NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
|
|
566765 |
2md4   |
19471 | cing | 4-filtered-FRED | STAR | entry | full | 134 |
data_FRED_restraints_with_modified_coordinates_PDB_code_2md4
# This FRED archive file contains, for PDB entry <2md4>:
#
# - Coordinates and sequence information from the PDB mmCIF file
# - NMR restraints from the PDB MR file
#
# In this file, the coordinates and NMR restraints share the same atom names,
# and in this way can differ from the data deposited at the wwPDB. To achieve
# this aim, the NMR restraints were parsed from their original format files, and
# the coordinates and NMR restraints information were subsequently harmonized.
#
# Due to the complexity of this harmonization process and the filtering process
# used in creating these files, the NMR restraints information in these files
# may differ significantly from that in the originally deposited file. Other
# modifications could have occurred to the NMR restraints information, or data
# could have been lost because of parsing or conversion errors. The PDB file
# remains the authoritative reference for the atomic coordinates and the
# originally deposited restraints files remain the primary reference for these
# data.
#
# This file is generated at the BioMagResBank (BMRB) in collaboration with the
# PDBe (formerly MSD) group at the European Bioinformatics Institute (EBI) and
# the CMBI/IMM group at the Radboud University of Nijmegen.
#
# Several software packages were used to produce this file:
#
# - Wattos (BMRB and CMBI/IMM).
# - FormatConverter and NMRStarExport (PDBe).
# - CCPN framework (http://www.ccpn.ac.uk/).
#
# More information about this process can be found in the references below.
# Please cite the original reference for this PDB entry.
#
# JF Doreleijers, A Nederveen, W Vranken, J Lin, AM Bonvin, R Kaptein, JL
# Markley, and EL Ulrich (2005). BioMagResBank databases DOCR and FRED
# containing converted and filtered sets of experimental NMR restraints and
# coordinates from over 500 protein PDB structures. J. Biomol. NMR 32, 1-12.
#
# WF Vranken, W Boucher, TJ Stevens, RH Fogh, A Pajon, M Llinas, EL Ulrich, JL
# Markley, J Ionides, ED Laue (2005). The CCPN data model for NMR spectroscopy:
# development of a software pipeline. Proteins 59, 687-696.
#
# JF Doreleijers, WF Vranken, C Schulte, J Lin, JR Wedell, CJ Penkett, GW Vuister,
# G Vriend, JL Markley, and EL Ulrich (2009). The NMR Restraints Grid at BMRB for
# 5,266 Protein and Nucleic Acid PDB Entries. J Biomol. NMR 45, 389?396.
save_Conversion_project_for_entry_Name_1
_Study_list.Sf_category study_list
_Study_list.Entry_ID 1
_Study_list.ID 1
loop_
_Study.ID
_Study.Name
_Study.Type
_Study.Details
_Study.Entry_ID
_Study.Study_list_ID
1 "Conversion project for entry 1" NMR . 1 1
stop_
save_
save_originalConstraints_1
_Entry.PDB_coordinate_file_version .
_Entry.Sf_category entry_information
_Entry.ID 1
_Entry.Title "Data for entry 1"
_Entry.NMR_STAR_version 3.1.0.8
_Entry.Experimental_method NMR
_Entry.Details .
save_
save_assembly_2md4
_Assembly.Sf_category assembly
_Assembly.Entry_ID 1
_Assembly.ID 1
_Assembly.Name 2md4
_Assembly.Number_of_components 1
_Assembly.Organic_ligands .
_Assembly.Metal_ions .
_Assembly.Paramagnetic .
_Assembly.Thiol_state "not present"
_Assembly.Molecular_mass 1418.68
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 $Lactotransferrin A . 1 1
stop_
save_
save_Lactotransferrin
_Entity.Sf_category entity
_Entity.Entry_ID 1
_Entity.ID 1
_Entity.Name Lactotransferrin
_Entity.Type polymer
_Entity.Polymer_type polypeptide(L)
_Entity.Polymer_seq_one_letter_code WKLLSKAQEKFG
_Entity.Number_of_monomers 12
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 TRP . 1 1
2 LYS . 1 1
3 LEU . 1 1
4 LEU . 1 1
5 SER . 1 1
6 LYS . 1 1
7 ALA . 1 1
8 GLN . 1 1
9 GLU . 1 1
10 LYS . 1 1
11 PHE . 1 1
12 GLY . 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
TRP 1 1 1 1
LYS 2 2 1 1
LEU 3 3 1 1
LEU 4 4 1 1
SER 5 5 1 1
LYS 6 6 1 1
ALA 7 7 1 1
GLN 8 8 1 1
GLU 9 9 1 1
LYS 10 10 1 1
PHE 11 11 1 1
GLY 12 12 1 1
stop_
save_
save_DYANA/DIANA_distance_constraints_2_1
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID 1
_Distance_constraint_list.ID 1
_Distance_constraint_list.Constraint_type NOE
_Distance_constraint_list.Constraint_file_ID .
_Distance_constraint_list.Block_ID .
loop_
_Dist_constraint_tree.Constraint_ID
_Dist_constraint_tree.Node_ID
_Dist_constraint_tree.Down_node_ID
_Dist_constraint_tree.Right_node_ID
_Dist_constraint_tree.Logic_operation
_Dist_constraint_tree.Entry_ID
_Dist_constraint_tree.Distance_constraint_list_ID
1 1 . . . 1 1
2 1 . . . 1 1
3 1 . . . 1 1
4 1 . . . 1 1
5 1 . . . 1 1
6 1 . . . 1 1
7 1 . . . 1 1
8 1 . . . 1 1
9 1 . . . 1 1
10 1 . . . 1 1
11 1 . . . 1 1
12 1 . . . 1 1
13 1 . . . 1 1
14 1 . . . 1 1
15 1 . . . 1 1
16 1 . . . 1 1
17 1 . . . 1 1
18 1 . . . 1 1
19 1 . . . 1 1
20 1 . . . 1 1
21 1 . . . 1 1
22 1 . . . 1 1
23 1 . . . 1 1
24 1 . . . 1 1
25 1 . . . 1 1
26 1 . . . 1 1
27 1 . . . 1 1
28 1 . . . 1 1
29 1 . . . 1 1
30 1 . . . 1 1
31 1 . . . 1 1
32 1 . . . 1 1
33 1 . . . 1 1
34 1 . . . 1 1
35 1 . . . 1 1
36 1 . . . 1 1
37 1 . . . 1 1
38 1 . . . 1 1
39 1 . . . 1 1
40 1 . . . 1 1
41 1 . . . 1 1
42 1 . . . 1 1
43 1 . . . 1 1
44 1 . . . 1 1
45 1 . . . 1 1
46 1 . . . 1 1
47 1 . . . 1 1
48 1 . . . 1 1
49 1 . . . 1 1
50 1 . . . 1 1
51 1 . . . 1 1
52 1 . . . 1 1
53 1 . . . 1 1
54 1 . . . 1 1
55 1 . . . 1 1
56 1 . . . 1 1
57 1 . . . 1 1
58 1 . . . 1 1
59 1 . . . 1 1
60 1 . . . 1 1
61 1 . . . 1 1
62 1 . . . 1 1
63 1 . . . 1 1
64 1 . . . 1 1
65 1 . . . 1 1
66 1 . . . 1 1
67 1 . . . 1 1
68 1 . . . 1 1
69 1 . . . 1 1
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
100 1 . . . 1 1
101 1 . . . 1 1
102 1 . . . 1 1
103 1 . . . 1 1
104 1 . . . 1 1
105 1 . . . 1 1
106 1 . . . 1 1
107 1 . . . 1 1
108 1 . . . 1 1
109 1 . . . 1 1
110 1 . . . 1 1
111 1 . . . 1 1
112 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 TRP H1 . 1 TRP H 1 1
1 1 2 1 1 1 TRP QB . 1 TRP QB 1 1
2 1 1 1 1 1 TRP H1 . 1 TRP H 1 1
2 1 2 1 1 3 LEU H . 3 LEU H 1 1
3 1 1 1 1 1 TRP HA . 1 TRP HA 1 1
3 1 2 1 1 2 LYS H . 2 LYS H 1 1
4 1 1 1 1 1 TRP HA . 1 TRP HA 1 1
4 1 2 1 1 3 LEU H . 3 LEU H 1 1
5 1 1 1 1 1 TRP HA . 1 TRP HA 1 1
5 1 2 1 1 4 LEU H . 4 LEU H 1 1
