 1 5 VAL HB H -3.661 -0.905 -3.357 1.00 . A A . 5 VAL HB 1 1
13 3085 1 1 5 VAL HG11 H -1.518 -1.568 -4.502 1.00 . A A . 5 VAL HG11 1 1
13 3086 1 1 5 VAL HG12 H -2.440 -2.295 -5.838 1.00 . A A . 5 VAL HG12 1 1
13 3087 1 1 5 VAL HG13 H -2.507 -0.539 -5.549 1.00 . A A . 5 VAL HG13 1 1
13 3088 1 1 5 VAL HG21 H -5.104 -2.289 -5.703 1.00 . A A . 5 VAL HG21 1 1
13 3089 1 1 5 VAL HG22 H -5.882 -1.552 -4.281 1.00 . A A . 5 VAL HG22 1 1
13 3090 1 1 5 VAL HG23 H -4.995 -0.531 -5.423 1.00 . A A . 5 VAL HG23 1 1
13 3091 1 1 5 VAL N N -4.800 -3.384 -2.474 1.00 . A A . 5 VAL N 1 1
13 3092 1 1 5 VAL O O -1.795 -4.531 -2.730 1.00 . A A . 5 VAL O 1 1
13 3093 1 1 6 CYS C C -0.353 -4.075 -0.146 1.00 . A A . 6 CYS C 1 1
13 3094 1 1 6 CYS CA C -1.474 -2.994 -0.223 1.00 . A A . 6 CYS CA 1 1
13 3095 1 1 6 CYS CB C -2.606 -3.335 0.777 1.00 . A A . 6 CYS CB 1 1
13 3096 1 1 6 CYS H H -2.435 -1.682 -1.679 1.00 . A A . 6 CYS H 1 1
13 3097 1 1 6 CYS HA H -1.094 -2.027 0.160 1.00 . A A . 6 CYS HA 1 1
13 3098 1 1 6 CYS HB2 H -3.603 -3.116 0.366 1.00 . A A . 6 CYS HB2 1 1
13 3099 1 1 6 CYS HB3 H -2.591 -4.411 0.990 1.00 . A A . 6 CYS HB3 1 1
13 3100 1 1 6 CYS N N -1.995 -2.596 -1.559 1.00 . A A . 6 CYS N 1 1
13 3101 1 1 6 CYS O O -0.496 -5.248 -0.504 1.00 . A A . 6 CYS O 1 1
13 3102 1 1 6 CYS SG S -2.440 -2.479 2.366 1.00 . A A . 6 CYS SG 1 1
13 3103 1 1 7 ABA C C 2.946 -4.946 0.472 1.00 . A A . 7 ABA C 1 1
13 3104 1 1 7 ABA CA C 1.657 -4.500 1.240 1.00 . A A . 7 ABA CA 1 1
13 3105 1 1 7 ABA CB C 1.963 -3.642 2.509 1.00 . A A . 7 ABA CB 1 1
13 3106 1 1 7 ABA CG C 0.759 -3.575 3.486 1.00 . A A . 7 ABA CG 1 1
13 3107 1 1 7 ABA H H 0.413 -2.758 0.937 1.00 . A A . 7 ABA H 1 1
13 3108 1 1 7 ABA HA H 1.151 -5.432 1.563 1.00 . A A . 7 ABA HA 1 1
13 3109 1 1 7 ABA HB2 H 2.798 -4.089 3.081 1.00 . A A . 7 ABA HB2 1 1
13 3110 1 1 7 ABA HG1 H 1.000 -3.048 4.422 1.00 . A A . 7 ABA HG1 1 1
13 3111 1 1 7 ABA HG2 H -0.105 -3.062 3.034 1.00 . A A . 7 ABA HG2 1 1
13 3112 1 1 7 ABA HG3 H 0.400 -4.587 3.755 1.00 . A A . 7 ABA HG3 1 1
13 3113 1 1 7 ABA N N 0.711 -3.630 0.490 1.00 . A A . 7 ABA N 1 1
13 3114 1 1 7 ABA O O 3.994 -5.139 1.098 1.00 . A A . 7 ABA O 1 1
13 3115 1 1 8 LEU C C 4.664 -4.298 -2.438 1.00 . A A . 8 LEU C 1 1
13 3116 1 1 8 LEU CA C 4.047 -5.527 -1.705 1.00 . A A . 8 LEU CA 1 1
13 3117 1 1 8 LEU CB C 3.685 -6.739 -2.623 1.00 . A A . 8 LEU CB 1 1
13 3118 1 1 8 LEU CD1 C 2.163 -5.603 -4.426 1.00 . A A . 8 LEU CD1 1 1
13 3119 1 1 8 LEU CD2 C 2.181 -8.110 -4.160 1.00 . A A . 8 LEU CD2 1 1
13 3120 1 1 8 LEU CG C 2.344 -6.764 -3.427 1.00 . A A . 8 LEU CG 1 1
13 3121 1 1 8 LEU H H 2.013 -4.793 -1.290 1.00 . A A . 8 LEU H 1 1
13 3122 1 1 8 LEU HA H 4.882 -5.878 -1.061 1.00 . A A . 8 LEU HA 1 1
13 3123 1 1 8 LEU HB2 H 4.528 -6.924 -3.316 1.00 . A A . 8 LEU HB2 1 1
13 3124 1 1 8 LEU HB3 H 3.688 -7.634 -1.970 1.00 . A A . 8 LEU HB3 1 1
13 3125 1 1 8 LEU HD11 H 2.967 -5.578 -5.186 1.00 . A A . 8 LEU HD11 1 1
13 3126 1 1 8 LEU HD12 H 1.201 -5.672 -4.966 1.00 . A A . 8 LEU HD12 1 1
13 3127 1 1 8 LEU HD13 H 2.161 -4.622 -3.915 1.00 . A A . 8 LEU HD13 1 1
13 3128 1 1 8 LEU HD21 H 2.228 -8.965 -3.459 1.00 . A A . 8 LEU HD21 1 1
13 3129 1 1 8 LEU HD22 H 1.206 -8.181 -4.678 1.00 . A A . 8 LEU HD22 1 1
13 3130 1 1 8 LEU HD23 H 2.969 -8.268 -4.921 1.00 . A A . 8 LEU HD23 1 1
13 3131 1 1 8 LEU HG H 1.511 -6.698 -2.702 1.00 . A A . 8 LEU HG 1 1
13 3132 1 1 8 LEU N N 2.869 -5.159 -0.859 1.00 . A A . 8 LEU N 1 1
13 3133 1 1 8 LEU O O 4.875 -4.297 -3.655 1.00 . A A . 8 LEU O 1 1
13 3134 1 1 9 ABA C C 4.755 -0.990 -2.878 1.00 . A A . 9 ABA C 1 1
13 3135 1 1 9 ABA CA C 5.664 -2.029 -2.144 1.00 . A A . 9 ABA CA 1 1
13 3136 1 1 9 ABA CB C 6.465 -1.410 -0.955 1.00 . A A . 9 ABA CB 1 1
13 3137 1 1 9 ABA CG C 7.674 -2.272 -0.541 1.00 . A A . 9 ABA CG 1 1
13 3138 1 1 9 ABA H H 4.777 -3.391 -0.658 1.00 . A A . 9 ABA H 1 1
13 3139 1 1 9 ABA HA H 6.414 -2.329 -2.903 1.00 . A A . 9 ABA HA 1 1
13 3140 1 1 9 ABA HB2 H 6.859 -0.419 -1.249 1.00 . A A . 9 ABA HB2 1 1
13 3141 1 1 9 ABA HG1 H 7.355 -3.267 -0.171 1.00 . A A . 9 ABA HG1 1 1
13 3142 1 1 9 ABA HG2 H 8.248 -1.797 0.273 1.00 . A A . 9 ABA HG2 1 1
13 3143 1 1 9 ABA HG3 H 8.363 -2.448 -1.387 1.00 . A A . 9 ABA HG3 1 1
13 3144 1 1 9 ABA N N 4.994 -3.260 -1.652 1.00 . A A . 9 ABA N 1 1
13 3145 1 1 9 ABA O O 5.320 -0.073 -3.479 1.00 . A A . 9 ABA O 1 1
13 3146 1 1 10 ILE C C 1.294 0.008 -2.635 1.00 . A A . 10 ILE C 1 1
13 3147 1 1 10 ILE CA C 2.487 -0.205 -3.612 1.00 . A A . 10 ILE CA 1 1
13 3148 1 1 10 ILE CB C 2.007 -0.764 -5.003 1.00 . A A . 10 ILE CB 1 1
13 3149 1 1 10 ILE CD1 C 4.031 -0.140 -6.597 1.00 . A A . 10 ILE CD1 1 1
13 3150 1 1 10 ILE CG1 C 3.123 -1.225 -5.991 1.00 . A A . 10 ILE CG1 1 1
13 3151 1 1 10 ILE CG2 C 1.027 0.198 -5.727 1.00 . A A . 10 ILE CG2 1 1
13 3152 1 1 10 ILE H H 3.037 -1.874 -2.288 1.00 . A A . 10 ILE H 1 1
13 3153 1 1 10 ILE HA H 2.995 0.763 -3.803 1.00 . A A . 10 ILE HA 1 1
13 3154 1 1 10 ILE HB H 1.422 -1.672 -4.774 1.00 . A A . 10 ILE HB 1 1
13 3155 1 1 10 ILE HD11 H 4.532 0.466 -5.823 1.00 . A A . 10 ILE HD11 1 1
13 3156 1 1 10 ILE HD12 H 4.823 -0.591 -7.222 1.00 . A A . 10 ILE HD12 1 1
13 3157 1 1 10 ILE HD13 H 3.466 0.555 -7.244 1.00 . A A . 10 ILE HD13 1 1
13 3158 1 1 10 ILE HG12 H 3.760 -1.981 -5.497 1.00 . A A . 10 ILE HG12 1 1
13 3159 1 1 10 ILE HG13 H 2.653 -1.780 -6.825 1.00 . A A . 10 ILE HG13 1 1
13 3160 1 1 10 ILE HG21 H 0.121 0.394 -5.126 1.00 . A A . 10 ILE HG21 1 1
13 3161 1 1 10 ILE HG22 H 1.490 1.180 -5.936 1.00 . A A . 10 ILE HG22 1 1
13 3162 1 1 10 ILE HG23 H 0.677 -0.218 -6.690 1.00 . A A . 10 ILE HG23 1 1
13 3163 1 1 10 ILE N N 3.406 -1.120 -2.881 1.00 . A A . 10 ILE N 1 1
13 3164 1 1 10 ILE O O 0.458 -0.882 -2.446 1.00 . A A . 10 ILE O 1 1
13 3165 1 1 11 GLU C C -0.319 0.779 -0.019 1.00 . A A . 11 GLU C 1 1
13 3166 1 1 11 GLU CA C 0.102 1.709 -1.209 1.00 . A A . 11 GLU CA 1 1
13 3167 1 1 11 GLU CB C -1.021 2.341 -2.101 1.00 . A A . 11 GLU CB 1 1
13 3168 1 1 11 GLU CD C -2.992 2.111 -3.718 1.00 . A A . 11 GLU CD 1 1
13 3169 1 1 11 GLU CG C -2.016 1.386 -2.788 1.00 . A A . 11 GLU CG 1 1
13 3170 1 1 11 GLU H H 2.047 1.801 -2.210 1.00 . A A . 11 GLU H 1 1