6 1 1 1 1 1 TRP HA . 1 TRP HA 1 1
6 1 2 1 1 5 SER H . 5 SER H 1 1
7 1 1 1 1 1 TRP QB . 1 TRP QB 1 1
7 1 2 1 1 2 LYS H . 2 LYS H 1 1
8 1 1 1 1 1 TRP QB . 1 TRP QB 1 1
8 1 2 1 1 3 LEU H . 3 LEU H 1 1
9 1 1 1 1 1 TRP QB . 1 TRP QB 1 1
9 1 2 1 1 4 LEU H . 4 LEU H 1 1
10 1 1 1 1 1 TRP HD1 . 1 TRP HD1 1 1
10 1 2 1 1 2 LYS HG3 . 2 LYS HG3 1 1
11 1 1 1 1 1 TRP HD1 . 1 TRP HD1 1 1
11 1 2 1 1 3 LEU QB . 3 LEU QB 1 1
12 1 1 1 1 1 TRP HD1 . 1 TRP HD1 1 1
12 1 2 1 1 4 LEU QD . 4 LEU QQD 1 1
13 1 1 1 1 1 TRP HE1 . 1 TRP HE1 1 1
13 1 2 1 1 3 LEU QB . 3 LEU QB 1 1
14 1 1 1 1 1 TRP HE1 . 1 TRP HE1 1 1
14 1 2 1 1 3 LEU QD . 3 LEU QQD 1 1
15 1 1 1 1 1 TRP HE3 . 1 TRP HE3 1 1
15 1 2 1 1 3 LEU QB . 3 LEU QB 1 1
16 1 1 1 1 1 TRP HE3 . 1 TRP HE3 1 1
16 1 2 1 1 3 LEU QD . 3 LEU QQD 1 1
17 1 1 1 1 1 TRP HE3 . 1 TRP HE3 1 1
17 1 2 1 1 4 LEU QD . 4 LEU QQD 1 1
18 1 1 1 1 1 TRP HH2 . 1 TRP HH2 1 1
18 1 2 1 1 3 LEU QB . 3 LEU QB 1 1
19 1 1 1 1 1 TRP HH2 . 1 TRP HH2 1 1
19 1 2 1 1 3 LEU QD . 3 LEU QQD 1 1
20 1 1 1 1 1 TRP HH2 . 1 TRP HH2 1 1
20 1 2 1 1 4 LEU QD . 4 LEU QQD 1 1
21 1 1 1 1 1 TRP HZ2 . 1 TRP HZ2 1 1
21 1 2 1 1 3 LEU QB . 3 LEU QB 1 1
22 1 1 1 1 1 TRP HZ2 . 1 TRP HZ2 1 1
22 1 2 1 1 3 LEU QD . 3 LEU QQD 1 1
23 1 1 1 1 1 TRP HZ2 . 1 TRP HZ2 1 1
23 1 2 1 1 4 LEU QD . 4 LEU QQD 1 1
24 1 1 1 1 1 TRP HZ3 . 1 TRP HZ3 1 1
24 1 2 1 1 3 LEU QB . 3 LEU QB 1 1
25 1 1 1 1 1 TRP HZ3 . 1 TRP HZ3 1 1
25 1 2 1 1 3 LEU QD . 3 LEU QQD 1 1
26 1 1 1 1 1 TRP HZ3 . 1 TRP HZ3 1 1
26 1 2 1 1 4 LEU QD . 4 LEU QQD 1 1
27 1 1 1 1 2 LYS H . 2 LYS H 1 1
27 1 2 1 1 2 LYS QD . 2 LYS QD 1 1
28 1 1 1 1 2 LYS H . 2 LYS H 1 1
28 1 2 1 1 2 LYS QG . 2 LYS QG 1 1
29 1 1 1 1 2 LYS H . 2 LYS H 1 1
29 1 2 1 1 3 LEU H . 3 LEU H 1 1
30 1 1 1 1 2 LYS H . 2 LYS H 1 1
30 1 2 1 1 4 LEU H . 4 LEU H 1 1
31 1 1 1 1 2 LYS HA . 2 LYS HA 1 1
31 1 2 1 1 3 LEU H . 3 LEU H 1 1
32 1 1 1 1 2 LYS HA . 2 LYS HA 1 1
32 1 2 1 1 4 LEU H . 4 LEU H 1 1
33 1 1 1 1 2 LYS HA . 2 LYS HA 1 1
33 1 2 1 1 5 SER H . 5 SER H 1 1
34 1 1 1 1 2 LYS HA . 2 LYS HA 1 1
34 1 2 1 1 6 LYS H . 6 LYS H 1 1
35 1 1 1 1 2 LYS QB . 2 LYS QB 1 1
35 1 2 1 1 4 LEU H . 4 LEU H 1 1
36 1 1 1 1 2 LYS QD . 2 LYS QD 1 1
36 1 2 1 1 3 LEU H . 3 LEU H 1 1
37 1 1 1 1 2 LYS QD . 2 LYS QD 1 1
37 1 2 1 1 4 LEU H . 4 LEU H 1 1
38 1 1 1 1 2 LYS QG . 2 LYS QG 1 1
38 1 2 1 1 3 LEU H . 3 LEU H 1 1
39 1 1 1 1 2 LYS QG . 2 LYS QG 1 1
39 1 2 1 1 4 LEU H . 4 LEU H 1 1
40 1 1 1 1 2 LYS QG . 2 LYS QG 1 1
40 1 2 1 1 6 LYS H . 6 LYS H 1 1
41 1 1 1 1 3 LEU H . 3 LEU H 1 1
41 1 2 1 1 3 LEU QB . 3 LEU QB 1 1
42 1 1 1 1 3 LEU H . 3 LEU H 1 1
42 1 2 1 1 3 LEU QD . 3 LEU QQD 1 1
43 1 1 1 1 3 LEU H . 3 LEU H 1 1
43 1 2 1 1 4 LEU H . 4 LEU H 1 1
44 1 1 1 1 3 LEU H . 3 LEU H 1 1
44 1 2 1 1 5 SER H . 5 SER H 1 1
45 1 1 1 1 3 LEU HA . 3 LEU HA 1 1
45 1 2 1 1 4 LEU H . 4 LEU H 1 1
46 1 1 1 1 3 LEU HA . 3 LEU HA 1 1
46 1 2 1 1 5 SER H . 5 SER H 1 1
47 1 1 1 1 3 LEU HA . 3 LEU HA 1 1
47 1 2 1 1 7 ALA H . 7 ALA H 1 1
48 1 1 1 1 3 LEU QD . 3 LEU QQD 1 1
48 1 2 1 1 4 LEU H . 4 LEU H 1 1
49 1 1 1 1 3 LEU QD . 3 LEU QQD 1 1
49 1 2 1 1 6 LYS H . 6 LYS H 1 1
50 1 1 1 1 3 LEU QD . 3 LEU QQD 1 1
50 1 2 1 1 7 ALA H . 7 ALA H 1 1
51 1 1 1 1 4 LEU H . 4 LEU H 1 1
51 1 2 1 1 4 LEU QB . 4 LEU QB 1 1
52 1 1 1 1 4 LEU H . 4 LEU H 1 1
52 1 2 1 1 4 LEU QD . 4 LEU QQD 1 1
53 1 1 1 1 4 LEU H . 4 LEU H 1 1
53 1 2 1 1 5 SER H . 5 SER H 1 1
54 1 1 1 1 4 LEU HA . 4 LEU HA 1 1
54 1 2 1 1 5 SER H . 5 SER H 1 1
55 1 1 1 1 4 LEU QB . 4 LEU QB 1 1
55 1 2 1 1 5 SER H . 5 SER H 1 1
56 1 1 1 1 4 LEU QD . 4 LEU QQD 1 1
56 1 2 1 1 5 SER H . 5 SER H 1 1
57 1 1 1 1 4 LEU QD . 4 LEU QQD 1 1
57 1 2 1 1 8 GLN H . 8 GLN H 1 1
58 1 1 1 1 5 SER H . 5 SER H 1 1
58 1 2 1 1 5 SER QB . 5 SER QB 1 1
59 1 1 1 1 5 SER H . 5 SER H 1 1
59 1 2 1 1 6 LYS H . 6 LYS H 1 1
60 1 1 1 1 5 SER HA . 5 SER HA 1 1
60 1 2 1 1 6 LYS H . 6 LYS H 1 1
61 1 1 1 1 5 SER HA . 5 SER HA 1 1
61 1 2 1 1 7 ALA H . 7 ALA H 1 1
62 1 1 1 1 5 SER HA . 5 SER HA 1 1
62 1 2 1 1 8 GLN H . 8 GLN H 1 1
63 1 1 1 1 5 SER HA . 5 SER HA 1 1
63 1 2 1 1 9 GLU H . 9 GLU H 1 1
64 1 1 1 1 5 SER QB . 5 SER QB 1 1
64 1 2 1 1 6 LYS H . 6 LYS H 1 1
65 1 1 1 1 5 SER QB . 5 SER QB 1 1
65 1 2 1 1 8 GLN H . 8 GLN H 1 1
66 1 1 1 1 5 SER QB . 5 SER QB 1 1
66 1 2 1 1 9 GLU H . 9 GLU H 1 1
67 1 1 1 1 6 LYS H . 6 LYS H 1 1
67 1 2 1 1 6 LYS QB . 6 LYS QB 1 1
68 1 1 1 1 6 LYS H . 6 LYS H 1 1
68 1 2 1 1 6 LYS QD . 6 LYS QD 1 1
69 1 1 1 1 6 LYS H . 6 LYS H 1 1
69 1 2 1 1 6 LYS QG . 6 LYS QG 1 1
70 1 1 1 1 6 LYS H . 6 LYS H 1 1
70 1 2 1 1 7 ALA H . 7 ALA H 1 1
71 1 1 1 1 6 LYS HA . 6 LYS HA 1 1
71 1 2 1 1 7 ALA H . 7 ALA H 1 1
72 1 1 1 1 6 LYS QB . 6 LYS QB 1 1
72 1 2 1 1 7 ALA H . 7 ALA H 1 1
73 1 1 1 1 6 LYS QD . 6 LYS QD 1 1
73 1 2 1 1 7 ALA H . 7 ALA H 1 1
74 1 1 1 1 6 LYS QG . 6 LYS QG 1 1
74 1 2 1 1 7 ALA H . 7 ALA H 1 1
75 1 1 1 1 7 ALA H . 7 ALA H 1 1
75 1 2 1 1 7 ALA MB . 7 ALA QB 1 1
76 1 1 1 1 7 ALA H . 7 ALA H 1 1
76 1 2 1 1 8 GLN H . 8 GLN H 1 1
77 1 1 1 1 7 ALA HA . 7 ALA HA 1 1
77 1 2 1 1 8 GLN H . 8 GLN H 1 1
78 1 1 1 1 7 ALA MB . 7 ALA QB 1 1
78 1 2 1 1 8 GLN H . 8 GLN H 1 1
79 1 1 1 1 7 ALA MB . 7 ALA QB 1 1
79 1 2 1 1 9 GLU H . 9 GLU H 1 1
80 1 1 1 1 7 ALA MB . 7 ALA QB 1 1
80 1 2 1 1 11 PHE QD . 11 PHE QD 1 1
81 1 1 1 1 7 ALA MB . 7 ALA QB 1 1
81 1 2 1 1 11 PHE QE . 11 PHE QE 1 1
82 1 1 1 1 7 ALA MB . 7 ALA QB 1 1
82 1 2 1 1 11 PHE HZ . 11 PHE HZ 1 1
83 1 1 1 1 8 GLN H . 8 GLN H 1 1
83 1 2 1 1 8 GLN QB . 8 GLN QB 1 1
84 1 1 1 1 8 GLN H . 8 GLN H 1 1
84 1 2 1 1 8 GLN QG . 8 GLN QG 1 1
85 1 1 1 1 8 GLN H . 8 GLN H 1 1
85 1 2 1 1 9 GLU H . 9 GLU H 1 1
86 1 1 1 1 8 GLN HA . 8 GLN HA 1 1
86 1 2 1 1 9 GLU H . 9 GLU H 1 1
87 1 1 1 1 8 GLN HA . 8 GLN HA 1 1
87 1 2 1 1 11 PHE QD . 11 PHE QD 1 1
88 1 1 1 1 8 GLN HA . 8 GLN HA 1 1
88 1 2 1 1 11 PHE QE . 11 PHE QE 1 1
89 1 1 1 1 8 GLN QB . 8 GLN QB 1 1
89 1 2 1 1 9 GLU H . 9 GLU H 1 1
90 1 1 1 1 8 GLN QG . 8 GLN QG 1 1
90 1 2 1 1 9 GLU H . 9 GLU H 1 1
91 1 1 1 1 8 GLN QG . 8 GLN QG 1 1
91 1 2 1 1 11 PHE QD . 11 PHE QD 1 1
92 1 1 1 1 9 GLU H . 9 GLU H 1 1
92 1 2 1 1 9 GLU QB . 9 GLU QB 1 1
93 1 1 1 1 9 GLU H . 9 GLU H 1 1
93 1 2 1 1 9 GLU QG . 9 GLU QG 1 1
94 1 1 1 1 9 GLU H . 9 GLU H 1 1
94 1 2 1 1 10 LYS H . 10 LYS H 1 1
95 1 1 1 1 9 GLU HA . 9 GLU HA 1 1
95 1 2 1 1 10 LYS H . 10 LYS H 1 1
96 1 1 1 1 9 GLU HA . 9 GLU HA 1 1
96 1 2 1 1 11 PHE H . 11 PHE H 1 1