13 3171 1 1 11 GLU HA H 0.528 2.592 -0.679 1.00 . A A . 11 GLU HA 1 1
13 3172 1 1 11 GLU HB2 H -1.586 3.049 -1.470 1.00 . A A . 11 GLU HB2 1 1
13 3173 1 1 11 GLU HB3 H -0.587 2.977 -2.909 1.00 . A A . 11 GLU HB3 1 1
13 3174 1 1 11 GLU HE2 H -3.134 2.645 -5.584 1.00 . A A . 11 GLU HE2 1 1
13 3175 1 1 11 GLU HG2 H -1.463 0.626 -3.365 1.00 . A A . 11 GLU HG2 1 1
13 3176 1 1 11 GLU HG3 H -2.596 0.826 -2.034 1.00 . A A . 11 GLU HG3 1 1
13 3177 1 1 11 GLU N N 1.224 1.217 -2.055 1.00 . A A . 11 GLU N 1 1
13 3178 1 1 11 GLU O O -1.495 0.475 0.168 1.00 . A A . 11 GLU O 1 1
13 3179 1 1 11 GLU OE1 O -4.071 2.570 -3.346 1.00 . A A . 11 GLU OE1 1 1
13 3180 1 1 11 GLU OE2 O -2.520 2.189 -5.004 1.00 . A A . 11 GLU OE2 1 1
13 3181 1 1 12 CYS C C -0.134 0.848 3.241 1.00 . A A . 12 CYS C 1 1
13 3182 1 1 12 CYS CA C 0.443 -0.153 2.187 1.00 . A A . 12 CYS CA 1 1
13 3183 1 1 12 CYS CB C 1.800 -0.651 2.774 1.00 . A A . 12 CYS CB 1 1
13 3184 1 1 12 CYS H H 1.570 0.808 0.558 1.00 . A A . 12 CYS H 1 1
13 3185 1 1 12 CYS HA H -0.244 -1.012 2.098 1.00 . A A . 12 CYS HA 1 1
13 3186 1 1 12 CYS HB2 H 2.551 0.160 2.731 1.00 . A A . 12 CYS HB2 1 1
13 3187 1 1 12 CYS HB3 H 1.718 -0.928 3.842 1.00 . A A . 12 CYS HB3 1 1
13 3188 1 1 12 CYS N N 0.666 0.442 0.838 1.00 . A A . 12 CYS N 1 1
13 3189 1 1 12 CYS O O -0.779 0.397 4.192 1.00 . A A . 12 CYS O 1 1
13 3190 1 1 12 CYS SG S 2.573 -2.024 1.889 1.00 . A A . 12 CYS SG 1 1
13 3191 1 1 13 GLY C C -0.520 4.608 3.617 1.00 . A A . 13 GLY C 1 1
13 3192 1 1 13 GLY CA C -0.244 3.173 4.114 1.00 . A A . 13 GLY CA 1 1
13 3193 1 1 13 GLY H H 0.627 2.365 2.214 1.00 . A A . 13 GLY H 1 1
13 3194 1 1 13 GLY HA2 H -1.128 2.838 4.690 1.00 . A A . 13 GLY HA2 1 1
13 3195 1 1 13 GLY HA3 H 0.574 3.218 4.857 1.00 . A A . 13 GLY HA3 1 1
13 3196 1 1 13 GLY N N 0.114 2.164 3.088 1.00 . A A . 13 GLY N 1 1
13 3197 1 1 13 GLY O O -1.475 5.228 4.095 1.00 . A A . 13 GLY O 1 1
13 3198 1 1 14 ABA C C 1.986 7.107 2.616 1.00 . A A . 14 ABA C 1 1
13 3199 1 1 14 ABA CA C 0.479 6.646 2.562 1.00 . A A . 14 ABA CA 1 1
13 3200 1 1 14 ABA CB C -0.328 7.221 1.338 1.00 . A A . 14 ABA CB 1 1
13 3201 1 1 14 ABA CG C -1.688 6.572 1.020 1.00 . A A . 14 ABA CG 1 1
13 3202 1 1 14 ABA H H 1.090 4.546 2.431 1.00 . A A . 14 ABA H 1 1
13 3203 1 1 14 ABA HA H 0.032 7.136 3.450 1.00 . A A . 14 ABA HA 1 1
13 3204 1 1 14 ABA HB2 H -0.551 8.273 1.598 1.00 . A A . 14 ABA HB2 1 1
13 3205 1 1 14 ABA HG1 H -1.567 5.514 0.717 1.00 . A A . 14 ABA HG1 1 1
13 3206 1 1 14 ABA HG2 H -2.193 7.093 0.189 1.00 . A A . 14 ABA HG2 1 1
13 3207 1 1 14 ABA HG3 H -2.358 6.589 1.897 1.00 . A A . 14 ABA HG3 1 1
13 3208 1 1 14 ABA N N 0.339 5.165 2.743 1.00 . A A . 14 ABA N 1 1
13 3209 1 1 14 ABA O O 2.330 8.156 2.061 1.00 . A A . 14 ABA O 1 1
13 3210 1 1 15 VAL C C 5.320 5.540 3.533 1.00 . A A . 15 VAL C 1 1
13 3211 1 1 15 VAL CA C 4.302 6.737 3.564 1.00 . A A . 15 VAL CA 1 1
13 3212 1 1 15 VAL CB C 4.386 7.624 4.855 1.00 . A A . 15 VAL CB 1 1
13 3213 1 1 15 VAL CG1 C 4.229 6.877 6.202 1.00 . A A . 15 VAL CG1 1 1
13 3214 1 1 15 VAL CG2 C 5.650 8.509 4.887 1.00 . A A . 15 VAL CG2 1 1
13 3215 1 1 15 VAL H H 2.435 5.600 3.846 1.00 . A A . 15 VAL H 1 1
13 3216 1 1 15 VAL HA H 4.609 7.363 2.708 1.00 . A A . 15 VAL HA 1 1
13 3217 1 1 15 VAL HB H 3.527 8.319 4.807 1.00 . A A . 15 VAL HB 1 1
13 3218 1 1 15 VAL HG11 H 3.316 6.255 6.220 1.00 . A A . 15 VAL HG11 1 1
13 3219 1 1 15 VAL HG12 H 5.086 6.209 6.407 1.00 . A A . 15 VAL HG12 1 1
13 3220 1 1 15 VAL HG13 H 4.154 7.580 7.052 1.00 . A A . 15 VAL HG13 1 1
13 3221 1 1 15 VAL HG21 H 5.738 9.125 3.973 1.00 . A A . 15 VAL HG21 1 1
13 3222 1 1 15 VAL HG22 H 5.639 9.211 5.742 1.00 . A A . 15 VAL HG22 1 1
13 3223 1 1 15 VAL HG23 H 6.576 7.909 4.968 1.00 . A A . 15 VAL HG23 1 1
13 3224 1 1 15 VAL N N 2.875 6.364 3.326 1.00 . A A . 15 VAL N 1 1
13 3225 1 1 15 VAL O O 6.467 5.750 3.129 1.00 . A A . 15 VAL O 1 1
13 3226 1 1 16 ILE C C 6.287 2.551 2.795 1.00 . A A . 16 ILE C 1 1
13 3227 1 1 16 ILE CA C 5.866 3.162 4.175 1.00 . A A . 16 ILE CA 1 1
13 3228 1 1 16 ILE CB C 5.259 2.175 5.252 1.00 . A A . 16 ILE CB 1 1
13 3229 1 1 16 ILE CD1 C 4.404 2.117 7.736 1.00 . A A . 16 ILE CD1 1 1
13 3230 1 1 16 ILE CG1 C 5.313 2.784 6.689 1.00 . A A . 16 ILE CG1 1 1
13 3231 1 1 16 ILE CG2 C 5.904 0.760 5.259 1.00 . A A . 16 ILE CG2 1 1
13 3232 1 1 16 ILE H H 3.937 4.271 4.201 1.00 . A A . 16 ILE H 1 1
13 3233 1 1 16 ILE HA H 6.804 3.554 4.618 1.00 . A A . 16 ILE HA 1 1
13 3234 1 1 16 ILE HB H 4.190 2.023 5.013 1.00 . A A . 16 ILE HB 1 1
13 3235 1 1 16 ILE HD11 H 3.347 2.112 7.413 1.00 . A A . 16 ILE HD11 1 1
13 3236 1 1 16 ILE HD12 H 4.698 1.071 7.939 1.00 . A A . 16 ILE HD12 1 1
13 3237 1 1 16 ILE HD13 H 4.449 2.657 8.699 1.00 . A A . 16 ILE HD13 1 1
13 3238 1 1 16 ILE HG12 H 6.356 2.795 7.060 1.00 . A A . 16 ILE HG12 1 1
13 3239 1 1 16 ILE HG13 H 5.017 3.847 6.654 1.00 . A A . 16 ILE HG13 1 1
13 3240 1 1 16 ILE HG21 H 5.785 0.247 4.286 1.00 . A A . 16 ILE HG21 1 1
13 3241 1 1 16 ILE HG22 H 6.986 0.795 5.479 1.00 . A A . 16 ILE HG22 1 1
13 3242 1 1 16 ILE HG23 H 5.436 0.087 6.000 1.00 . A A . 16 ILE HG23 1 1
13 3243 1 1 16 ILE N N 4.936 4.324 3.980 1.00 . A A . 16 ILE N 1 1
13 3244 1 1 16 ILE O O 7.461 2.652 2.424 1.00 . A A . 16 ILE O 1 1
13 3245 1 1 17 CYS C C 5.412 2.796 -0.338 1.00 . A A . 17 CYS C 1 1
13 3246 1 1 17 CYS CA C 5.551 1.567 0.617 1.00 . A A . 17 CYS CA 1 1
13 3247 1 1 17 CYS CB C 4.593 0.363 0.362 1.00 . A A . 17 CYS CB 1 1
13 3248 1 1 17 CYS H H 4.395 2.020 2.431 1.00 . A A . 17 CYS H 1 1
13 3249 1 1 17 CYS HA H 6.578 1.196 0.454 1.00 . A A . 17 CYS HA 1 1
13 3250 1 1 17 CYS HB2 H 3.724 0.350 1.040 1.00 . A A . 17 CYS HB2 1 1
13 3251 1 1 17 CYS HB3 H 4.119 0.383 -0.627 1.00 . A A . 17 CYS HB3 1 1
13 3252 1 1 17 CYS N N 5.340 1.965 2.038 1.00 . A A . 17 CYS N 1 1
13 3253 1 1 17 CYS O O 5.433 3.955 0.094 1.00 . A A . 17 CYS O 1 1
13 3254 1 1 17 CYS SG S 5.455 -1.218 0.551 1.00 . A A . 17 CYS SG 1 1
13 3255 1 1 18 ALA C C 3.293 3.718 -2.688 1.00 . A A . 18 ALA C 1 1
13 3256 1 1 18 ALA CA C 4.836 3.568 -2.639 1.00 . A A . 18 ALA CA 1 1
13 3257 1 1 18 ALA CB C 5.479 3.276 -4.008 1.00 . A A . 18 ALA CB 1 1
13 3258 1 1 18 ALA H H 5.350 1.534 -1.850 1.00 . A A . 18 ALA H 1 1
13 3259 1 1 18 ALA HA H 5.165 4.590 -2.348 1.00 . A A . 18 ALA HA 1 1
13 3260 1 1 18 ALA HB1 H 6.582 3.224 -3.945 1.00 . A A . 18 ALA HB1 1 1
13 3261 1 1 18 ALA HB2 H 5.126 2.322 -4.441 1.00 . A A . 18 ALA HB2 1 1
13 3262 1 1 18 ALA HB3 H 5.240 4.068 -4.741 1.00 . A A . 18 ALA HB3 1 1
13 3263 1 1 18 ALA N N 5.293 2.539 -1.652 1.00 . A A . 18 ALA N 1 1
13 3264 1 1 18 ALA O O 2.628 3.611 -3.722 1.00 . A A . 18 ALA O 1 1
13 3265 1 1 19 CYS C C 3.373 6.235 -0.510 1.00 . A A . 19 CYS C 1 1
13 3266 1 1 19 CYS CA C 2.335 5.561 -1.425 1.00 . A A . 19 CYS CA 1 1
13 3267 1 1 19 CYS CB C 0.922 5.657 -0.771 1.00 . A A . 19 CYS CB 1 1
13 3268 1 1 19 CYS H H 3.363 3.874 -0.774 1.00 . A A . 19 CYS H 1 1
13 3269 1 1 19 CYS HXT H 4.153 6.103 1.293 1.00 . A A . 19 CYS HXT 1 1
13 3270 1 1 19 CYS HA H 2.463 6.038 -2.421 1.00 . A A . 19 CYS HA 1 1
13 3271 1 1 19 CYS HB2 H 0.056 5.318 -1.389 1.00 . A A . 19 CYS HB2 1 1
13 3272 1 1 19 CYS HB3 H 0.879 5.003 0.119 1.00 . A A . 19 CYS HB3 1 1
13 3273 1 1 19 CYS N N 2.749 4.160 -1.544 1.00 . A A . 19 CYS N 1 1
13 3274 1 1 19 CYS O O 4.045 7.208 -0.852 1.00 . A A . 19 CYS O 1 1
13 3275 1 1 19 CYS OXT O 3.491 5.633 0.780 1.00 . A A . 19 CYS OXT 1 1
13 3276 1 1 19 CYS SG S 0.616 7.353 -0.216 1.00 . A A . 19 CYS SG 1 1
14 3277 1 1 1 DAL C C -6.141 -0.149 1.576 1.00 . A A . 1 DAL C 1 1
14 3278 1 1 1 DAL CA C -5.179 -1.329 1.921 1.00 . A A . 1 DAL CA 1 1
14 3279 1 1 1 DAL CB C -3.677 -1.005 1.764 1.00 . A A . 1 DAL CB 1 1
14 3280 1 1 1 DAL H1 H -5.155 -1.163 3.984 1.00 . A A . 1 DAL H1 1 1
14 3281 1 1 1 DAL H2 H -4.769 -2.660 3.452 1.00 . A A . 1 DAL H2 1 1
14 3282 1 1 1 DAL HA H -5.416 -2.147 1.215 1.00 . A A . 1 DAL HA 1 1
14 3283 1 1 1 DAL HB1 H -3.350 -0.245 2.498 1.00 . A A . 1 DAL HB1 1 1
14 3284 1 1 1 DAL HB2 H -3.489 -0.570 0.770 1.00 . A A . 1 DAL HB2 1 1
14 3285 1 1 1 DAL N N -5.400 -1.869 3.281 1.00 . A A . 1 DAL N 1 1
14 3286 1 1 1 DAL O O -7.011 0.245 2.362 1.00 . A A . 1 DAL O 1 1
14 3287 1 1 2 SER C C -7.920 -0.013 -1.244 1.00 . A A . 2 SER C 1 1
14 3288 1 1 2 SER CA C -7.152 1.040 -0.379 1.00 . A A . 2 SER CA 1 1
14 3289 1 1 2 SER CB C -6.580 2.207 -1.217 1.00 . A A . 2 SER CB 1 1
14 3290 1 1 2 SER H H -5.240 -0.025 -0.194 1.00 . A A . 2 SER H 1 1
14 3291 1 1 2 SER HA H -7.854 1.497 0.347 1.00 . A A . 2 SER HA 1 1
14 3292 1 1 2 SER HB2 H -5.847 1.842 -1.961 1.00 . A A . 2 SER HB2 1 1
14 3293 1 1 2 SER HB3 H -7.387 2.690 -1.799 1.00 . A A . 2 SER HB3 1 1
14 3294 1 1 2 SER HG H -6.653 3.505 0.202 1.00 . A A . 2 SER HG 1 1
14 3295 1 1 2 SER N N -6.039 0.340 0.323 1.00 . A A . 2 SER N 1 1
14 3296 1 1 2 SER O O -7.793 -0.076 -2.472 1.00 . A A . 2 SER O 1 1
14 3297 1 1 2 SER OG O -5.966 3.192 -0.392 1.00 . A A . 2 SER OG 1 1
14 3298 1 1 3 GLY C C -8.079 -3.262 -0.818 1.00 . A A . 3 GLY C 1 1
14 3299 1 1 3 GLY CA C -9.145 -2.173 -1.097 1.00 . A A . 3 GLY CA 1 1
14 3300 1 1 3 GLY H H -8.433 -0.809 0.457 1.00 . A A . 3 GLY H 1 1
14 3301 1 1 3 GLY HA2 H -10.089 -2.436 -0.575 1.00 . A A . 3 GLY HA2 1 1
14 3302 1 1 3 GLY HA3 H -9.431 -2.085 -2.164 1.00 . A A . 3 GLY HA3 1 1
14 3303 1 1 3 GLY N N -8.665 -0.885 -0.541 1.00 . A A . 3 GLY N 1 1
14 3304 1 1 3 GLY O O -7.809 -3.525 0.359 1.00 . A A . 3 GLY O 1 1
14 3305 1 1 4 TRP C C -5.279 -4.183 -3.008 1.00 . A A . 4 TRP C 1 1
14 3306 1 1 4 TRP CA C -6.072 -4.444 -1.693 1.00 . A A . 4 TRP CA 1 1
14 3307 1 1 4 TRP CB C -6.049 -5.940 -1.315 1.00 . A A . 4 TRP CB 1 1
14 3308 1 1 4 TRP CD1 C -5.744 -6.179 1.273 1.00 . A A . 4 TRP CD1 1 1
14 3309 1 1 4 TRP CD2 C -7.757 -6.753 0.514 1.00 . A A . 4 TRP CD2 1 1
14 3310 1 1 4 TRP CE2 C -7.724 -6.889 1.926 1.00 . A A . 4 TRP CE2 1 1
14 3311 1 1 4 TRP CE3 C -8.949 -7.020 -0.206 1.00 . A A . 4 TRP CE3 1 1
14 3312 1 1 4 TRP CG C -6.516 -6.304 0.098 1.00 . A A . 4 TRP CG 1 1
14 3313 1 1 4 TRP CH2 C -10.049 -7.562 1.898 1.00 . A A . 4 TRP CH2 1 1
14 3314 1 1 4 TRP CZ2 C -8.887 -7.298 2.626 1.00 . A A . 4 TRP CZ2 1 1
14 3315 1 1 4 TRP CZ3 C -10.079 -7.424 0.505 1.00 . A A . 4 TRP CZ3 1 1
14 3316 1 1 4 TRP H H -7.687 -3.576 -2.808 1.00 . A A . 4 TRP H 1 1
14 3317 1 1 4 TRP HA H -5.549 -3.935 -0.868 1.00 . A A . 4 TRP HA 1 1
14 3318 1 1 4 TRP HB2 H -6.650 -6.430 -2.075 1.00 . A A . 4 TRP HB2 1 1
14 3319 1 1 4 TRP HB3 H -5.030 -6.357 -1.447 1.00 . A A . 4 TRP HB3 1 1
14 3320 1 1 4 TRP HD1 H -4.724 -5.824 1.298 1.00 . A A . 4 TRP HD1 1 1
14 3321 1 1 4 TRP HE1 H -6.154 -6.518 3.394 1.00 . A A . 4 TRP HE1 1 1
14 3322 1 1 4 TRP HE3 H -8.990 -6.904 -1.280 1.00 . A A . 4 TRP HE3 1 1
14 3323 1 1 4 TRP HH2 H -10.942 -7.873 2.420 1.00 . A A . 4 TRP HH2 1 1
14 3324 1 1 4 TRP HZ2 H -8.889 -7.401 3.702 1.00 . A A . 4 TRP HZ2 1 1
14 3325 1 1 4 TRP HZ3 H -10.995 -7.630 -0.029 1.00 . A A . 4 TRP HZ3 1 1
14 3326 1 1 4 TRP N N -7.423 -3.839 -1.853 1.00 . A A . 4 TRP N 1 1
14 3327 1 1 4 TRP NE1 N -6.474 -6.540 2.419 1.00 . A A . 4 TRP NE1 1 1
14 3328 1 1 4 TRP O O -5.063 -5.054 -3.857 1.00 . A A . 4 TRP O 1 1
14 3329 1 1 5 VAL C C -2.334 -3.069 -3.003 1.00 . A A . 5 VAL C 1 1
14 3330 1 1 5 VAL CA C -3.546 -2.593 -3.862 1.00 . A A . 5 VAL CA 1 1
14 3331 1 1 5 VAL CB C -3.552 -1.117 -4.411 1.00 . A A . 5 VAL CB 1 1
14 3332 1 1 5 VAL CG1 C -2.282 -0.788 -5.230 1.00 . A A . 5 VAL CG1 1 1
14 3333 1 1 5 VAL CG2 C -4.784 -0.808 -5.297 1.00 . A A . 5 VAL CG2 1 1
14 3334 1 1 5 VAL H H -5.163 -2.403 -2.315 1.00 . A A . 5 VAL H 1 1
14 3335 1 1 5 VAL HA H -3.504 -3.221 -4.754 1.00 . A A . 5 VAL HA 1 1
14 3336 1 1 5 VAL HB H -3.585 -0.392 -3.576 1.00 . A A . 5 VAL HB 1 1
14 3337 1 1 5 VAL HG11 H -1.364 -0.915 -4.631 1.00 . A A . 5 VAL HG11 1 1
14 3338 1 1 5 VAL HG12 H -2.180 -1.436 -6.120 1.00 . A A . 5 VAL HG12 1 1
14 3339 1 1 5 VAL HG13 H -2.279 0.261 -5.582 1.00 . A A . 5 VAL HG13 1 1
14 3340 1 1 5 VAL HG21 H -4.845 -1.481 -6.173 1.00 . A A . 5 VAL HG21 1 1
14 3341 1 1 5 VAL HG22 H -5.729 -0.919 -4.734 1.00 . A A . 5 VAL HG22 1 1
14 3342 1 1 5 VAL HG23 H -4.770 0.230 -5.678 1.00 . A A . 5 VAL HG23 1 1
14 3343 1 1 5 VAL N N -4.768 -2.949 -3.078 1.00 . A A . 5 VAL N 1 1
14 3344 1 1 5 VAL O O -1.800 -4.148 -3.271 1.00 . A A . 5 VAL O 1 1
14 3345 1 1 6 CYS C C -0.443 -3.962 -0.594 1.00 . A A . 6 CYS C 1 1