97 1 1 1 1 9 GLU QB . 9 GLU QB 1 1
97 1 2 1 1 10 LYS H . 10 LYS H 1 1
98 1 1 1 1 9 GLU QB . 9 GLU QB 1 1
98 1 2 1 1 11 PHE H . 11 PHE H 1 1
99 1 1 1 1 9 GLU QG . 9 GLU QG 1 1
99 1 2 1 1 10 LYS H . 10 LYS H 1 1
100 1 1 1 1 10 LYS H . 10 LYS H 1 1
100 1 2 1 1 10 LYS QB . 10 LYS QB 1 1
101 1 1 1 1 10 LYS H . 10 LYS H 1 1
101 1 2 1 1 10 LYS QD . 10 LYS QD 1 1
102 1 1 1 1 10 LYS H . 10 LYS H 1 1
102 1 2 1 1 10 LYS QG . 10 LYS QG 1 1
103 1 1 1 1 10 LYS H . 10 LYS H 1 1
103 1 2 1 1 11 PHE H . 11 PHE H 1 1
104 1 1 1 1 10 LYS HA . 10 LYS HA 1 1
104 1 2 1 1 11 PHE H . 11 PHE H 1 1
105 1 1 1 1 10 LYS QD . 10 LYS QD 1 1
105 1 2 1 1 11 PHE H . 11 PHE H 1 1
106 1 1 1 1 10 LYS QG . 10 LYS QG 1 1
106 1 2 1 1 11 PHE H . 11 PHE H 1 1
107 1 1 1 1 10 LYS QG . 10 LYS QG 1 1
107 1 2 1 1 11 PHE QD . 11 PHE QD 1 1
108 1 1 1 1 10 LYS QG . 10 LYS QG 1 1
108 1 2 1 1 11 PHE QE . 11 PHE QE 1 1
109 1 1 1 1 11 PHE H . 11 PHE H 1 1
109 1 2 1 1 11 PHE QB . 11 PHE QB 1 1
110 1 1 1 1 11 PHE H . 11 PHE H 1 1
110 1 2 1 1 12 GLY H . 12 GLY H 1 1
111 1 1 1 1 11 PHE HA . 11 PHE HA 1 1
111 1 2 1 1 12 GLY H . 12 GLY H 1 1
112 1 1 1 1 11 PHE QB . 11 PHE QB 1 1
112 1 2 1 1 12 GLY H . 12 GLY H 1 1
stop_
loop_
_Dist_constraint_value.Constraint_ID
_Dist_constraint_value.Tree_node_ID
_Dist_constraint_value.Source_experiment_ID
_Dist_constraint_value.Spectral_peak_ID
_Dist_constraint_value.Intensity_val
_Dist_constraint_value.Intensity_lower_val_err
_Dist_constraint_value.Intensity_upper_val_err
_Dist_constraint_value.Distance_val
_Dist_constraint_value.Distance_lower_bound_val
_Dist_constraint_value.Distance_upper_bound_val
_Dist_constraint_value.Entry_ID
_Dist_constraint_value.Distance_constraint_list_ID
1 1 . . . . . . . 3.5 1 1
2 1 . . . . . . . 4.0 1 1
3 1 . . . . . . . 3.5 1 1
4 1 . . . . . . . 4.4 1 1
5 1 . . . . . . . 4.2 1 1
6 1 . . . . . . . 4.2 1 1
7 1 . . . . . . . 3.3 1 1
8 1 . . . . . . . 3.9 1 1
9 1 . . . . . . . 4.5 1 1
10 1 . . . . . . . 4.4 1 1
11 1 . . . . . . . 3.8 1 1
12 1 . . . . . . . 4.7 1 1
13 1 . . . . . . . 4.0 1 1
14 1 . . . . . . . 4.0 1 1
15 1 . . . . . . . 4.4 1 1
16 1 . . . . . . . 4.4 1 1
17 1 . . . . . . . 4.2 1 1
18 1 . . . . . . . 4.2 1 1
19 1 . . . . . . . 4.2 1 1
20 1 . . . . . . . 4.0 1 1
21 1 . . . . . . . 4.0 1 1
22 1 . . . . . . . 4.0 1 1
23 1 . . . . . . . 4.0 1 1
24 1 . . . . . . . 4.2 1 1
25 1 . . . . . . . 4.2 1 1
26 1 . . . . . . . 4.3 1 1
27 1 . . . . . . . 4.0 1 1
28 1 . . . . . . . 3.8 1 1
29 1 . . . . . . . 2.8 1 1
30 1 . . . . . . . 4.0 1 1
31 1 . . . . . . . 3.3 1 1
32 1 . . . . . . . 4.4 1 1
33 1 . . . . . . . 3.3 1 1
34 1 . . . . . . . 3.5 1 1
35 1 . . . . . . . 4.5 1 1
36 1 . . . . . . . 3.9 1 1
37 1 . . . . . . . 4.0 1 1
38 1 . . . . . . . 3.8 1 1
39 1 . . . . . . . 4.3 1 1
40 1 . . . . . . . 4.0 1 1
41 1 . . . . . . . 3.8 1 1
42 1 . . . . . . . 4.0 1 1
43 1 . . . . . . . 2.8 1 1
44 1 . . . . . . . 4.0 1 1
45 1 . . . . . . . 3.2 1 1
46 1 . . . . . . . 4.4 1 1
47 1 . . . . . . . 3.8 1 1
48 1 . . . . . . . 4.2 1 1
49 1 . . . . . . . 4.2 1 1
50 1 . . . . . . . 4.2 1 1
51 1 . . . . . . . 3.3 1 1
52 1 . . . . . . . 3.8 1 1
53 1 . . . . . . . 2.8 1 1
54 1 . . . . . . . 3.3 1 1
55 1 . . . . . . . 3.3 1 1
56 1 . . . . . . . 4.0 1 1
57 1 . . . . . . . 4.2 1 1
58 1 . . . . . . . 3.3 1 1
59 1 . . . . . . . 2.8 1 1
60 1 . . . . . . . 3.3 1 1
61 1 . . . . . . . 4.4 1 1
62 1 . . . . . . . 3.3 1 1
63 1 . . . . . . . 3.5 1 1
64 1 . . . . . . . 3.3 1 1
65 1 . . . . . . . 4.8 1 1
66 1 . . . . . . . 4.2 1 1
67 1 . . . . . . . 3.3 1 1
68 1 . . . . . . . 3.8 1 1
69 1 . . . . . . . 4.0 1 1
70 1 . . . . . . . 2.8 1 1
71 1 . . . . . . . 3.3 1 1
72 1 . . . . . . . 3.5 1 1
73 1 . . . . . . . 4.0 1 1
74 1 . . . . . . . 3.6 1 1
75 1 . . . . . . . 3.3 1 1
76 1 . . . . . . . 2.8 1 1
77 1 . . . . . . . 3.3 1 1
78 1 . . . . . . . 3.3 1 1
79 1 . . . . . . . 4.4 1 1
80 1 . . . . . . . 3.8 1 1
81 1 . . . . . . . 3.8 1 1
82 1 . . . . . . . 3.8 1 1
83 1 . . . . . . . 3.3 1 1
84 1 . . . . . . . 3.8 1 1
85 1 . . . . . . . 2.8 1 1
86 1 . . . . . . . 3.3 1 1
87 1 . . . . . . . 4.2 1 1
88 1 . . . . . . . 4.2 1 1
89 1 . . . . . . . 3.3 1 1
90 1 . . . . . . . 4.0 1 1
91 1 . . . . . . . 4.2 1 1
92 1 . . . . . . . 3.8 1 1
93 1 . . . . . . . 4.1 1 1
94 1 . . . . . . . 2.8 1 1
95 1 . . . . . . . 3.4 1 1
96 1 . . . . . . . 4.4 1 1
97 1 . . . . . . . 3.8 1 1
98 1 . . . . . . . 4.4 1 1
99 1 . . . . . . . 4.1 1 1
100 1 . . . . . . . 3.3 1 1
101 1 . . . . . . . 4.0 1 1
102 1 . . . . . . . 3.8 1 1
103 1 . . . . . . . 2.8 1 1
104 1 . . . . . . . 3.0 1 1
105 1 . . . . . . . 4.2 1 1
106 1 . . . . . . . 4.0 1 1
107 1 . . . . . . . 3.8 1 1
108 1 . . . . . . . 3.8 1 1
109 1 . . . . . . . 3.3 1 1
110 1 . . . . . . . 2.8 1 1
111 1 . . . . . . . 3.5 1 1
112 1 . . . . . . . 3.3 1 1
stop_
save_
save_DYANA/DIANA_dihedral_3
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID 1
_Torsion_angle_constraint_list.ID 1
_Torsion_angle_constraint_list.Constraint_file_ID .
_Torsion_angle_constraint_list.Block_ID .
loop_
_Torsion_angle_constraint.ID
_Torsion_angle_constraint.Torsion_angle_name
_Torsion_angle_constraint.Entity_assembly_ID_1
_Torsion_angle_constraint.Entity_ID_1
_Torsion_angle_constraint.Comp_index_ID_1
_Torsion_angle_constraint.Comp_ID_1
_Torsion_angle_constraint.Atom_ID_1
_Torsion_angle_constraint.Entity_assembly_ID_2
_Torsion_angle_constraint.Entity_ID_2
_Torsion_angle_constraint.Comp_index_ID_2
_Torsion_angle_constraint.Comp_ID_2
_Torsion_angle_constraint.Atom_ID_2
_Torsion_angle_constraint.Entity_assembly_ID_3
_Torsion_angle_constraint.Entity_ID_3
_Torsion_angle_constraint.Comp_index_ID_3
_Torsion_angle_constraint.Comp_ID_3
_Torsion_angle_constraint.Atom_ID_3
_Torsion_angle_constraint.Entity_assembly_ID_4
_Torsion_angle_constraint.Entity_ID_4
_Torsion_angle_constraint.Comp_index_ID_4
_Torsion_angle_constraint.Comp_ID_4
_Torsion_angle_constraint.Atom_ID_4
_Torsion_angle_constraint.Angle_lower_bound_val
_Torsion_angle_constraint.Angle_upper_bound_val
_Torsion_angle_constraint.Auth_asym_ID_1
_Torsion_angle_constraint.Auth_seq_ID_1
_Torsion_angle_constraint.Auth_comp_ID_1
_Torsion_angle_constraint.Auth_atom_ID_1
_Torsion_angle_constraint.Auth_asym_ID_2
_Torsion_angle_constraint.Auth_seq_ID_2
_Torsion_angle_constraint.Auth_comp_ID_2
_Torsion_angle_constraint.Auth_atom_ID_2
_Torsion_angle_constraint.Auth_asym_ID_3
_Torsion_angle_constraint.Auth_seq_ID_3
_Torsion_angle_constraint.Auth_comp_ID_3
_Torsion_angle_constraint.Auth_atom_ID_3
_Torsion_angle_constraint.Auth_asym_ID_4
_Torsion_angle_constraint.Auth_seq_ID_4
_Torsion_angle_constraint.Auth_comp_ID_4
_Torsion_angle_constraint.Auth_atom_ID_4
_Torsion_angle_constraint.Entry_ID
_Torsion_angle_constraint.Torsion_angle_constraint_list_ID
1 PSI 1 1 1 TRP N 1 1 1 TRP CA 1 1 1 TRP C 1 1 2 LYS N -120.0 120.0 . 1 TRP . . 1 TRP . . 1 TRP . . 1 TRP . 1 1
2 PHI 1 1 1 TRP C 1 1 2 LYS N 1 1 2 LYS CA 1 1 2 LYS C -120.0 -30.0 . 2 LYS . . 2 LYS . . 2 LYS . . 2 LYS . 1 1
3 PSI 1 1 2 LYS N 1 1 2 LYS CA 1 1 2 LYS C 1 1 3 LEU N -120.0 120.0 . 2 LYS . . 2 LYS . . 2 LYS . . 2 LYS . 1 1
4 PHI 1 1 2 LYS C 1 1 3 LEU N 1 1 3 LEU CA 1 1 3 LEU C -120.0 -30.0 . 3 LEU . . 3 LEU . . 3 LEU . . 3 LEU . 1 1
5 PSI 1 1 3 LEU N 1 1 3 LEU CA 1 1 3 LEU C 1 1 4 LEU N -120.0 120.0 . 3 LEU . . 3 LEU . . 3 LEU . . 3 LEU . 1 1
6 PHI 1 1 3 LEU C 1 1 4 LEU N 1 1 4 LEU CA 1 1 4 LEU C -120.0 -30.0 . 4 LEU . . 4 LEU . . 4 LEU . . 4 LEU . 1 1
7 PSI 1 1 4 LEU N 1 1 4 LEU CA 1 1 4 LEU C 1 1 5 SER N -120.0 120.0 . 4 LEU . . 4 LEU . . 4 LEU . . 4 LEU . 1 1
8 PHI 1 1 4 LEU C 1 1 5 SER N 1 1 5 SER CA 1 1 5 SER C -120.0 -30.0 . 5 SER . . 5 SER . . 5 SER . . 5 SER . 1 1
9 PSI 1 1 5 SER N 1 1 5 SER CA 1 1 5 SER C 1 1 6 LYS N -120.0 120.0 . 5 SER . . 5 SER . . 5 SER . . 5 SER . 1 1
10 PHI 1 1 5 SER C 1 1 6 LYS N 1 1 6 LYS CA 1 1 6 LYS C -120.0 -30.0 . 6 LYS . . 6 LYS . . 6 LYS . . 6 LYS . 1 1
11 PSI 1 1 6 LYS N 1 1 6 LYS CA 1 1 6 LYS C 1 1 7 ALA N -120.0 120.0 . 6 LYS . . 6 LYS . . 6 LYS . . 6 LYS . 1 1
12 PHI 1 1 6 LYS C 1 1 7 ALA N 1 1 7 ALA CA 1 1 7 ALA C -120.0 -30.0 . 7 ALA . . 7 ALA . . 7 ALA . . 7 ALA . 1 1
13 PSI 1 1 7 ALA N 1 1 7 ALA CA 1 1 7 ALA C 1 1 8 GLN N -120.0 120.0 . 7 ALA . . 7 ALA . . 7 ALA . . 7 ALA . 1 1
14 PHI 1 1 7 ALA C 1 1 8 GLN N 1 1 8 GLN CA 1 1 8 GLN C -120.0 -30.0 . 8 GLN . . 8 GLN . . 8 GLN . . 8 GLN . 1 1
15 PSI 1 1 8 GLN N 1 1 8 GLN CA 1 1 8 GLN C 1 1 9 GLU N -120.0 120.0 . 8 GLN . . 8 GLN . . 8 GLN . . 8 GLN . 1 1
16 PHI 1 1 8 GLN C 1 1 9 GLU N 1 1 9 GLU CA 1 1 9 GLU C -120.0 -30.0 . 9 GLU . . 9 GLU . . 9 GLU . . 9 GLU . 1 1
17 PSI 1 1 9 GLU N 1 1 9 GLU CA 1 1 9 GLU C 1 1 10 LYS N -120.0 120.0 . 9 GLU . . 9 GLU . . 9 GLU . . 9 GLU . 1 1
18 PHI 1 1 9 GLU C 1 1 10 LYS N 1 1 10 LYS CA 1 1 10 LYS C -120.0 -30.0 . 10 LYS . . 10 LYS . . 10 LYS . . 10 LYS . 1 1
19 PSI 1 1 10 LYS N 1 1 10 LYS CA 1 1 10 LYS C 1 1 11 PHE N -120.0 120.0 . 10 LYS . . 10 LYS . . 10 LYS . . 10 LYS . 1 1
20 PHI 1 1 10 LYS C 1 1 11 PHE N 1 1 11 PHE CA 1 1 11 PHE C -120.0 -30.0 . 11 PHE . . 11 PHE . . 11 PHE . . 11 PHE . 1 1
21 PSI 1 1 11 PHE N 1 1 11 PHE CA 1 1 11 PHE C 1 1 12 GLY N -120.0 120.0 . 11 PHE . . 11 PHE . . 11 PHE . . 11 PHE . 1 1
22 PHI 1 1 11 PHE C 1 1 12 GLY N 1 1 12 GLY CA 1 1 12 GLY C -120.0 -30.0 . 12 GLY . . 12 GLY . . 12 GLY . . 12 GLY . 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 TRP C C 3.289 -0.940 -1.146 1.00 . A A . 1 TRP C 1 1
1 2 1 1 1 TRP CA C 2.092 0.000 -1.242 1.00 . A A . 1 TRP CA 1 1
1 3 1 1 1 TRP CB C 2.566 1.416 -1.574 1.00 . A A . 1 TRP CB 1 1
1 4 1 1 1 TRP CD1 C 4.877 2.166 -0.759 1.00 . A A . 1 TRP CD1 1 1
1 5 1 1 1 TRP CD2 C 3.249 2.385 0.763 1.00 . A A . 1 TRP CD2 1 1
1 6 1 1 1 TRP CE2 C 4.459 2.828 1.332 1.00 . A A . 1 TRP CE2 1 1
1 7 1 1 1 TRP CE3 C 2.085 2.431 1.535 1.00 . A A . 1 TRP CE3 1 1
1 8 1 1 1 TRP CG C 3.539 1.966 -0.575 1.00 . A A . 1 TRP CG 1 1
1 9 1 1 1 TRP CH2 C 3.380 3.342 3.370 1.00 . A A . 1 TRP CH2 1 1
1 10 1 1 1 TRP CZ2 C 4.535 3.308 2.637 1.00 . A A . 1 TRP CZ2 1 1
1 11 1 1 1 TRP CZ3 C 2.162 2.907 2.829 1.00 . A A . 1 TRP CZ3 1 1
1 12 1 1 1 TRP H1 H 1.807 0.000 0.856 1.00 . A A . 1 TRP H1 1 1
1 13 1 1 1 TRP HA H 1.440 -0.346 -2.031 1.00 . A A . 1 TRP HA 1 1
1 14 1 1 1 TRP HB2 H 3.047 1.411 -2.540 1.00 . A A . 1 TRP HB2 1 1
1 15 1 1 1 TRP HB3 H 1.710 2.076 -1.605 1.00 . A A . 1 TRP HB3 1 1
1 16 1 1 1 TRP HD1 H 5.405 1.943 -1.674 1.00 . A A . 1 TRP HD1 1 1
1 17 1 1 1 TRP HE1 H 6.383 2.913 0.500 1.00 . A A . 1 TRP HE1 1 1
1 18 1 1 1 TRP HE3 H 1.137 2.100 1.136 1.00 . A A . 1 TRP HE3 1 1
1 19 1 1 1 TRP HH2 H 3.394 3.706 4.385 1.00 . A A . 1 TRP HH2 1 1
1 20 1 1 1 TRP HZ2 H 5.466 3.647 3.067 1.00 . A A . 1 TRP HZ2 1 1
1 21 1 1 1 TRP HZ3 H 1.273 2.950 3.441 1.00 . A A . 1 TRP HZ3 1 1
1 22 1 1 1 TRP N N 1.328 0.000 0.000 1.00 . A A . 1 TRP N 1 1
1 23 1 1 1 TRP NE1 N 5.437 2.683 0.384 1.00 . A A . 1 TRP NE1 1 1
1 24 1 1 1 TRP O O 3.213 -1.995 -0.516 1.00 . A A . 1 TRP O 1 1
1 25 1 1 2 LYS C C 6.023 -1.687 -0.326 1.00 . A A . 2 LYS C 1 1
1 26 1 1 2 LYS CA C 5.608 -1.358 -1.756 1.00 . A A . 2 LYS CA 1 1
1 27 1 1 2 LYS CB C 6.744 -0.622 -2.471 1.00 . A A . 2 LYS CB 1 1
1 28 1 1 2 LYS CD C 8.083 0.606 -0.737 1.00 . A A . 2 LYS CD 1 1
1 29 1 1 2 LYS CE C 8.815 1.784 -1.362 1.00 . A A . 2 LYS CE 1 1
1 30 1 1 2 LYS CG C 8.039 -0.586 -1.678 1.00 . A A . 2 LYS CG 1 1
1 31 1 1 2 LYS H H 4.393 0.302 -2.258 1.00 . A A . 2 LYS H 1 1
1 32 1 1 2 LYS HA H 5.401 -2.279 -2.279 1.00 . A A . 2 LYS HA 1 1
1 33 1 1 2 LYS HB2 H 6.936 -1.112 -3.414 1.00 . A A . 2 LYS HB2 1 1
1 34 1 1 2 LYS HB3 H 6.434 0.396 -2.661 1.00 . A A . 2 LYS HB3 1 1
1 35 1 1 2 LYS HD2 H 7.073 0.907 -0.503 1.00 . A A . 2 LYS HD2 1 1
1 36 1 1 2 LYS HD3 H 8.594 0.317 0.171 1.00 . A A . 2 LYS HD3 1 1
1 37 1 1 2 LYS HE2 H 8.802 1.670 -2.435 1.00 . A A . 2 LYS HE2 1 1
1 38 1 1 2 LYS HE3 H 8.301 2.694 -1.091 1.00 . A A . 2 LYS HE3 1 1
1 39 1 1 2 LYS HG2 H 8.121 -1.493 -1.098 1.00 . A A . 2 LYS HG2 1 1
1 40 1 1 2 LYS HG3 H 8.869 -0.520 -2.367 1.00 . A A . 2 LYS HG3 1 1
1 41 1 1 2 LYS HZ1 H 10.486 2.859 -0.719 1.00 . A A . 2 LYS HZ1 1 1
1 42 1 1 2 LYS HZ2 H 10.864 1.481 -1.625 1.00 . A A . 2 LYS HZ2 1 1
1 43 1 1 2 LYS HZ3 H 10.350 1.323 -0.022 1.00 . A A . 2 LYS HZ3 1 1
1 44 1 1 2 LYS N N 4.394 -0.551 -1.772 1.00 . A A . 2 LYS N 1 1
1 45 1 1 2 LYS NZ N 10.228 1.868 -0.900 1.00 . A A . 2 LYS NZ 1 1
1 46 1 1 2 LYS O O 6.540 -2.771 -0.052 1.00 . A A . 2 LYS O 1 1
1 47 1 1 3 LEU C C 5.159 -1.888 2.668 1.00 . A A . 3 LEU C 1 1
1 48 1 1 3 LEU CA C 6.140 -0.938 1.988 1.00 . A A . 3 LEU CA 1 1
1 49 1 1 3 LEU CB C 6.155 0.406 2.718 1.00 . A A . 3 LEU CB 1 1
1 50 1 1 3 LEU CD1 C 5.322 0.044 5.054 1.00 . A A . 3 LEU CD1 1 1