14 3346 1 1 6 CYS CA C -1.558 -2.871 -0.627 1.00 . A A . 6 CYS CA 1 1
14 3347 1 1 6 CYS CB C -2.733 -3.264 0.297 1.00 . A A . 6 CYS CB 1 1
14 3348 1 1 6 CYS H H -2.442 -1.403 -1.983 1.00 . A A . 6 CYS H 1 1
14 3349 1 1 6 CYS HA H -1.196 -1.952 -0.137 1.00 . A A . 6 CYS HA 1 1
14 3350 1 1 6 CYS HB2 H -3.708 -3.024 -0.148 1.00 . A A . 6 CYS HB2 1 1
14 3351 1 1 6 CYS HB3 H -2.725 -4.350 0.442 1.00 . A A . 6 CYS HB3 1 1
14 3352 1 1 6 CYS N N -2.008 -2.327 -1.936 1.00 . A A . 6 CYS N 1 1
14 3353 1 1 6 CYS O O -0.584 -5.108 -1.030 1.00 . A A . 6 CYS O 1 1
14 3354 1 1 6 CYS SG S -2.646 -2.487 1.933 1.00 . A A . 6 CYS SG 1 1
14 3355 1 1 7 ABA C C 2.801 -4.951 0.192 1.00 . A A . 7 ABA C 1 1
14 3356 1 1 7 ABA CA C 1.487 -4.458 0.880 1.00 . A A . 7 ABA CA 1 1
14 3357 1 1 7 ABA CB C 1.758 -3.609 2.167 1.00 . A A . 7 ABA CB 1 1
14 3358 1 1 7 ABA CG C 0.515 -3.526 3.091 1.00 . A A . 7 ABA CG 1 1
14 3359 1 1 7 ABA H H 0.297 -2.704 0.563 1.00 . A A . 7 ABA H 1 1
14 3360 1 1 7 ABA HA H 0.934 -5.373 1.173 1.00 . A A . 7 ABA HA 1 1
14 3361 1 1 7 ABA HB2 H 2.554 -4.080 2.774 1.00 . A A . 7 ABA HB2 1 1
14 3362 1 1 7 ABA HG1 H -0.324 -3.010 2.598 1.00 . A A . 7 ABA HG1 1 1
14 3363 1 1 7 ABA HG2 H 0.135 -4.533 3.349 1.00 . A A . 7 ABA HG2 1 1
14 3364 1 1 7 ABA HG3 H 0.719 -2.993 4.033 1.00 . A A . 7 ABA HG3 1 1
14 3365 1 1 7 ABA N N 0.607 -3.557 0.092 1.00 . A A . 7 ABA N 1 1
14 3366 1 1 7 ABA O O 3.756 -5.284 0.901 1.00 . A A . 7 ABA O 1 1
14 3367 1 1 8 LEU C C 4.647 -4.206 -2.673 1.00 . A A . 8 LEU C 1 1
14 3368 1 1 8 LEU CA C 4.100 -5.435 -1.887 1.00 . A A . 8 LEU CA 1 1
14 3369 1 1 8 LEU CB C 3.891 -6.701 -2.782 1.00 . A A . 8 LEU CB 1 1
14 3370 1 1 8 LEU CD1 C 4.588 -8.510 -1.056 1.00 . A A . 8 LEU CD1 1 1
14 3371 1 1 8 LEU CD2 C 2.124 -8.231 -1.629 1.00 . A A . 8 LEU CD2 1 1
14 3372 1 1 8 LEU CG C 3.573 -8.084 -2.136 1.00 . A A . 8 LEU CG 1 1
14 3373 1 1 8 LEU H H 2.061 -4.603 -1.631 1.00 . A A . 8 LEU H 1 1
14 3374 1 1 8 LEU HA H 4.915 -5.689 -1.177 1.00 . A A . 8 LEU HA 1 1
14 3375 1 1 8 LEU HB2 H 3.132 -6.488 -3.558 1.00 . A A . 8 LEU HB2 1 1
14 3376 1 1 8 LEU HB3 H 4.821 -6.850 -3.367 1.00 . A A . 8 LEU HB3 1 1
14 3377 1 1 8 LEU HD11 H 5.626 -8.464 -1.433 1.00 . A A . 8 LEU HD11 1 1
14 3378 1 1 8 LEU HD12 H 4.535 -7.866 -0.158 1.00 . A A . 8 LEU HD12 1 1
14 3379 1 1 8 LEU HD13 H 4.414 -9.550 -0.721 1.00 . A A . 8 LEU HD13 1 1
14 3380 1 1 8 LEU HD21 H 1.390 -7.928 -2.398 1.00 . A A . 8 LEU HD21 1 1
14 3381 1 1 8 LEU HD22 H 1.894 -9.280 -1.365 1.00 . A A . 8 LEU HD22 1 1
14 3382 1 1 8 LEU HD23 H 1.925 -7.625 -0.727 1.00 . A A . 8 LEU HD23 1 1
14 3383 1 1 8 LEU HG H 3.672 -8.821 -2.955 1.00 . A A . 8 LEU HG 1 1
14 3384 1 1 8 LEU N N 2.851 -5.057 -1.155 1.00 . A A . 8 LEU N 1 1
14 3385 1 1 8 LEU O O 4.798 -4.230 -3.898 1.00 . A A . 8 LEU O 1 1
14 3386 1 1 9 ABA C C 4.823 -0.867 -3.184 1.00 . A A . 9 ABA C 1 1
14 3387 1 1 9 ABA CA C 5.686 -1.939 -2.439 1.00 . A A . 9 ABA CA 1 1
14 3388 1 1 9 ABA CB C 6.506 -1.331 -1.255 1.00 . A A . 9 ABA CB 1 1
14 3389 1 1 9 ABA CG C 7.761 -2.157 -0.914 1.00 . A A . 9 ABA CG 1 1
14 3390 1 1 9 ABA H H 4.763 -3.241 -0.925 1.00 . A A . 9 ABA H 1 1
14 3391 1 1 9 ABA HA H 6.421 -2.272 -3.199 1.00 . A A . 9 ABA HA 1 1
14 3392 1 1 9 ABA HB2 H 6.855 -0.315 -1.518 1.00 . A A . 9 ABA HB2 1 1
14 3393 1 1 9 ABA HG1 H 7.497 -3.182 -0.588 1.00 . A A . 9 ABA HG1 1 1
14 3394 1 1 9 ABA HG2 H 8.333 -1.694 -0.091 1.00 . A A . 9 ABA HG2 1 1
14 3395 1 1 9 ABA HG3 H 8.438 -2.253 -1.782 1.00 . A A . 9 ABA HG3 1 1
14 3396 1 1 9 ABA N N 4.988 -3.144 -1.921 1.00 . A A . 9 ABA N 1 1
14 3397 1 1 9 ABA O O 5.429 0.034 -3.772 1.00 . A A . 9 ABA O 1 1
14 3398 1 1 10 ILE C C 1.359 0.197 -2.936 1.00 . A A . 10 ILE C 1 1
14 3399 1 1 10 ILE CA C 2.608 0.079 -3.863 1.00 . A A . 10 ILE CA 1 1
14 3400 1 1 10 ILE CB C 2.181 -0.226 -5.357 1.00 . A A . 10 ILE CB 1 1
14 3401 1 1 10 ILE CD1 C 3.741 -2.085 -6.375 1.00 . A A . 10 ILE CD1 1 1
14 3402 1 1 10 ILE CG1 C 3.286 -0.618 -6.397 1.00 . A A . 10 ILE CG1 1 1
14 3403 1 1 10 ILE CG2 C 1.409 0.985 -5.950 1.00 . A A . 10 ILE CG2 1 1
14 3404 1 1 10 ILE H H 3.063 -1.711 -2.668 1.00 . A A . 10 ILE H 1 1
14 3405 1 1 10 ILE HA H 3.147 1.052 -3.836 1.00 . A A . 10 ILE HA 1 1
14 3406 1 1 10 ILE HB H 1.464 -1.069 -5.330 1.00 . A A . 10 ILE HB 1 1
14 3407 1 1 10 ILE HD11 H 2.886 -2.783 -6.442 1.00 . A A . 10 ILE HD11 1 1
14 3408 1 1 10 ILE HD12 H 4.408 -2.303 -7.228 1.00 . A A . 10 ILE HD12 1 1
14 3409 1 1 10 ILE HD13 H 4.306 -2.333 -5.464 1.00 . A A . 10 ILE HD13 1 1
14 3410 1 1 10 ILE HG12 H 2.916 -0.462 -7.432 1.00 . A A . 10 ILE HG12 1 1
14 3411 1 1 10 ILE HG13 H 4.165 0.046 -6.319 1.00 . A A . 10 ILE HG13 1 1
14 3412 1 1 10 ILE HG21 H 0.528 1.258 -5.342 1.00 . A A . 10 ILE HG21 1 1
14 3413 1 1 10 ILE HG22 H 2.047 1.887 -6.021 1.00 . A A . 10 ILE HG22 1 1
14 3414 1 1 10 ILE HG23 H 1.021 0.775 -6.965 1.00 . A A . 10 ILE HG23 1 1
14 3415 1 1 10 ILE N N 3.471 -0.946 -3.216 1.00 . A A . 10 ILE N 1 1
14 3416 1 1 10 ILE O O 0.534 -0.719 -2.859 1.00 . A A . 10 ILE O 1 1
14 3417 1 1 11 GLU C C -0.383 0.823 -0.352 1.00 . A A . 11 GLU C 1 1
14 3418 1 1 11 GLU CA C -0.014 1.788 -1.536 1.00 . A A . 11 GLU CA 1 1
14 3419 1 1 11 GLU CB C -1.143 2.190 -2.550 1.00 . A A . 11 GLU CB 1 1
14 3420 1 1 11 GLU CD C -3.457 3.216 -3.018 1.00 . A A . 11 GLU CD 1 1
14 3421 1 1 11 GLU CG C -2.542 2.544 -1.989 1.00 . A A . 11 GLU CG 1 1
14 3422 1 1 11 GLU H H 2.066 1.940 -2.312 1.00 . A A . 11 GLU H 1 1
14 3423 1 1 11 GLU HA H 0.246 2.747 -1.048 1.00 . A A . 11 GLU HA 1 1
14 3424 1 1 11 GLU HB2 H -0.850 3.075 -3.155 1.00 . A A . 11 GLU HB2 1 1
14 3425 1 1 11 GLU HB3 H -1.216 1.376 -3.288 1.00 . A A . 11 GLU HB3 1 1
14 3426 1 1 11 GLU HE2 H -4.539 2.747 -4.566 1.00 . A A . 11 GLU HE2 1 1
14 3427 1 1 11 GLU HG2 H -3.056 1.643 -1.612 1.00 . A A . 11 GLU HG2 1 1
14 3428 1 1 11 GLU HG3 H -2.434 3.216 -1.117 1.00 . A A . 11 GLU HG3 1 1
14 3429 1 1 11 GLU N N 1.213 1.370 -2.288 1.00 . A A . 11 GLU N 1 1
14 3430 1 1 11 GLU O O -1.523 0.383 -0.230 1.00 . A A . 11 GLU O 1 1
14 3431 1 1 11 GLU OE1 O -3.705 4.421 -3.018 1.00 . A A . 11 GLU OE1 1 1
14 3432 1 1 11 GLU OE2 O -3.965 2.322 -3.925 1.00 . A A . 11 GLU OE2 1 1
14 3433 1 1 12 CYS C C -0.358 0.806 2.939 1.00 . A A . 12 CYS C 1 1
14 3434 1 1 12 CYS CA C 0.330 -0.104 1.872 1.00 . A A . 12 CYS CA 1 1
14 3435 1 1 12 CYS CB C 1.672 -0.604 2.481 1.00 . A A . 12 CYS CB 1 1
14 3436 1 1 12 CYS H H 1.425 1.100 0.392 1.00 . A A . 12 CYS H 1 1
14 3437 1 1 12 CYS HA H -0.319 -0.981 1.708 1.00 . A A . 12 CYS HA 1 1
14 3438 1 1 12 CYS HB2 H 2.417 0.214 2.447 1.00 . A A . 12 CYS HB2 1 1
14 3439 1 1 12 CYS HB3 H 1.580 -0.880 3.549 1.00 . A A . 12 CYS HB3 1 1
14 3440 1 1 12 CYS N N 0.576 0.569 0.561 1.00 . A A . 12 CYS N 1 1
14 3441 1 1 12 CYS O O -1.060 0.273 3.805 1.00 . A A . 12 CYS O 1 1
14 3442 1 1 12 CYS SG S 2.432 -1.993 1.600 1.00 . A A . 12 CYS SG 1 1
14 3443 1 1 13 GLY C C -0.759 4.565 3.558 1.00 . A A . 13 GLY C 1 1
14 3444 1 1 13 GLY CA C -0.685 3.064 3.921 1.00 . A A . 13 GLY CA 1 1
14 3445 1 1 13 GLY H H 0.433 2.433 2.100 1.00 . A A . 13 GLY H 1 1
14 3446 1 1 13 GLY HA2 H -1.701 2.739 4.217 1.00 . A A . 13 GLY HA2 1 1
14 3447 1 1 13 GLY HA3 H -0.075 2.966 4.839 1.00 . A A . 13 GLY HA3 1 1
14 3448 1 1 13 GLY N N -0.146 2.137 2.899 1.00 . A A . 13 GLY N 1 1
14 3449 1 1 13 GLY O O -1.655 5.240 4.071 1.00 . A A . 13 GLY O 1 1
14 3450 1 1 14 ABA C C 1.924 6.991 2.803 1.00 . A A . 14 ABA C 1 1
14 3451 1 1 14 ABA CA C 0.409 6.586 2.646 1.00 . A A . 14 ABA CA 1 1
14 3452 1 1 14 ABA CB C -0.309 7.257 1.414 1.00 . A A . 14 ABA CB 1 1
14 3453 1 1 14 ABA CG C -1.684 6.706 0.991 1.00 . A A . 14 ABA CG 1 1
14 3454 1 1 14 ABA H H 0.859 4.442 2.374 1.00 . A A . 14 ABA H 1 1
14 3455 1 1 14 ABA HA H -0.060 7.060 3.530 1.00 . A A . 14 ABA HA 1 1
14 3456 1 1 14 ABA HB2 H -0.490 8.306 1.717 1.00 . A A . 14 ABA HB2 1 1
14 3457 1 1 14 ABA HG1 H -1.609 5.662 0.631 1.00 . A A . 14 ABA HG1 1 1
14 3458 1 1 14 ABA HG2 H -2.116 7.302 0.168 1.00 . A A . 14 ABA HG2 1 1
14 3459 1 1 14 ABA HG3 H -2.401 6.716 1.831 1.00 . A A . 14 ABA HG3 1 1
14 3460 1 1 14 ABA N N 0.181 5.108 2.754 1.00 . A A . 14 ABA N 1 1
14 3461 1 1 14 ABA O O 2.305 8.088 2.381 1.00 . A A . 14 ABA O 1 1
14 3462 1 1 15 VAL C C 5.162 5.307 3.539 1.00 . A A . 15 VAL C 1 1
14 3463 1 1 15 VAL CA C 4.188 6.503 3.824 1.00 . A A . 15 VAL CA 1 1
14 3464 1 1 15 VAL CB C 4.317 7.055 5.297 1.00 . A A . 15 VAL CB 1 1
14 3465 1 1 15 VAL CG1 C 5.767 7.435 5.695 1.00 . A A . 15 VAL CG1 1 1
14 3466 1 1 15 VAL CG2 C 3.430 8.288 5.599 1.00 . A A . 15 VAL CG2 1 1
14 3467 1 1 15 VAL H H 2.348 5.267 3.737 1.00 . A A . 15 VAL H 1 1
14 3468 1 1 15 VAL HA H 4.530 7.300 3.146 1.00 . A A . 15 VAL HA 1 1
14 3469 1 1 15 VAL HB H 3.996 6.252 5.988 1.00 . A A . 15 VAL HB 1 1
14 3470 1 1 15 VAL HG11 H 6.184 8.221 5.039 1.00 . A A . 15 VAL HG11 1 1
14 3471 1 1 15 VAL HG12 H 5.829 7.805 6.736 1.00 . A A . 15 VAL HG12 1 1
14 3472 1 1 15 VAL HG13 H 6.450 6.568 5.639 1.00 . A A . 15 VAL HG13 1 1
14 3473 1 1 15 VAL HG21 H 3.659 9.138 4.929 1.00 . A A . 15 VAL HG21 1 1
14 3474 1 1 15 VAL HG22 H 2.355 8.061 5.480 1.00 . A A . 15 VAL HG22 1 1
14 3475 1 1 15 VAL HG23 H 3.552 8.645 6.639 1.00 . A A . 15 VAL HG23 1 1
14 3476 1 1 15 VAL N N 2.772 6.163 3.468 1.00 . A A . 15 VAL N 1 1
14 3477 1 1 15 VAL O O 6.223 5.521 2.946 1.00 . A A . 15 VAL O 1 1
14 3478 1 1 16 ILE C C 6.250 2.383 2.755 1.00 . A A . 16 ILE C 1 1
14 3479 1 1 16 ILE CA C 5.805 2.945 4.146 1.00 . A A . 16 ILE CA 1 1
14 3480 1 1 16 ILE CB C 5.220 1.899 5.178 1.00 . A A . 16 ILE CB 1 1
14 3481 1 1 16 ILE CD1 C 6.467 2.765 7.353 1.00 . A A . 16 ILE CD1 1 1
14 3482 1 1 16 ILE CG1 C 5.142 2.422 6.648 1.00 . A A . 16 ILE CG1 1 1
14 3483 1 1 16 ILE CG2 C 5.873 0.492 5.152 1.00 . A A . 16 ILE CG2 1 1
14 3484 1 1 16 ILE H H 3.878 4.038 4.353 1.00 . A A . 16 ILE H 1 1
14 3485 1 1 16 ILE HA H 6.733 3.346 4.599 1.00 . A A . 16 ILE HA 1 1
14 3486 1 1 16 ILE HB H 4.168 1.714 4.894 1.00 . A A . 16 ILE HB 1 1
14 3487 1 1 16 ILE HD11 H 7.150 1.897 7.395 1.00 . A A . 16 ILE HD11 1 1
14 3488 1 1 16 ILE HD12 H 7.003 3.590 6.850 1.00 . A A . 16 ILE HD12 1 1
14 3489 1 1 16 ILE HD13 H 6.287 3.087 8.394 1.00 . A A . 16 ILE HD13 1 1
14 3490 1 1 16 ILE HG12 H 4.494 3.318 6.682 1.00 . A A . 16 ILE HG12 1 1
14 3491 1 1 16 ILE HG13 H 4.603 1.681 7.268 1.00 . A A . 16 ILE HG13 1 1
14 3492 1 1 16 ILE HG21 H 6.957 0.526 5.361 1.00 . A A . 16 ILE HG21 1 1
14 3493 1 1 16 ILE HG22 H 5.411 -0.192 5.889 1.00 . A A . 16 ILE HG22 1 1
14 3494 1 1 16 ILE HG23 H 5.745 0.001 4.169 1.00 . A A . 16 ILE HG23 1 1
14 3495 1 1 16 ILE N N 4.845 4.090 4.024 1.00 . A A . 16 ILE N 1 1
14 3496 1 1 16 ILE O O 7.439 2.443 2.430 1.00 . A A . 16 ILE O 1 1
14 3497 1 1 17 CYS C C 5.443 2.787 -0.396 1.00 . A A . 17 CYS C 1 1
14 3498 1 1 17 CYS CA C 5.552 1.524 0.516 1.00 . A A . 17 CYS CA 1 1
14 3499 1 1 17 CYS CB C 4.624 0.315 0.190 1.00 . A A . 17 CYS CB 1 1
14 3500 1 1 17 CYS H H 4.352 1.991 2.312 1.00 . A A . 17 CYS H 1 1
14 3501 1 1 17 CYS HA H 6.585 1.169 0.359 1.00 . A A . 17 CYS HA 1 1
14 3502 1 1 17 CYS HB2 H 3.765 0.233 0.875 1.00 . A A . 17 CYS HB2 1 1
14 3503 1 1 17 CYS HB3 H 4.144 0.379 -0.796 1.00 . A A . 17 CYS HB3 1 1
14 3504 1 1 17 CYS N N 5.304 1.877 1.944 1.00 . A A . 17 CYS N 1 1
14 3505 1 1 17 CYS O O 5.516 3.928 0.076 1.00 . A A . 17 CYS O 1 1
14 3506 1 1 17 CYS SG S 5.541 -1.240 0.291 1.00 . A A . 17 CYS SG 1 1
14 3507 1 1 18 ALA C C 3.331 3.866 -2.697 1.00 . A A . 18 ALA C 1 1
14 3508 1 1 18 ALA CA C 4.869 3.661 -2.658 1.00 . A A . 18 ALA CA 1 1
14 3509 1 1 18 ALA CB C 5.499 3.406 -4.041 1.00 . A A . 18 ALA CB 1 1
14 3510 1 1 18 ALA H H 5.359 1.585 -1.954 1.00 . A A . 18 ALA H 1 1
14 3511 1 1 18 ALA HA H 5.231 4.657 -2.321 1.00 . A A . 18 ALA HA 1 1
14 3512 1 1 18 ALA HB1 H 6.600 3.310 -3.984 1.00 . A A . 18 ALA HB1 1 1
14 3513 1 1 18 ALA HB2 H 5.109 2.488 -4.517 1.00 . A A . 18 ALA HB2 1 1
14 3514 1 1 18 ALA HB3 H 5.291 4.241 -4.737 1.00 . A A . 18 ALA HB3 1 1
14 3515 1 1 18 ALA N N 5.301 2.582 -1.716 1.00 . A A . 18 ALA N 1 1
14 3516 1 1 18 ALA O O 2.670 3.866 -3.739 1.00 . A A . 18 ALA O 1 1
14 3517 1 1 19 CYS C C 3.445 6.189 -0.292 1.00 . A A . 19 CYS C 1 1
14 3518 1 1 19 CYS CA C 2.425 5.636 -1.301 1.00 . A A . 19 CYS CA 1 1
14 3519 1 1 19 CYS CB C 0.993 5.737 -0.693 1.00 . A A . 19 CYS CB 1 1