1 51 1 1 3 LEU CD2 C 7.640 -0.660 4.433 1.00 . A A . 3 LEU CD2 1 1
1 52 1 1 3 LEU CG C 6.538 0.362 4.197 1.00 . A A . 3 LEU CG 1 1
1 53 1 1 3 LEU H H 5.377 0.096 0.306 1.00 . A A . 3 LEU H 1 1
1 54 1 1 3 LEU HA H 7.128 -1.371 2.028 1.00 . A A . 3 LEU HA 1 1
1 55 1 1 3 LEU HB2 H 6.860 1.048 2.213 1.00 . A A . 3 LEU HB2 1 1
1 56 1 1 3 LEU HB3 H 5.165 0.833 2.643 1.00 . A A . 3 LEU HB3 1 1
1 57 1 1 3 LEU HD11 H 5.235 0.777 5.842 1.00 . A A . 3 LEU HD11 1 1
1 58 1 1 3 LEU HD12 H 5.434 -0.939 5.487 1.00 . A A . 3 LEU HD12 1 1
1 59 1 1 3 LEU HD13 H 4.433 0.068 4.440 1.00 . A A . 3 LEU HD13 1 1
1 60 1 1 3 LEU HD21 H 7.793 -0.786 5.494 1.00 . A A . 3 LEU HD21 1 1
1 61 1 1 3 LEU HD22 H 8.555 -0.313 3.975 1.00 . A A . 3 LEU HD22 1 1
1 62 1 1 3 LEU HD23 H 7.355 -1.605 3.995 1.00 . A A . 3 LEU HD23 1 1
1 63 1 1 3 LEU HG H 6.911 1.333 4.495 1.00 . A A . 3 LEU HG 1 1
1 64 1 1 3 LEU N N 5.792 -0.747 0.584 1.00 . A A . 3 LEU N 1 1
1 65 1 1 3 LEU O O 5.418 -2.384 3.765 1.00 . A A . 3 LEU O 1 1
1 66 1 1 4 LEU C C 3.126 -4.422 1.932 1.00 . A A . 4 LEU C 1 1
1 67 1 1 4 LEU CA C 3.014 -3.031 2.548 1.00 . A A . 4 LEU CA 1 1
1 68 1 1 4 LEU CB C 1.619 -2.458 2.292 1.00 . A A . 4 LEU CB 1 1
1 69 1 1 4 LEU CD1 C 1.083 -2.142 4.720 1.00 . A A . 4 LEU CD1 1 1
1 70 1 1 4 LEU CD2 C 1.917 -0.212 3.364 1.00 . A A . 4 LEU CD2 1 1
1 71 1 1 4 LEU CG C 1.087 -1.488 3.347 1.00 . A A . 4 LEU CG 1 1
1 72 1 1 4 LEU H H 3.883 -1.714 1.139 1.00 . A A . 4 LEU H 1 1
1 73 1 1 4 LEU HA H 3.172 -3.109 3.614 1.00 . A A . 4 LEU HA 1 1
1 74 1 1 4 LEU HB2 H 1.644 -1.938 1.347 1.00 . A A . 4 LEU HB2 1 1
1 75 1 1 4 LEU HB3 H 0.928 -3.288 2.226 1.00 . A A . 4 LEU HB3 1 1
1 76 1 1 4 LEU HD11 H 1.678 -1.553 5.401 1.00 . A A . 4 LEU HD11 1 1
1 77 1 1 4 LEU HD12 H 1.498 -3.136 4.647 1.00 . A A . 4 LEU HD12 1 1
1 78 1 1 4 LEU HD13 H 0.069 -2.202 5.087 1.00 . A A . 4 LEU HD13 1 1
1 79 1 1 4 LEU HD21 H 2.458 -0.147 4.297 1.00 . A A . 4 LEU HD21 1 1
1 80 1 1 4 LEU HD22 H 1.265 0.643 3.266 1.00 . A A . 4 LEU HD22 1 1
1 81 1 1 4 LEU HD23 H 2.617 -0.227 2.541 1.00 . A A . 4 LEU HD23 1 1
1 82 1 1 4 LEU HG H 0.068 -1.221 3.102 1.00 . A A . 4 LEU HG 1 1
1 83 1 1 4 LEU N N 4.033 -2.138 2.009 1.00 . A A . 4 LEU N 1 1
1 84 1 1 4 LEU O O 2.884 -5.429 2.598 1.00 . A A . 4 LEU O 1 1
1 85 1 1 5 SER C C 4.988 -6.382 0.257 1.00 . A A . 5 SER C 1 1
1 86 1 1 5 SER CA C 3.640 -5.737 -0.051 1.00 . A A . 5 SER CA 1 1
1 87 1 1 5 SER CB C 3.497 -5.523 -1.559 1.00 . A A . 5 SER CB 1 1
1 88 1 1 5 SER H H 3.676 -3.633 0.179 1.00 . A A . 5 SER H 1 1
1 89 1 1 5 SER HA H 2.854 -6.396 0.286 1.00 . A A . 5 SER HA 1 1
1 90 1 1 5 SER HB2 H 4.345 -4.963 -1.923 1.00 . A A . 5 SER HB2 1 1
1 91 1 1 5 SER HB3 H 3.459 -6.482 -2.054 1.00 . A A . 5 SER HB3 1 1
1 92 1 1 5 SER HG H 2.429 -4.329 -2.688 1.00 . A A . 5 SER HG 1 1
1 93 1 1 5 SER N N 3.497 -4.470 0.656 1.00 . A A . 5 SER N 1 1
1 94 1 1 5 SER O O 5.105 -7.606 0.320 1.00 . A A . 5 SER O 1 1
1 95 1 1 5 SER OG O 2.313 -4.805 -1.862 1.00 . A A . 5 SER OG 1 1
1 96 1 1 6 LYS C C 7.388 -6.697 2.123 1.00 . A A . 6 LYS C 1 1
1 97 1 1 6 LYS CA C 7.346 -6.034 0.750 1.00 . A A . 6 LYS CA 1 1
1 98 1 1 6 LYS CB C 8.352 -4.882 0.698 1.00 . A A . 6 LYS CB 1 1
1 99 1 1 6 LYS CD C 9.761 -4.450 2.733 1.00 . A A . 6 LYS CD 1 1
1 100 1 1 6 LYS CE C 10.862 -3.401 2.708 1.00 . A A . 6 LYS CE 1 1
1 101 1 1 6 LYS CG C 9.661 -5.185 1.406 1.00 . A A . 6 LYS CG 1 1
1 102 1 1 6 LYS H H 5.850 -4.582 0.384 1.00 . A A . 6 LYS H 1 1
1 103 1 1 6 LYS HA H 7.611 -6.765 0.002 1.00 . A A . 6 LYS HA 1 1
1 104 1 1 6 LYS HB2 H 8.570 -4.656 -0.335 1.00 . A A . 6 LYS HB2 1 1
1 105 1 1 6 LYS HB3 H 7.909 -4.012 1.162 1.00 . A A . 6 LYS HB3 1 1
1 106 1 1 6 LYS HD2 H 8.819 -3.962 2.936 1.00 . A A . 6 LYS HD2 1 1
1 107 1 1 6 LYS HD3 H 9.974 -5.165 3.515 1.00 . A A . 6 LYS HD3 1 1
1 108 1 1 6 LYS HE2 H 11.297 -3.331 3.693 1.00 . A A . 6 LYS HE2 1 1
1 109 1 1 6 LYS HE3 H 11.619 -3.710 2.002 1.00 . A A . 6 LYS HE3 1 1
1 110 1 1 6 LYS HG2 H 9.723 -6.247 1.590 1.00 . A A . 6 LYS HG2 1 1
1 111 1 1 6 LYS HG3 H 10.482 -4.878 0.773 1.00 . A A . 6 LYS HG3 1 1
1 112 1 1 6 LYS HZ1 H 10.371 -1.962 1.275 1.00 . A A . 6 LYS HZ1 1 1
1 113 1 1 6 LYS HZ2 H 10.927 -1.314 2.736 1.00 . A A . 6 LYS HZ2 1 1
1 114 1 1 6 LYS HZ3 H 9.363 -1.949 2.633 1.00 . A A . 6 LYS HZ3 1 1
1 115 1 1 6 LYS N N 6.005 -5.548 0.448 1.00 . A A . 6 LYS N 1 1
1 116 1 1 6 LYS NZ N 10.344 -2.063 2.310 1.00 . A A . 6 LYS NZ 1 1
1 117 1 1 6 LYS O O 8.016 -7.741 2.300 1.00 . A A . 6 LYS O 1 1
1 118 1 1 7 ALA C C 5.646 -7.743 4.563 1.00 . A A . 7 ALA C 1 1
1 119 1 1 7 ALA CA C 6.671 -6.620 4.447 1.00 . A A . 7 ALA CA 1 1
1 120 1 1 7 ALA CB C 6.357 -5.512 5.441 1.00 . A A . 7 ALA CB 1 1
1 121 1 1 7 ALA H H 6.232 -5.257 2.889 1.00 . A A . 7 ALA H 1 1
1 122 1 1 7 ALA HA H 7.649 -7.014 4.682 1.00 . A A . 7 ALA HA 1 1
1 123 1 1 7 ALA HB1 H 6.106 -5.947 6.398 1.00 . A A . 7 ALA HB1 1 1
1 124 1 1 7 ALA HB2 H 7.220 -4.872 5.551 1.00 . A A . 7 ALA HB2 1 1
1 125 1 1 7 ALA HB3 H 5.521 -4.931 5.080 1.00 . A A . 7 ALA HB3 1 1
1 126 1 1 7 ALA N N 6.713 -6.086 3.091 1.00 . A A . 7 ALA N 1 1
1 127 1 1 7 ALA O O 5.862 -8.721 5.278 1.00 . A A . 7 ALA O 1 1
1 128 1 1 8 GLN C C 3.869 -9.830 3.076 1.00 . A A . 8 GLN C 1 1
1 129 1 1 8 GLN CA C 3.471 -8.597 3.881 1.00 . A A . 8 GLN CA 1 1
1 130 1 1 8 GLN CB C 2.171 -8.010 3.329 1.00 . A A . 8 GLN CB 1 1
1 131 1 1 8 GLN CD C -0.299 -8.452 3.628 1.00 . A A . 8 GLN CD 1 1
1 132 1 1 8 GLN CG C 1.044 -9.025 3.219 1.00 . A A . 8 GLN CG 1 1
1 133 1 1 8 GLN H H 4.416 -6.794 3.304 1.00 . A A . 8 GLN H 1 1
1 134 1 1 8 GLN HA H 3.316 -8.889 4.909 1.00 . A A . 8 GLN HA 1 1
1 135 1 1 8 GLN HB2 H 1.846 -7.212 3.979 1.00 . A A . 8 GLN HB2 1 1
1 136 1 1 8 GLN HB3 H 2.361 -7.608 2.345 1.00 . A A . 8 GLN HB3 1 1
1 137 1 1 8 GLN HE21 H 0.234 -8.505 5.542 1.00 . A A . 8 GLN HE21 1 1
1 138 1 1 8 GLN HE22 H -1.350 -7.897 5.220 1.00 . A A . 8 GLN HE22 1 1
1 139 1 1 8 GLN HG2 H 0.978 -9.360 2.195 1.00 . A A . 8 GLN HG2 1 1
1 140 1 1 8 GLN HG3 H 1.270 -9.865 3.858 1.00 . A A . 8 GLN HG3 1 1
1 141 1 1 8 GLN N N 4.530 -7.595 3.855 1.00 . A A . 8 GLN N 1 1
1 142 1 1 8 GLN NE2 N -0.492 -8.266 4.928 1.00 . A A . 8 GLN NE2 1 1
1 143 1 1 8 GLN O O 3.433 -10.942 3.370 1.00 . A A . 8 GLN O 1 1
1 144 1 1 8 GLN OE1 O -1.153 -8.179 2.784 1.00 . A A . 8 GLN OE1 1 1