14 3520 1 1 19 CYS H H 3.382 3.865 -0.775 1.00 . A A . 19 CYS H 1 1
14 3521 1 1 19 CYS HXT H 4.137 5.879 1.526 1.00 . A A . 19 CYS HXT 1 1
14 3522 1 1 19 CYS HA H 2.608 6.194 -2.246 1.00 . A A . 19 CYS HA 1 1
14 3523 1 1 19 CYS HB2 H 0.141 5.454 -1.357 1.00 . A A . 19 CYS HB2 1 1
14 3524 1 1 19 CYS HB3 H 0.909 5.040 0.160 1.00 . A A . 19 CYS HB3 1 1
14 3525 1 1 19 CYS N N 2.790 4.233 -1.526 1.00 . A A . 19 CYS N 1 1
14 3526 1 1 19 CYS O O 4.171 7.155 -0.524 1.00 . A A . 19 CYS O 1 1
14 3527 1 1 19 CYS OXT O 3.482 5.481 0.948 1.00 . A A . 19 CYS OXT 1 1
14 3528 1 1 19 CYS SG S 0.722 7.417 -0.078 1.00 . A A . 19 CYS SG 1 1
15 3529 1 1 1 DAL C C -6.099 0.351 2.072 1.00 . A A . 1 DAL C 1 1
15 3530 1 1 1 DAL CA C -5.190 -0.863 2.448 1.00 . A A . 1 DAL CA 1 1
15 3531 1 1 1 DAL CB C -3.687 -0.665 2.151 1.00 . A A . 1 DAL CB 1 1
15 3532 1 1 1 DAL H1 H -4.791 -2.119 4.044 1.00 . A A . 1 DAL H1 1 1
15 3533 1 1 1 DAL H2 H -6.306 -1.505 4.068 1.00 . A A . 1 DAL H2 1 1
15 3534 1 1 1 DAL HA H -5.538 -1.719 1.839 1.00 . A A . 1 DAL HA 1 1
15 3535 1 1 1 DAL HB1 H -3.239 0.107 2.805 1.00 . A A . 1 DAL HB1 1 1
15 3536 1 1 1 DAL HB2 H -3.555 -0.305 1.119 1.00 . A A . 1 DAL HB2 1 1
15 3537 1 1 1 DAL N N -5.330 -1.264 3.866 1.00 . A A . 1 DAL N 1 1
15 3538 1 1 1 DAL O O -6.902 0.844 2.873 1.00 . A A . 1 DAL O 1 1
15 3539 1 1 2 SER C C -8.005 0.531 -0.677 1.00 . A A . 2 SER C 1 1
15 3540 1 1 2 SER CA C -7.103 1.537 0.110 1.00 . A A . 2 SER CA 1 1
15 3541 1 1 2 SER CB C -6.428 2.607 -0.778 1.00 . A A . 2 SER CB 1 1
15 3542 1 1 2 SER H H -5.303 0.296 0.245 1.00 . A A . 2 SER H 1 1
15 3543 1 1 2 SER HA H -7.718 2.091 0.848 1.00 . A A . 2 SER HA 1 1
15 3544 1 1 2 SER HB2 H -5.750 3.246 -0.181 1.00 . A A . 2 SER HB2 1 1
15 3545 1 1 2 SER HB3 H -5.802 2.137 -1.558 1.00 . A A . 2 SER HB3 1 1
15 3546 1 1 2 SER HG H -6.911 4.074 -1.924 1.00 . A A . 2 SER HG 1 1
15 3547 1 1 2 SER N N -6.030 0.761 0.789 1.00 . A A . 2 SER N 1 1
15 3548 1 1 2 SER O O -7.931 0.402 -1.904 1.00 . A A . 2 SER O 1 1
15 3549 1 1 2 SER OG O -7.402 3.439 -1.397 1.00 . A A . 2 SER OG 1 1
15 3550 1 1 3 GLY C C -8.478 -2.661 -0.028 1.00 . A A . 3 GLY C 1 1
15 3551 1 1 3 GLY CA C -9.427 -1.488 -0.379 1.00 . A A . 3 GLY CA 1 1
15 3552 1 1 3 GLY H H -8.525 -0.132 1.077 1.00 . A A . 3 GLY H 1 1
15 3553 1 1 3 GLY HA2 H -10.389 -1.612 0.162 1.00 . A A . 3 GLY HA2 1 1
15 3554 1 1 3 GLY HA3 H -9.709 -1.439 -1.448 1.00 . A A . 3 GLY HA3 1 1
15 3555 1 1 3 GLY N N -8.805 -0.227 0.093 1.00 . A A . 3 GLY N 1 1
15 3556 1 1 3 GLY O O -8.204 -2.852 1.163 1.00 . A A . 3 GLY O 1 1
15 3557 1 1 4 TRP C C -5.827 -4.052 -2.165 1.00 . A A . 4 TRP C 1 1
15 3558 1 1 4 TRP CA C -6.626 -4.119 -0.826 1.00 . A A . 4 TRP CA 1 1
15 3559 1 1 4 TRP CB C -6.760 -5.580 -0.335 1.00 . A A . 4 TRP CB 1 1
15 3560 1 1 4 TRP CD1 C -8.738 -6.287 1.235 1.00 . A A . 4 TRP CD1 1 1
15 3561 1 1 4 TRP CD2 C -6.909 -5.586 2.292 1.00 . A A . 4 TRP CD2 1 1
15 3562 1 1 4 TRP CE2 C -7.914 -5.899 3.242 1.00 . A A . 4 TRP CE2 1 1
15 3563 1 1 4 TRP CE3 C -5.653 -5.086 2.715 1.00 . A A . 4 TRP CE3 1 1
15 3564 1 1 4 TRP CG C -7.423 -5.821 1.028 1.00 . A A . 4 TRP CG 1 1
15 3565 1 1 4 TRP CH2 C -6.420 -5.219 5.021 1.00 . A A . 4 TRP CH2 1 1
15 3566 1 1 4 TRP CZ2 C -7.665 -5.710 4.625 1.00 . A A . 4 TRP CZ2 1 1
15 3567 1 1 4 TRP CZ3 C -5.429 -4.913 4.080 1.00 . A A . 4 TRP CZ3 1 1
15 3568 1 1 4 TRP H H -8.207 -3.223 -1.987 1.00 . A A . 4 TRP H 1 1
15 3569 1 1 4 TRP HA H -6.037 -3.597 -0.053 1.00 . A A . 4 TRP HA 1 1
15 3570 1 1 4 TRP HB2 H -7.309 -6.083 -1.126 1.00 . A A . 4 TRP HB2 1 1
15 3571 1 1 4 TRP HB3 H -5.770 -6.079 -0.325 1.00 . A A . 4 TRP HB3 1 1
15 3572 1 1 4 TRP HD1 H -9.427 -6.543 0.444 1.00 . A A . 4 TRP HD1 1 1
15 3573 1 1 4 TRP HE1 H -9.958 -6.626 3.020 1.00 . A A . 4 TRP HE1 1 1
15 3574 1 1 4 TRP HE3 H -4.886 -4.840 1.998 1.00 . A A . 4 TRP HE3 1 1
15 3575 1 1 4 TRP HH2 H -6.218 -5.069 6.072 1.00 . A A . 4 TRP HH2 1 1
15 3576 1 1 4 TRP HZ2 H -8.419 -5.934 5.368 1.00 . A A . 4 TRP HZ2 1 1
15 3577 1 1 4 TRP HZ3 H -4.476 -4.530 4.416 1.00 . A A . 4 TRP HZ3 1 1
15 3578 1 1 4 TRP N N -7.914 -3.393 -1.019 1.00 . A A . 4 TRP N 1 1
15 3579 1 1 4 TRP NE1 N -9.063 -6.343 2.603 1.00 . A A . 4 TRP NE1 1 1
15 3580 1 1 4 TRP O O -5.663 -5.031 -2.901 1.00 . A A . 4 TRP O 1 1
15 3581 1 1 5 VAL C C -2.835 -3.098 -2.587 1.00 . A A . 5 VAL C 1 1
15 3582 1 1 5 VAL CA C -4.117 -2.653 -3.349 1.00 . A A . 5 VAL CA 1 1
15 3583 1 1 5 VAL CB C -4.108 -1.255 -4.068 1.00 . A A . 5 VAL CB 1 1
15 3584 1 1 5 VAL CG1 C -2.929 -1.120 -5.063 1.00 . A A . 5 VAL CG1 1 1
15 3585 1 1 5 VAL CG2 C -5.418 -0.950 -4.833 1.00 . A A . 5 VAL CG2 1 1
15 3586 1 1 5 VAL H H -5.615 -2.183 -1.737 1.00 . A A . 5 VAL H 1 1
15 3587 1 1 5 VAL HA H -4.203 -3.373 -4.163 1.00 . A A . 5 VAL HA 1 1
15 3588 1 1 5 VAL HB H -3.994 -0.447 -3.324 1.00 . A A . 5 VAL HB 1 1
15 3589 1 1 5 VAL HG11 H -1.952 -1.227 -4.558 1.00 . A A . 5 VAL HG11 1 1
15 3590 1 1 5 VAL HG12 H -2.968 -1.885 -5.861 1.00 . A A . 5 VAL HG12 1 1
15 3591 1 1 5 VAL HG13 H -2.916 -0.130 -5.557 1.00 . A A . 5 VAL HG13 1 1
15 3592 1 1 5 VAL HG21 H -5.626 -1.700 -5.619 1.00 . A A . 5 VAL HG21 1 1
15 3593 1 1 5 VAL HG22 H -6.292 -0.935 -4.156 1.00 . A A . 5 VAL HG22 1 1
15 3594 1 1 5 VAL HG23 H -5.388 0.042 -5.322 1.00 . A A . 5 VAL HG23 1 1
15 3595 1 1 5 VAL N N -5.264 -2.861 -2.411 1.00 . A A . 5 VAL N 1 1
15 3596 1 1 5 VAL O O -2.356 -4.207 -2.835 1.00 . A A . 5 VAL O 1 1
15 3597 1 1 6 CYS C C -0.848 -3.948 -0.265 1.00 . A A . 6 CYS C 1 1
15 3598 1 1 6 CYS CA C -1.866 -2.763 -0.301 1.00 . A A . 6 CYS CA 1 1
15 3599 1 1 6 CYS CB C -3.003 -3.027 0.718 1.00 . A A . 6 CYS CB 1 1
15 3600 1 1 6 CYS H H -2.761 -1.349 -1.704 1.00 . A A . 6 CYS H 1 1
15 3601 1 1 6 CYS HA H -1.398 -1.838 0.088 1.00 . A A . 6 CYS HA 1 1
15 3602 1 1 6 CYS HB2 H -3.991 -2.740 0.332 1.00 . A A . 6 CYS HB2 1 1
15 3603 1 1 6 CYS HB3 H -3.061 -4.104 0.917 1.00 . A A . 6 CYS HB3 1 1
15 3604 1 1 6 CYS N N -2.376 -2.292 -1.618 1.00 . A A . 6 CYS N 1 1
15 3605 1 1 6 CYS O O -1.110 -5.101 -0.622 1.00 . A A . 6 CYS O 1 1
15 3606 1 1 6 CYS SG S -2.751 -2.207 2.315 1.00 . A A . 6 CYS SG 1 1
15 3607 1 1 7 ABA C C 2.326 -5.230 0.432 1.00 . A A . 7 ABA C 1 1