1 145 1 1 9 GLU C C 5.762 -11.840 2.048 1.00 . A A . 9 GLU C 1 1
1 146 1 1 9 GLU CA C 5.154 -10.719 1.210 1.00 . A A . 9 GLU CA 1 1
1 147 1 1 9 GLU CB C 6.179 -10.214 0.192 1.00 . A A . 9 GLU CB 1 1
1 148 1 1 9 GLU CD C 7.367 -10.936 -1.917 1.00 . A A . 9 GLU CD 1 1
1 149 1 1 9 GLU CG C 6.931 -11.327 -0.518 1.00 . A A . 9 GLU CG 1 1
1 150 1 1 9 GLU H H 5.012 -8.714 1.873 1.00 . A A . 9 GLU H 1 1
1 151 1 1 9 GLU HA H 4.296 -11.106 0.680 1.00 . A A . 9 GLU HA 1 1
1 152 1 1 9 GLU HB2 H 5.668 -9.620 -0.552 1.00 . A A . 9 GLU HB2 1 1
1 153 1 1 9 GLU HB3 H 6.899 -9.591 0.704 1.00 . A A . 9 GLU HB3 1 1
1 154 1 1 9 GLU HG2 H 7.809 -11.576 0.059 1.00 . A A . 9 GLU HG2 1 1
1 155 1 1 9 GLU HG3 H 6.288 -12.192 -0.585 1.00 . A A . 9 GLU HG3 1 1
1 156 1 1 9 GLU N N 4.699 -9.623 2.058 1.00 . A A . 9 GLU N 1 1
1 157 1 1 9 GLU O O 5.590 -13.021 1.745 1.00 . A A . 9 GLU O 1 1
1 158 1 1 9 GLU OE1 O 7.327 -9.730 -2.236 1.00 . A A . 9 GLU OE1 1 1
1 159 1 1 9 GLU OE2 O 7.748 -11.838 -2.692 1.00 . A A . 9 GLU OE2 1 1
1 160 1 1 10 LYS C C 6.161 -12.851 5.105 1.00 . A A . 10 LYS C 1 1
1 161 1 1 10 LYS CA C 7.109 -12.432 3.987 1.00 . A A . 10 LYS CA 1 1
1 162 1 1 10 LYS CB C 8.392 -11.847 4.584 1.00 . A A . 10 LYS CB 1 1
1 163 1 1 10 LYS CD C 8.624 -9.381 5.003 1.00 . A A . 10 LYS CD 1 1
1 164 1 1 10 LYS CE C 10.133 -9.367 4.814 1.00 . A A . 10 LYS CE 1 1
1 165 1 1 10 LYS CG C 8.145 -10.711 5.561 1.00 . A A . 10 LYS CG 1 1
1 166 1 1 10 LYS H H 6.576 -10.504 3.293 1.00 . A A . 10 LYS H 1 1
1 167 1 1 10 LYS HA H 7.360 -13.302 3.399 1.00 . A A . 10 LYS HA 1 1
1 168 1 1 10 LYS HB2 H 8.923 -12.632 5.102 1.00 . A A . 10 LYS HB2 1 1
1 169 1 1 10 LYS HB3 H 9.011 -11.475 3.780 1.00 . A A . 10 LYS HB3 1 1
1 170 1 1 10 LYS HD2 H 8.151 -9.211 4.048 1.00 . A A . 10 LYS HD2 1 1
1 171 1 1 10 LYS HD3 H 8.348 -8.593 5.689 1.00 . A A . 10 LYS HD3 1 1
1 172 1 1 10 LYS HE2 H 10.389 -10.053 4.021 1.00 . A A . 10 LYS HE2 1 1
1 173 1 1 10 LYS HE3 H 10.438 -8.368 4.539 1.00 . A A . 10 LYS HE3 1 1
1 174 1 1 10 LYS HG2 H 7.086 -10.645 5.762 1.00 . A A . 10 LYS HG2 1 1
1 175 1 1 10 LYS HG3 H 8.675 -10.918 6.480 1.00 . A A . 10 LYS HG3 1 1
1 176 1 1 10 LYS HZ1 H 10.433 -9.295 6.880 1.00 . A A . 10 LYS HZ1 1 1
1 177 1 1 10 LYS HZ2 H 11.855 -9.506 5.987 1.00 . A A . 10 LYS HZ2 1 1
1 178 1 1 10 LYS HZ3 H 10.783 -10.799 6.189 1.00 . A A . 10 LYS HZ3 1 1
1 179 1 1 10 LYS N N 6.475 -11.461 3.103 1.00 . A A . 10 LYS N 1 1
1 180 1 1 10 LYS NZ N 10.851 -9.770 6.055 1.00 . A A . 10 LYS NZ 1 1
1 181 1 1 10 LYS O O 6.573 -13.483 6.078 1.00 . A A . 10 LYS O 1 1
1 182 1 1 11 PHE C C 2.777 -13.693 5.346 1.00 . A A . 11 PHE C 1 1
1 183 1 1 11 PHE CA C 3.881 -12.835 5.958 1.00 . A A . 11 PHE CA 1 1
1 184 1 1 11 PHE CB C 3.280 -11.564 6.560 1.00 . A A . 11 PHE CB 1 1
1 185 1 1 11 PHE CD1 C 5.356 -11.326 7.949 1.00 . A A . 11 PHE CD1 1 1
1 186 1 1 11 PHE CD2 C 4.126 -9.357 7.404 1.00 . A A . 11 PHE CD2 1 1
1 187 1 1 11 PHE CE1 C 6.272 -10.563 8.649 1.00 . A A . 11 PHE CE1 1 1
1 188 1 1 11 PHE CE2 C 5.039 -8.589 8.103 1.00 . A A . 11 PHE CE2 1 1
1 189 1 1 11 PHE CG C 4.274 -10.732 7.320 1.00 . A A . 11 PHE CG 1 1
1 190 1 1 11 PHE CZ C 6.114 -9.193 8.725 1.00 . A A . 11 PHE CZ 1 1
1 191 1 1 11 PHE H H 4.621 -11.992 4.162 1.00 . A A . 11 PHE H 1 1
1 192 1 1 11 PHE HA H 4.367 -13.399 6.740 1.00 . A A . 11 PHE HA 1 1
1 193 1 1 11 PHE HB2 H 2.876 -10.954 5.766 1.00 . A A . 11 PHE HB2 1 1
1 194 1 1 11 PHE HB3 H 2.486 -11.836 7.239 1.00 . A A . 11 PHE HB3 1 1
1 195 1 1 11 PHE HD1 H 5.482 -12.397 7.890 1.00 . A A . 11 PHE HD1 1 1
1 196 1 1 11 PHE HD2 H 3.286 -8.883 6.917 1.00 . A A . 11 PHE HD2 1 1
1 197 1 1 11 PHE HE1 H 7.112 -11.038 9.135 1.00 . A A . 11 PHE HE1 1 1
1 198 1 1 11 PHE HE2 H 4.912 -7.518 8.160 1.00 . A A . 11 PHE HE2 1 1
1 199 1 1 11 PHE HZ H 6.828 -8.595 9.272 1.00 . A A . 11 PHE HZ 1 1
1 200 1 1 11 PHE N N 4.888 -12.495 4.960 1.00 . A A . 11 PHE N 1 1
1 201 1 1 11 PHE O O 2.200 -14.551 6.014 1.00 . A A . 11 PHE O 1 1
1 202 1 1 12 GLY C C 1.918 -15.595 2.988 1.00 . A A . 12 GLY C 1 1
1 203 1 1 12 GLY CA C 1.453 -14.210 3.390 1.00 . A A . 12 GLY CA 1 1
1 204 1 1 12 GLY H H 2.980 -12.756 3.589 1.00 . A A . 12 GLY H 1 1
1 205 1 1 12 GLY HA2 H 0.600 -14.304 4.045 1.00 . A A . 12 GLY HA2 1 1
1 206 1 1 12 GLY HA3 H 1.155 -13.672 2.502 1.00 . A A . 12 GLY HA3 1 1
1 207 1 1 12 GLY N N 2.487 -13.453 4.071 1.00 . A A . 12 GLY N 1 1
1 208 1 1 12 GLY O O 3.045 -15.768 2.522 1.00 . A A . 12 GLY O 1 1
2 209 1 1 1 TRP C C 3.427 -0.951 -1.182 1.00 . A A . 1 TRP C 1 1
2 210 1 1 1 TRP CA C 2.237 -0.007 -1.310 1.00 . A A . 1 TRP CA 1 1
2 211 1 1 1 TRP CB C 2.724 1.404 -1.646 1.00 . A A . 1 TRP CB 1 1
2 212 1 1 1 TRP CD1 C 5.023 2.150 -0.795 1.00 . A A . 1 TRP CD1 1 1
2 213 1 1 1 TRP CD2 C 3.368 2.391 0.694 1.00 . A A . 1 TRP CD2 1 1
2 214 1 1 1 TRP CE2 C 4.569 2.834 1.282 1.00 . A A . 1 TRP CE2 1 1
2 215 1 1 1 TRP CE3 C 2.190 2.449 1.444 1.00 . A A . 1 TRP CE3 1 1
2 216 1 1 1 TRP CG C 3.681 1.959 -0.634 1.00 . A A . 1 TRP CG 1 1
2 217 1 1 1 TRP CH2 C 3.455 3.372 3.294 1.00 . A A . 1 TRP CH2 1 1
2 218 1 1 1 TRP CZ2 C 4.623 3.326 2.583 1.00 . A A . 1 TRP CZ2 1 1
2 219 1 1 1 TRP CZ3 C 2.245 2.938 2.735 1.00 . A A . 1 TRP CZ3 1 1
2 220 1 1 1 TRP H1 H 1.913 0.014 0.782 1.00 . A A . 1 TRP H1 1 1
2 221 1 1 1 TRP HA H 1.599 -0.357 -2.108 1.00 . A A . 1 TRP HA 1 1
2 222 1 1 1 TRP HB2 H 3.223 1.388 -2.603 1.00 . A A . 1 TRP HB2 1 1
2 223 1 1 1 TRP HB3 H 1.872 2.067 -1.699 1.00 . A A . 1 TRP HB3 1 1
2 224 1 1 1 TRP HD1 H 5.567 1.917 -1.697 1.00 . A A . 1 TRP HD1 1 1
2 225 1 1 1 TRP HE1 H 6.508 2.903 0.486 1.00 . A A . 1 TRP HE1 1 1
2 226 1 1 1 TRP HE3 H 1.248 2.120 1.031 1.00 . A A . 1 TRP HE3 1 1
2 227 1 1 1 TRP HH2 H 3.451 3.746 4.307 1.00 . A A . 1 TRP HH2 1 1
2 228 1 1 1 TRP HZ2 H 5.547 3.665 3.028 1.00 . A A . 1 TRP HZ2 1 1
2 229 1 1 1 TRP HZ3 H 1.345 2.990 3.330 1.00 . A A . 1 TRP HZ3 1 1
2 230 1 1 1 TRP N N 1.450 0.008 -0.082 1.00 . A A . 1 TRP N 1 1
2 231 1 1 1 TRP NE1 N 5.564 2.676 0.354 1.00 . A A . 1 TRP NE1 1 1
2 232 1 1 1 TRP O O 3.335 -2.000 -0.544 1.00 . A A . 1 TRP O 1 1
2 233 1 1 2 LYS C C 6.142 -1.703 -0.304 1.00 . A A . 2 LYS C 1 1
2 234 1 1 2 LYS CA C 5.756 -1.385 -1.745 1.00 . A A . 2 LYS CA 1 1
2 235 1 1 2 LYS CB C 6.908 -0.661 -2.445 1.00 . A A . 2 LYS CB 1 1
2 236 1 1 2 LYS CD C 8.221 0.576 -0.698 1.00 . A A . 2 LYS CD 1 1
2 237 1 1 2 LYS CE C 8.970 1.744 -1.320 1.00 . A A . 2 LYS CE 1 1
2 238 1 1 2 LYS CG C 8.188 -0.624 -1.629 1.00 . A A . 2 LYS CG 1 1
2 239 1 1 2 LYS H H 4.558 0.275 -2.285 1.00 . A A . 2 LYS H 1 1
2 240 1 1 2 LYS HA H 5.555 -2.310 -2.263 1.00 . A A . 2 LYS HA 1 1
2 241 1 1 2 LYS HB2 H 7.116 -1.161 -3.380 1.00 . A A . 2 LYS HB2 1 1
2 242 1 1 2 LYS HB3 H 6.607 0.356 -2.650 1.00 . A A . 2 LYS HB3 1 1
2 243 1 1 2 LYS HD2 H 7.208 0.884 -0.486 1.00 . A A . 2 LYS HD2 1 1
2 244 1 1 2 LYS HD3 H 8.713 0.293 0.223 1.00 . A A . 2 LYS HD3 1 1
2 245 1 1 2 LYS HE2 H 9.515 2.260 -0.544 1.00 . A A . 2 LYS HE2 1 1
2 246 1 1 2 LYS HE3 H 9.665 1.361 -2.052 1.00 . A A . 2 LYS HE3 1 1
2 247 1 1 2 LYS HG2 H 8.255 -1.526 -1.039 1.00 . A A . 2 LYS HG2 1 1
2 248 1 1 2 LYS HG3 H 9.032 -0.569 -2.303 1.00 . A A . 2 LYS HG3 1 1
2 249 1 1 2 LYS HZ1 H 8.589 3.406 -2.527 1.00 . A A . 2 LYS HZ1 1 1
2 250 1 1 2 LYS HZ2 H 7.474 3.201 -1.271 1.00 . A A . 2 LYS HZ2 1 1
2 251 1 1 2 LYS HZ3 H 7.410 2.199 -2.632 1.00 . A A . 2 LYS HZ3 1 1
2 252 1 1 2 LYS N N 4.546 -0.573 -1.792 1.00 . A A . 2 LYS N 1 1
2 253 1 1 2 LYS NZ N 8.046 2.705 -1.984 1.00 . A A . 2 LYS NZ 1 1
2 254 1 1 2 LYS O O 6.649 -2.787 -0.011 1.00 . A A . 2 LYS O 1 1
2 255 1 1 3 LEU C C 5.222 -1.872 2.674 1.00 . A A . 3 LEU C 1 1
2 256 1 1 3 LEU CA C 6.220 -0.933 2.004 1.00 . A A . 3 LEU CA 1 1
2 257 1 1 3 LEU CB C 6.228 0.418 2.721 1.00 . A A . 3 LEU CB 1 1
2 258 1 1 3 LEU CD1 C 5.350 0.082 5.045 1.00 . A A . 3 LEU CD1 1 1
2 259 1 1 3 LEU CD2 C 7.676 -0.639 4.474 1.00 . A A . 3 LEU CD2 1 1
2 260 1 1 3 LEU CG C 6.583 0.386 4.208 1.00 . A A . 3 LEU CG 1 1
2 261 1 1 3 LEU H H 5.493 0.089 0.299 1.00 . A A . 3 LEU H 1 1
2 262 1 1 3 LEU HA H 7.205 -1.370 2.066 1.00 . A A . 3 LEU HA 1 1
2 263 1 1 3 LEU HB2 H 6.945 1.052 2.224 1.00 . A A . 3 LEU HB2 1 1
2 264 1 1 3 LEU HB3 H 5.241 0.849 2.625 1.00 . A A . 3 LEU HB3 1 1
2 265 1 1 3 LEU HD11 H 5.449 -0.897 5.489 1.00 . A A . 3 LEU HD11 1 1
2 266 1 1 3 LEU HD12 H 4.473 0.105 4.415 1.00 . A A . 3 LEU HD12 1 1
2 267 1 1 3 LEU HD13 H 5.252 0.824 5.824 1.00 . A A . 3 LEU HD13 1 1
2 268 1 1 3 LEU HD21 H 7.809 -0.755 5.539 1.00 . A A . 3 LEU HD21 1 1
2 269 1 1 3 LEU HD22 H 8.601 -0.301 4.030 1.00 . A A . 3 LEU HD22 1 1
2 270 1 1 3 LEU HD23 H 7.394 -1.587 4.039 1.00 . A A . 3 LEU HD23 1 1
2 271 1 1 3 LEU HG H 6.955 1.358 4.504 1.00 . A A . 3 LEU HG 1 1
2 272 1 1 3 LEU N N 5.899 -0.753 0.592 1.00 . A A . 3 LEU N 1 1
2 273 1 1 3 LEU O O 5.458 -2.359 3.781 1.00 . A A . 3 LEU O 1 1
2 274 1 1 4 LEU C C 3.191 -4.404 1.924 1.00 . A A . 4 LEU C 1 1
2 275 1 1 4 LEU CA C 3.074 -3.007 2.525 1.00 . A A . 4 LEU CA 1 1
2 276 1 1 4 LEU CB C 1.686 -2.430 2.237 1.00 . A A . 4 LEU CB 1 1
2 277 1 1 4 LEU CD1 C 1.105 -2.088 4.651 1.00 . A A . 4 LEU CD1 1 1
2 278 1 1 4 LEU CD2 C 1.976 -0.175 3.295 1.00 . A A . 4 LEU CD2 1 1
2 279 1 1 4 LEU CG C 1.140 -1.447 3.273 1.00 . A A . 4 LEU CG 1 1
2 280 1 1 4 LEU H H 3.976 -1.706 1.120 1.00 . A A . 4 LEU H 1 1
2 281 1 1 4 LEU HA H 3.211 -3.075 3.594 1.00 . A A . 4 LEU HA 1 1
2 282 1 1 4 LEU HB2 H 1.732 -1.918 1.288 1.00 . A A . 4 LEU HB2 1 1
2 283 1 1 4 LEU HB3 H 0.994 -3.257 2.166 1.00 . A A . 4 LEU HB3 1 1
2 284 1 1 4 LEU HD11 H 1.519 -3.084 4.596 1.00 . A A . 4 LEU HD11 1 1
2 285 1 1 4 LEU HD12 H 0.084 -2.141 4.998 1.00 . A A . 4 LEU HD12 1 1
2 286 1 1 4 LEU HD13 H 1.688 -1.493 5.340 1.00 . A A . 4 LEU HD13 1 1
2 287 1 1 4 LEU HD21 H 1.330 0.682 3.178 1.00 . A A . 4 LEU HD21 1 1
2 288 1 1 4 LEU HD22 H 2.690 -0.201 2.485 1.00 . A A . 4 LEU HD22 1 1
2 289 1 1 4 LEU HD23 H 2.501 -0.106 4.236 1.00 . A A . 4 LEU HD23 1 1
2 290 1 1 4 LEU HG H 0.127 -1.178 3.005 1.00 . A A . 4 LEU HG 1 1
2 291 1 1 4 LEU N N 4.107 -2.124 1.997 1.00 . A A . 4 LEU N 1 1
2 292 1 1 4 LEU O O 2.932 -5.403 2.595 1.00 . A A . 4 LEU O 1 1
2 293 1 1 5 SER C C 5.075 -6.387 0.303 1.00 . A A . 5 SER C 1 1
2 294 1 1 5 SER CA C 3.736 -5.740 -0.036 1.00 . A A . 5 SER CA 1 1
2 295 1 1 5 SER CB C 3.622 -5.539 -1.548 1.00 . A A . 5 SER CB 1 1
2 296 1 1 5 SER H H 3.777 -3.634 0.175 1.00 . A A . 5 SER H 1 1
2 297 1 1 5 SER HA H 2.941 -6.392 0.293 1.00 . A A . 5 SER HA 1 1
2 298 1 1 5 SER HB2 H 4.479 -4.987 -1.901 1.00 . A A . 5 SER HB2 1 1
2 299 1 1 5 SER HB3 H 3.589 -6.504 -2.035 1.00 . A A . 5 SER HB3 1 1
2 300 1 1 5 SER HG H 1.696 -5.418 -1.886 1.00 . A A . 5 SER HG 1 1
2 301 1 1 5 SER N N 3.585 -4.465 0.656 1.00 . A A . 5 SER N 1 1
2 302 1 1 5 SER O O 5.185 -7.611 0.380 1.00 . A A . 5 SER O 1 1
2 303 1 1 5 SER OG O 2.447 -4.820 -1.880 1.00 . A A . 5 SER OG 1 1
2 304 1 1 6 LYS C C 7.438 -6.696 2.217 1.00 . A A . 6 LYS C 1 1
2 305 1 1 6 LYS CA C 7.425 -6.045 0.837 1.00 . A A . 6 LYS CA 1 1
2 306 1 1 6 LYS CB C 8.437 -4.898 0.794 1.00 . A A . 6 LYS CB 1 1
2 307 1 1 6 LYS CD C 9.809 -4.453 2.850 1.00 . A A . 6 LYS CD 1 1
2 308 1 1 6 LYS CE C 10.915 -3.410 2.837 1.00 . A A . 6 LYS CE 1 1
2 309 1 1 6 LYS CG C 9.731 -5.200 1.529 1.00 . A A . 6 LYS CG 1 1
2 310 1 1 6 LYS H H 5.942 -4.591 0.430 1.00 . A A . 6 LYS H 1 1
2 311 1 1 6 LYS HA H 7.701 -6.785 0.101 1.00 . A A . 6 LYS HA 1 1
2 312 1 1 6 LYS HB2 H 8.675 -4.683 -0.237 1.00 . A A . 6 LYS HB2 1 1
2 313 1 1 6 LYS HB3 H 7.989 -4.022 1.241 1.00 . A A . 6 LYS HB3 1 1
2 314 1 1 6 LYS HD2 H 8.866 -3.959 3.031 1.00 . A A . 6 LYS HD2 1 1
2 315 1 1 6 LYS HD3 H 10.004 -5.162 3.643 1.00 . A A . 6 LYS HD3 1 1
2 316 1 1 6 LYS HE2 H 11.760 -3.806 2.294 1.00 . A A . 6 LYS HE2 1 1
2 317 1 1 6 LYS HE3 H 10.550 -2.524 2.338 1.00 . A A . 6 LYS HE3 1 1
2 318 1 1 6 LYS HG2 H 9.785 -6.261 1.724 1.00 . A A . 6 LYS HG2 1 1
2 319 1 1 6 LYS HG3 H 10.565 -4.903 0.909 1.00 . A A . 6 LYS HG3 1 1
2 320 1 1 6 LYS HZ1 H 12.244 -2.514 4.176 1.00 . A A . 6 LYS HZ1 1 1
2 321 1 1 6 LYS HZ2 H 11.496 -3.905 4.781 1.00 . A A . 6 LYS HZ2 1 1
2 322 1 1 6 LYS HZ3 H 10.628 -2.458 4.674 1.00 . A A . 6 LYS HZ3 1 1
2 323 1 1 6 LYS N N 6.092 -5.557 0.505 1.00 . A A . 6 LYS N 1 1
2 324 1 1 6 LYS NZ N 11.352 -3.046 4.213 1.00 . A A . 6 LYS NZ 1 1
2 325 1 1 6 LYS O O 8.058 -7.741 2.415 1.00 . A A . 6 LYS O 1 1
2 326 1 1 7 ALA C C 5.645 -7.711 4.633 1.00 . A A . 7 ALA C 1 1
2 327 1 1 7 ALA CA C 6.678 -6.594 4.526 1.00 . A A . 7 ALA CA 1 1
2 328 1 1 7 ALA CB C 6.351 -5.475 5.504 1.00 . A A . 7 ALA CB 1 1
2 329 1 1 7 ALA H H 6.275 -5.244 2.947 1.00 . A A . 7 ALA H 1 1
2 330 1 1 7 ALA HA H 7.650 -6.990 4.783 1.00 . A A . 7 ALA HA 1 1