15 3608 1 1 7 ABA CA C 1.108 -4.550 1.134 1.00 . A A . 7 ABA CA 1 1
15 3609 1 1 7 ABA CB C 1.545 -3.665 2.347 1.00 . A A . 7 ABA CB 1 1
15 3610 1 1 7 ABA CG C 0.382 -3.480 3.356 1.00 . A A . 7 ABA CG 1 1
15 3611 1 1 7 ABA H H 0.065 -2.702 0.775 1.00 . A A . 7 ABA H 1 1
15 3612 1 1 7 ABA HA H 0.483 -5.384 1.513 1.00 . A A . 7 ABA HA 1 1
15 3613 1 1 7 ABA HB2 H 2.371 -4.146 2.907 1.00 . A A . 7 ABA HB2 1 1
15 3614 1 1 7 ABA HG1 H 0.685 -2.939 4.266 1.00 . A A . 7 ABA HG1 1 1
15 3615 1 1 7 ABA HG2 H -0.457 -2.924 2.908 1.00 . A A . 7 ABA HG2 1 1
15 3616 1 1 7 ABA HG3 H -0.040 -4.453 3.673 1.00 . A A . 7 ABA HG3 1 1
15 3617 1 1 7 ABA N N 0.266 -3.609 0.347 1.00 . A A . 7 ABA N 1 1
15 3618 1 1 7 ABA O O 3.057 -5.958 1.112 1.00 . A A . 7 ABA O 1 1
15 3619 1 1 8 LEU C C 4.289 -4.186 -2.438 1.00 . A A . 8 LEU C 1 1
15 3620 1 1 8 LEU CA C 3.862 -5.372 -1.526 1.00 . A A . 8 LEU CA 1 1
15 3621 1 1 8 LEU CB C 3.832 -6.776 -2.218 1.00 . A A . 8 LEU CB 1 1
15 3622 1 1 8 LEU CD1 C 6.220 -7.612 -1.663 1.00 . A A . 8 LEU CD1 1 1
15 3623 1 1 8 LEU CD2 C 4.961 -8.578 -3.624 1.00 . A A . 8 LEU CD2 1 1
15 3624 1 1 8 LEU CG C 5.186 -7.314 -2.769 1.00 . A A . 8 LEU CG 1 1
15 3625 1 1 8 LEU H H 1.906 -4.337 -1.281 1.00 . A A . 8 LEU H 1 1
15 3626 1 1 8 LEU HA H 4.643 -5.436 -0.739 1.00 . A A . 8 LEU HA 1 1
15 3627 1 1 8 LEU HB2 H 3.436 -7.538 -1.516 1.00 . A A . 8 LEU HB2 1 1
15 3628 1 1 8 LEU HB3 H 3.098 -6.761 -3.048 1.00 . A A . 8 LEU HB3 1 1
15 3629 1 1 8 LEU HD11 H 5.847 -8.353 -0.933 1.00 . A A . 8 LEU HD11 1 1
15 3630 1 1 8 LEU HD12 H 7.164 -8.010 -2.082 1.00 . A A . 8 LEU HD12 1 1
15 3631 1 1 8 LEU HD13 H 6.493 -6.702 -1.098 1.00 . A A . 8 LEU HD13 1 1
15 3632 1 1 8 LEU HD21 H 4.273 -8.381 -4.468 1.00 . A A . 8 LEU HD21 1 1
15 3633 1 1 8 LEU HD22 H 5.905 -8.946 -4.067 1.00 . A A . 8 LEU HD22 1 1
15 3634 1 1 8 LEU HD23 H 4.528 -9.408 -3.035 1.00 . A A . 8 LEU HD23 1 1
15 3635 1 1 8 LEU HG H 5.622 -6.550 -3.439 1.00 . A A . 8 LEU HG 1 1
15 3636 1 1 8 LEU N N 2.557 -5.027 -0.881 1.00 . A A . 8 LEU N 1 1
15 3637 1 1 8 LEU O O 4.245 -4.254 -3.671 1.00 . A A . 8 LEU O 1 1
15 3638 1 1 9 ABA C C 4.525 -0.906 -3.189 1.00 . A A . 9 ABA C 1 1
15 3639 1 1 9 ABA CA C 5.412 -1.946 -2.429 1.00 . A A . 9 ABA CA 1 1
15 3640 1 1 9 ABA CB C 6.309 -1.268 -1.344 1.00 . A A . 9 ABA CB 1 1
15 3641 1 1 9 ABA CG C 7.602 -2.055 -1.059 1.00 . A A . 9 ABA CG 1 1
15 3642 1 1 9 ABA H H 4.634 -3.153 -0.762 1.00 . A A . 9 ABA H 1 1
15 3643 1 1 9 ABA HA H 6.091 -2.351 -3.207 1.00 . A A . 9 ABA HA 1 1
15 3644 1 1 9 ABA HB2 H 6.620 -0.260 -1.681 1.00 . A A . 9 ABA HB2 1 1
15 3645 1 1 9 ABA HG1 H 7.384 -3.069 -0.671 1.00 . A A . 9 ABA HG1 1 1
15 3646 1 1 9 ABA HG2 H 8.220 -1.544 -0.300 1.00 . A A . 9 ABA HG2 1 1
15 3647 1 1 9 ABA HG3 H 8.219 -2.174 -1.968 1.00 . A A . 9 ABA HG3 1 1
15 3648 1 1 9 ABA N N 4.727 -3.097 -1.782 1.00 . A A . 9 ABA N 1 1
15 3649 1 1 9 ABA O O 5.090 -0.120 -3.954 1.00 . A A . 9 ABA O 1 1
15 3650 1 1 10 ILE C C 1.097 0.269 -2.747 1.00 . A A . 10 ILE C 1 1
15 3651 1 1 10 ILE CA C 2.276 0.034 -3.743 1.00 . A A . 10 ILE CA 1 1
15 3652 1 1 10 ILE CB C 1.746 -0.504 -5.137 1.00 . A A . 10 ILE CB 1 1
15 3653 1 1 10 ILE CD1 C 2.080 -2.010 -7.269 1.00 . A A . 10 ILE CD1 1 1
15 3654 1 1 10 ILE CG1 C 2.728 -1.314 -6.059 1.00 . A A . 10 ILE CG1 1 1
15 3655 1 1 10 ILE CG2 C 1.102 0.671 -5.919 1.00 . A A . 10 ILE CG2 1 1
15 3656 1 1 10 ILE H H 2.824 -1.579 -2.356 1.00 . A A . 10 ILE H 1 1
15 3657 1 1 10 ILE HA H 2.796 1.014 -3.875 1.00 . A A . 10 ILE HA 1 1
15 3658 1 1 10 ILE HB H 0.940 -1.224 -4.902 1.00 . A A . 10 ILE HB 1 1
15 3659 1 1 10 ILE HD11 H 1.248 -2.671 -6.963 1.00 . A A . 10 ILE HD11 1 1
15 3660 1 1 10 ILE HD12 H 1.683 -1.287 -8.004 1.00 . A A . 10 ILE HD12 1 1
15 3661 1 1 10 ILE HD13 H 2.816 -2.639 -7.804 1.00 . A A . 10 ILE HD13 1 1
15 3662 1 1 10 ILE HG12 H 3.564 -0.691 -6.425 1.00 . A A . 10 ILE HG12 1 1
15 3663 1 1 10 ILE HG13 H 3.211 -2.131 -5.488 1.00 . A A . 10 ILE HG13 1 1
15 3664 1 1 10 ILE HG21 H 0.352 1.213 -5.313 1.00 . A A . 10 ILE HG21 1 1
15 3665 1 1 10 ILE HG22 H 1.857 1.414 -6.239 1.00 . A A . 10 ILE HG22 1 1
15 3666 1 1 10 ILE HG23 H 0.568 0.332 -6.824 1.00 . A A . 10 ILE HG23 1 1
15 3667 1 1 10 ILE N N 3.184 -0.901 -3.031 1.00 . A A . 10 ILE N 1 1
15 3668 1 1 10 ILE O O 0.241 -0.605 -2.563 1.00 . A A . 10 ILE O 1 1
15 3669 1 1 11 GLU C C -0.483 0.980 -0.104 1.00 . A A . 11 GLU C 1 1
15 3670 1 1 11 GLU CA C -0.044 1.951 -1.254 1.00 . A A . 11 GLU CA 1 1
15 3671 1 1 11 GLU CB C -1.155 2.644 -2.116 1.00 . A A . 11 GLU CB 1 1
15 3672 1 1 11 GLU CD C -3.099 2.512 -3.778 1.00 . A A . 11 GLU CD 1 1
15 3673 1 1 11 GLU CG C -2.136 1.733 -2.878 1.00 . A A . 11 GLU CG 1 1
15 3674 1 1 11 GLU H H 1.881 2.059 -2.268 1.00 . A A . 11 GLU H 1 1
15 3675 1 1 11 GLU HA H 0.410 2.797 -0.687 1.00 . A A . 11 GLU HA 1 1
15 3676 1 1 11 GLU HB2 H -1.730 3.309 -1.448 1.00 . A A . 11 GLU HB2 1 1
15 3677 1 1 11 GLU HB3 H -0.711 3.331 -2.876 1.00 . A A . 11 GLU HB3 1 1
15 3678 1 1 11 GLU HE2 H -3.214 3.154 -5.612 1.00 . A A . 11 GLU HE2 1 1
15 3679 1 1 11 GLU HG2 H -1.574 1.012 -3.497 1.00 . A A . 11 GLU HG2 1 1
15 3680 1 1 11 GLU HG3 H -2.722 1.126 -2.166 1.00 . A A . 11 GLU HG3 1 1
15 3681 1 1 11 GLU N N 1.058 1.467 -2.130 1.00 . A A . 11 GLU N 1 1
15 3682 1 1 11 GLU O O -1.667 0.708 0.084 1.00 . A A . 11 GLU O 1 1
15 3683 1 1 11 GLU OE1 O -4.184 2.948 -3.396 1.00 . A A . 11 GLU OE1 1 1
15 3684 1 1 11 GLU OE2 O -2.609 2.665 -5.050 1.00 . A A . 11 GLU OE2 1 1
15 3685 1 1 12 CYS C C -0.208 0.912 3.156 1.00 . A A . 12 CYS C 1 1
15 3686 1 1 12 CYS CA C 0.285 -0.074 2.047 1.00 . A A . 12 CYS CA 1 1
15 3687 1 1 12 CYS CB C 1.629 -0.669 2.569 1.00 . A A . 12 CYS CB 1 1
15 3688 1 1 12 CYS H H 1.416 0.909 0.437 1.00 . A A . 12 CYS H 1 1
15 3689 1 1 12 CYS HA H -0.452 -0.888 1.946 1.00 . A A . 12 CYS HA 1 1
15 3690 1 1 12 CYS HB2 H 2.431 0.090 2.496 1.00 . A A . 12 CYS HB2 1 1
15 3691 1 1 12 CYS HB3 H 1.578 -0.940 3.640 1.00 . A A . 12 CYS HB3 1 1
15 3692 1 1 12 CYS N N 0.503 0.563 0.717 1.00 . A A . 12 CYS N 1 1
15 3693 1 1 12 CYS O O -0.851 0.456 4.106 1.00 . A A . 12 CYS O 1 1
15 3694 1 1 12 CYS SG S 2.244 -2.105 1.656 1.00 . A A . 12 CYS SG 1 1
15 3695 1 1 13 GLY C C -0.410 4.649 3.714 1.00 . A A . 13 GLY C 1 1
15 3696 1 1 13 GLY CA C -0.138 3.193 4.140 1.00 . A A . 13 GLY CA 1 1
15 3697 1 1 13 GLY H H 0.618 2.431 2.178 1.00 . A A . 13 GLY H 1 1
15 3698 1 1 13 GLY HA2 H -0.984 2.861 4.773 1.00 . A A . 13 GLY HA2 1 1
15 3699 1 1 13 GLY HA3 H 0.736 3.188 4.818 1.00 . A A . 13 GLY HA3 1 1
15 3700 1 1 13 GLY N N 0.112 2.218 3.053 1.00 . A A . 13 GLY N 1 1
15 3701 1 1 13 GLY O O -1.351 5.256 4.232 1.00 . A A . 13 GLY O 1 1
15 3702 1 1 14 ABA C C 2.139 7.155 2.920 1.00 . A A . 14 ABA C 1 1
15 3703 1 1 14 ABA CA C 0.629 6.726 2.786 1.00 . A A . 14 ABA CA 1 1
15 3704 1 1 14 ABA CB C -0.132 7.400 1.585 1.00 . A A . 14 ABA CB 1 1
15 3705 1 1 14 ABA CG C -1.530 6.850 1.245 1.00 . A A . 14 ABA CG 1 1
15 3706 1 1 14 ABA H H 1.154 4.614 2.461 1.00 . A A . 14 ABA H 1 1
15 3707 1 1 14 ABA HA H 0.165 7.168 3.690 1.00 . A A . 14 ABA HA 1 1
15 3708 1 1 14 ABA HB2 H -0.293 8.451 1.892 1.00 . A A . 14 ABA HB2 1 1
15 3709 1 1 14 ABA HG1 H -1.477 5.804 0.889 1.00 . A A . 14 ABA HG1 1 1
15 3710 1 1 14 ABA HG2 H -2.010 7.444 0.450 1.00 . A A . 14 ABA HG2 1 1
15 3711 1 1 14 ABA HG3 H -2.193 6.864 2.129 1.00 . A A . 14 ABA HG3 1 1
15 3712 1 1 14 ABA N N 0.450 5.239 2.860 1.00 . A A . 14 ABA N 1 1
15 3713 1 1 14 ABA O O 2.517 8.231 2.445 1.00 . A A . 14 ABA O 1 1
15 3714 1 1 15 VAL C C 5.363 5.445 3.577 1.00 . A A . 15 VAL C 1 1
15 3715 1 1 15 VAL CA C 4.428 6.668 3.892 1.00 . A A . 15 VAL CA 1 1
15 3716 1 1 15 VAL CB C 4.639 7.236 5.347 1.00 . A A . 15 VAL CB 1 1
15 3717 1 1 15 VAL CG1 C 6.112 7.591 5.674 1.00 . A A . 15 VAL CG1 1 1
15 3718 1 1 15 VAL CG2 C 3.791 8.493 5.668 1.00 . A A . 15 VAL CG2 1 1
15 3719 1 1 15 VAL H H 2.566 5.465 3.904 1.00 . A A . 15 VAL H 1 1
15 3720 1 1 15 VAL HA H 4.753 7.448 3.186 1.00 . A A . 15 VAL HA 1 1
15 3721 1 1 15 VAL HB H 4.333 6.450 6.065 1.00 . A A . 15 VAL HB 1 1
15 3722 1 1 15 VAL HG11 H 6.515 8.358 4.985 1.00 . A A . 15 VAL HG11 1 1
15 3723 1 1 15 VAL HG12 H 6.228 7.978 6.704 1.00 . A A . 15 VAL HG12 1 1
15 3724 1 1 15 VAL HG13 H 6.774 6.709 5.603 1.00 . A A . 15 VAL HG13 1 1
15 3725 1 1 15 VAL HG21 H 4.012 9.328 4.977 1.00 . A A . 15 VAL HG21 1 1
15 3726 1 1 15 VAL HG22 H 2.707 8.289 5.596 1.00 . A A . 15 VAL HG22 1 1
15 3727 1 1 15 VAL HG23 H 3.964 8.861 6.697 1.00 . A A . 15 VAL HG23 1 1
15 3728 1 1 15 VAL N N 2.988 6.356 3.617 1.00 . A A . 15 VAL N 1 1
15 3729 1 1 15 VAL O O 6.439 5.645 3.004 1.00 . A A . 15 VAL O 1 1
15 3730 1 1 16 ILE C C 6.290 2.523 2.603 1.00 . A A . 16 ILE C 1 1
15 3731 1 1 16 ILE CA C 5.904 3.022 4.037 1.00 . A A . 16 ILE CA 1 1
15 3732 1 1 16 ILE CB C 5.286 1.945 5.019 1.00 . A A . 16 ILE CB 1 1
15 3733 1 1 16 ILE CD1 C 4.428 1.675 7.487 1.00 . A A . 16 ILE CD1 1 1
15 3734 1 1 16 ILE CG1 C 5.362 2.409 6.510 1.00 . A A . 16 ILE CG1 1 1
15 3735 1 1 16 ILE CG2 C 5.892 0.519 4.886 1.00 . A A . 16 ILE CG2 1 1
15 3736 1 1 16 ILE H H 4.028 4.185 4.322 1.00 . A A . 16 ILE H 1 1
15 3737 1 1 16 ILE HA H 6.858 3.349 4.499 1.00 . A A . 16 ILE HA 1 1
15 3738 1 1 16 ILE HB H 4.214 1.840 4.768 1.00 . A A . 16 ILE HB 1 1
15 3739 1 1 16 ILE HD11 H 3.371 1.743 7.169 1.00 . A A . 16 ILE HD11 1 1
15 3740 1 1 16 ILE HD12 H 4.681 0.604 7.583 1.00 . A A . 16 ILE HD12 1 1
15 3741 1 1 16 ILE HD13 H 4.493 2.113 8.500 1.00 . A A . 16 ILE HD13 1 1
15 3742 1 1 16 ILE HG12 H 6.404 2.344 6.877 1.00 . A A . 16 ILE HG12 1 1
15 3743 1 1 16 ILE HG13 H 5.108 3.483 6.583 1.00 . A A . 16 ILE HG13 1 1
15 3744 1 1 16 ILE HG21 H 5.756 0.104 3.870 1.00 . A A . 16 ILE HG21 1 1
15 3745 1 1 16 ILE HG22 H 6.975 0.501 5.104 1.00 . A A . 16 ILE HG22 1 1
15 3746 1 1 16 ILE HG23 H 5.407 -0.210 5.562 1.00 . A A . 16 ILE HG23 1 1
15 3747 1 1 16 ILE N N 4.997 4.216 3.995 1.00 . A A . 16 ILE N 1 1
15 3748 1 1 16 ILE O O 7.473 2.548 2.250 1.00 . A A . 16 ILE O 1 1
15 3749 1 1 17 CYS C C 5.447 2.858 -0.588 1.00 . A A . 17 CYS C 1 1
15 3750 1 1 17 CYS CA C 5.515 1.647 0.392 1.00 . A A . 17 CYS CA 1 1
15 3751 1 1 17 CYS CB C 4.546 0.445 0.167 1.00 . A A . 17 CYS CB 1 1
15 3752 1 1 17 CYS H H 4.364 2.210 2.195 1.00 . A A . 17 CYS H 1 1
15 3753 1 1 17 CYS HA H 6.530 1.247 0.231 1.00 . A A . 17 CYS HA 1 1
15 3754 1 1 17 CYS HB2 H 3.731 0.389 0.910 1.00 . A A . 17 CYS HB2 1 1
15 3755 1 1 17 CYS HB3 H 4.005 0.484 -0.788 1.00 . A A . 17 CYS HB3 1 1
15 3756 1 1 17 CYS N N 5.304 2.085 1.801 1.00 . A A . 17 CYS N 1 1
15 3757 1 1 17 CYS O O 5.660 4.011 -0.196 1.00 . A A . 17 CYS O 1 1
15 3758 1 1 17 CYS SG S 5.457 -1.113 0.262 1.00 . A A . 17 CYS SG 1 1
15 3759 1 1 18 ALA C C 3.177 3.905 -2.740 1.00 . A A . 18 ALA C 1 1
15 3760 1 1 18 ALA CA C 4.702 3.643 -2.833 1.00 . A A . 18 ALA CA 1 1
15 3761 1 1 18 ALA CB C 5.194 3.295 -4.251 1.00 . A A . 18 ALA CB 1 1
15 3762 1 1 18 ALA H H 5.180 1.585 -2.056 1.00 . A A . 18 ALA H 1 1
15 3763 1 1 18 ALA HA H 5.113 4.648 -2.586 1.00 . A A . 18 ALA HA 1 1
15 3764 1 1 18 ALA HB1 H 6.292 3.168 -4.289 1.00 . A A . 18 ALA HB1 1 1
15 3765 1 1 18 ALA HB2 H 4.738 2.364 -4.635 1.00 . A A . 18 ALA HB2 1 1
15 3766 1 1 18 ALA HB3 H 4.943 4.095 -4.971 1.00 . A A . 18 ALA HB3 1 1
15 3767 1 1 18 ALA N N 5.182 2.595 -1.876 1.00 . A A . 18 ALA N 1 1
15 3768 1 1 18 ALA O O 2.423 3.895 -3.718 1.00 . A A . 18 ALA O 1 1
15 3769 1 1 19 CYS C C 3.542 6.424 -0.550 1.00 . A A . 19 CYS C 1 1
15 3770 1 1 19 CYS CA C 2.412 5.760 -1.362 1.00 . A A . 19 CYS CA 1 1
15 3771 1 1 19 CYS CB C 1.052 5.871 -0.602 1.00 . A A . 19 CYS CB 1 1
15 3772 1 1 19 CYS H H 3.430 4.006 -0.835 1.00 . A A . 19 CYS H 1 1
15 3773 1 1 19 CYS HXT H 4.849 7.892 -0.681 1.00 . A A . 19 CYS HXT 1 1
15 3774 1 1 19 CYS HA H 2.478 6.250 -2.360 1.00 . A A . 19 CYS HA 1 1
15 3775 1 1 19 CYS HB2 H 0.138 5.572 -1.170 1.00 . A A . 19 CYS HB2 1 1
15 3776 1 1 19 CYS HB3 H 1.057 5.187 0.265 1.00 . A A . 19 CYS HB3 1 1
15 3777 1 1 19 CYS N N 2.769 4.346 -1.541 1.00 . A A . 19 CYS N 1 1
15 3778 1 1 19 CYS O O 3.897 6.067 0.574 1.00 . A A . 19 CYS O 1 1
15 3779 1 1 19 CYS OXT O 4.156 7.519 -1.232 1.00 . A A . 19 CYS OXT 1 1
15 3780 1 1 19 CYS SG S 0.831 7.550 0.042 1.00 . A A . 19 CYS SG 1 1
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