2 331 1 1 7 ALA HB1 H 7.215 -4.837 5.621 1.00 . A A . 7 ALA HB1 1 1
2 332 1 1 7 ALA HB2 H 5.524 -4.895 5.123 1.00 . A A . 7 ALA HB2 1 1
2 333 1 1 7 ALA HB3 H 6.084 -5.899 6.460 1.00 . A A . 7 ALA HB3 1 1
2 334 1 1 7 ALA N N 6.748 -6.073 3.167 1.00 . A A . 7 ALA N 1 1
2 335 1 1 7 ALA O O 5.843 -8.683 5.361 1.00 . A A . 7 ALA O 1 1
2 336 1 1 8 GLN C C 3.886 -9.803 3.133 1.00 . A A . 8 GLN C 1 1
2 337 1 1 8 GLN CA C 3.480 -8.561 3.919 1.00 . A A . 8 GLN CA 1 1
2 338 1 1 8 GLN CB C 2.193 -7.973 3.337 1.00 . A A . 8 GLN CB 1 1
2 339 1 1 8 GLN CD C -0.285 -8.396 3.585 1.00 . A A . 8 GLN CD 1 1
2 340 1 1 8 GLN CG C 1.063 -8.983 3.217 1.00 . A A . 8 GLN CG 1 1
2 341 1 1 8 GLN H H 4.444 -6.767 3.343 1.00 . A A . 8 GLN H 1 1
2 342 1 1 8 GLN HA H 3.304 -8.842 4.946 1.00 . A A . 8 GLN HA 1 1
2 343 1 1 8 GLN HB2 H 1.860 -7.167 3.973 1.00 . A A . 8 GLN HB2 1 1
2 344 1 1 8 GLN HB3 H 2.403 -7.582 2.353 1.00 . A A . 8 GLN HB3 1 1
2 345 1 1 8 GLN HE21 H -0.486 -9.720 5.056 1.00 . A A . 8 GLN HE21 1 1
2 346 1 1 8 GLN HE22 H -1.792 -8.605 4.865 1.00 . A A . 8 GLN HE22 1 1
2 347 1 1 8 GLN HG2 H 1.018 -9.334 2.197 1.00 . A A . 8 GLN HG2 1 1
2 348 1 1 8 GLN HG3 H 1.270 -9.815 3.874 1.00 . A A . 8 GLN HG3 1 1
2 349 1 1 8 GLN N N 4.544 -7.564 3.904 1.00 . A A . 8 GLN N 1 1
2 350 1 1 8 GLN NE2 N -0.920 -8.965 4.604 1.00 . A A . 8 GLN NE2 1 1
2 351 1 1 8 GLN O O 3.439 -10.910 3.429 1.00 . A A . 8 GLN O 1 1
2 352 1 1 8 GLN OE1 O -0.752 -7.443 2.961 1.00 . A A . 8 GLN OE1 1 1
2 353 1 1 9 GLU C C 5.788 -11.832 2.160 1.00 . A A . 9 GLU C 1 1
2 354 1 1 9 GLU CA C 5.202 -10.716 1.300 1.00 . A A . 9 GLU CA 1 1
2 355 1 1 9 GLU CB C 6.250 -10.226 0.298 1.00 . A A . 9 GLU CB 1 1
2 356 1 1 9 GLU CD C 7.517 -10.957 -1.761 1.00 . A A . 9 GLU CD 1 1
2 357 1 1 9 GLU CG C 7.009 -11.349 -0.387 1.00 . A A . 9 GLU CG 1 1
2 358 1 1 9 GLU H H 5.059 -8.704 1.942 1.00 . A A . 9 GLU H 1 1
2 359 1 1 9 GLU HA H 4.353 -11.104 0.758 1.00 . A A . 9 GLU HA 1 1
2 360 1 1 9 GLU HB2 H 5.757 -9.636 -0.461 1.00 . A A . 9 GLU HB2 1 1
2 361 1 1 9 GLU HB3 H 6.963 -9.603 0.818 1.00 . A A . 9 GLU HB3 1 1
2 362 1 1 9 GLU HG2 H 7.854 -11.622 0.227 1.00 . A A . 9 GLU HG2 1 1
2 363 1 1 9 GLU HG3 H 6.352 -12.200 -0.491 1.00 . A A . 9 GLU HG3 1 1
2 364 1 1 9 GLU N N 4.737 -9.610 2.129 1.00 . A A . 9 GLU N 1 1
2 365 1 1 9 GLU O O 5.616 -13.015 1.865 1.00 . A A . 9 GLU O 1 1
2 366 1 1 9 GLU OE1 O 8.596 -10.332 -1.838 1.00 . A A . 9 GLU OE1 1 1
2 367 1 1 9 GLU OE2 O 6.836 -11.274 -2.758 1.00 . A A . 9 GLU OE2 1 1
2 368 1 1 10 LYS C C 6.122 -12.816 5.235 1.00 . A A . 10 LYS C 1 1
2 369 1 1 10 LYS CA C 7.094 -12.413 4.130 1.00 . A A . 10 LYS CA 1 1
2 370 1 1 10 LYS CB C 8.369 -11.831 4.745 1.00 . A A . 10 LYS CB 1 1
2 371 1 1 10 LYS CD C 8.605 -9.361 5.139 1.00 . A A . 10 LYS CD 1 1
2 372 1 1 10 LYS CE C 10.117 -9.358 4.969 1.00 . A A . 10 LYS CE 1 1
2 373 1 1 10 LYS CG C 8.111 -10.682 5.705 1.00 . A A . 10 LYS CG 1 1
2 374 1 1 10 LYS H H 6.585 -10.489 3.409 1.00 . A A . 10 LYS H 1 1
2 375 1 1 10 LYS HA H 7.350 -13.290 3.556 1.00 . A A . 10 LYS HA 1 1
2 376 1 1 10 LYS HB2 H 8.885 -12.613 5.283 1.00 . A A . 10 LYS HB2 1 1
2 377 1 1 10 LYS HB3 H 9.006 -11.471 3.950 1.00 . A A . 10 LYS HB3 1 1
2 378 1 1 10 LYS HD2 H 8.146 -9.197 4.176 1.00 . A A . 10 LYS HD2 1 1
2 379 1 1 10 LYS HD3 H 8.326 -8.564 5.814 1.00 . A A . 10 LYS HD3 1 1
2 380 1 1 10 LYS HE2 H 10.514 -8.457 5.411 1.00 . A A . 10 LYS HE2 1 1
2 381 1 1 10 LYS HE3 H 10.525 -10.219 5.479 1.00 . A A . 10 LYS HE3 1 1
2 382 1 1 10 LYS HG2 H 7.050 -10.608 5.887 1.00 . A A . 10 LYS HG2 1 1
2 383 1 1 10 LYS HG3 H 8.625 -10.880 6.635 1.00 . A A . 10 LYS HG3 1 1
2 384 1 1 10 LYS HZ1 H 11.422 -8.924 3.397 1.00 . A A . 10 LYS HZ1 1 1
2 385 1 1 10 LYS HZ2 H 9.791 -8.947 2.947 1.00 . A A . 10 LYS HZ2 1 1
2 386 1 1 10 LYS HZ3 H 10.612 -10.399 3.227 1.00 . A A . 10 LYS HZ3 1 1
2 387 1 1 10 LYS N N 6.483 -11.447 3.226 1.00 . A A . 10 LYS N 1 1
2 388 1 1 10 LYS NZ N 10.514 -9.411 3.535 1.00 . A A . 10 LYS NZ 1 1
2 389 1 1 10 LYS O O 6.513 -13.438 6.223 1.00 . A A . 10 LYS O 1 1
2 390 1 1 11 PHE C C 2.731 -13.641 5.420 1.00 . A A . 11 PHE C 1 1
2 391 1 1 11 PHE CA C 3.827 -12.781 6.043 1.00 . A A . 11 PHE CA 1 1
2 392 1 1 11 PHE CB C 3.220 -11.500 6.620 1.00 . A A . 11 PHE CB 1 1
2 393 1 1 11 PHE CD1 C 5.266 -11.259 8.052 1.00 . A A . 11 PHE CD1 1 1
2 394 1 1 11 PHE CD2 C 4.061 -9.289 7.456 1.00 . A A . 11 PHE CD2 1 1
2 395 1 1 11 PHE CE1 C 6.170 -10.494 8.764 1.00 . A A . 11 PHE CE1 1 1
2 396 1 1 11 PHE CE2 C 4.963 -8.519 8.166 1.00 . A A . 11 PHE CE2 1 1
2 397 1 1 11 PHE CG C 4.202 -10.666 7.392 1.00 . A A . 11 PHE CG 1 1
2 398 1 1 11 PHE CZ C 6.020 -9.122 8.820 1.00 . A A . 11 PHE CZ 1 1
2 399 1 1 11 PHE H H 4.605 -11.962 4.253 1.00 . A A . 11 PHE H 1 1
2 400 1 1 11 PHE HA H 4.295 -13.338 6.840 1.00 . A A . 11 PHE HA 1 1
2 401 1 1 11 PHE HB2 H 2.836 -10.897 5.811 1.00 . A A . 11 PHE HB2 1 1
2 402 1 1 11 PHE HB3 H 2.410 -11.762 7.284 1.00 . A A . 11 PHE HB3 1 1
2 403 1 1 11 PHE HD1 H 5.386 -12.332 8.008 1.00 . A A . 11 PHE HD1 1 1
2 404 1 1 11 PHE HD2 H 3.235 -8.816 6.945 1.00 . A A . 11 PHE HD2 1 1
2 405 1 1 11 PHE HE1 H 6.996 -10.968 9.274 1.00 . A A . 11 PHE HE1 1 1
2 406 1 1 11 PHE HE2 H 4.842 -7.447 8.208 1.00 . A A . 11 PHE HE2 1 1
2 407 1 1 11 PHE HZ H 6.725 -8.522 9.375 1.00 . A A . 11 PHE HZ 1 1
2 408 1 1 11 PHE N N 4.855 -12.457 5.061 1.00 . A A . 11 PHE N 1 1
2 409 1 1 11 PHE O O 2.138 -14.489 6.085 1.00 . A A . 11 PHE O 1 1
2 410 1 1 12 GLY C C 1.827 -15.629 3.259 1.00 . A A . 12 GLY C 1 1
2 411 1 1 12 GLY CA C 1.443 -14.174 3.444 1.00 . A A . 12 GLY CA 1 1
2 412 1 1 12 GLY H H 2.972 -12.725 3.656 1.00 . A A . 12 GLY H 1 1
2 413 1 1 12 GLY HA2 H 0.526 -14.124 4.013 1.00 . A A . 12 GLY HA2 1 1
2 414 1 1 12 GLY HA3 H 1.277 -13.732 2.473 1.00 . A A . 12 GLY HA3 1 1
2 415 1 1 12 GLY N N 2.467 -13.414 4.137 1.00 . A A . 12 GLY N 1 1
2 416 1 1 12 GLY O O 2.051 -16.081 2.136 1.00 . A A . 12 GLY O 1 1
3 417 1 1 1 TRP C C 3.268 -0.944 -1.184 1.00 . A A . 1 TRP C 1 1
3 418 1 1 1 TRP CA C 2.068 -0.006 -1.256 1.00 . A A . 1 TRP CA 1 1
3 419 1 1 1 TRP CB C 2.534 1.413 -1.587 1.00 . A A . 1 TRP CB 1 1
3 420 1 1 1 TRP CD1 C 4.858 2.160 -0.808 1.00 . A A . 1 TRP CD1 1 1
3 421 1 1 1 TRP CD2 C 3.256 2.370 0.742 1.00 . A A . 1 TRP CD2 1 1
3 422 1 1 1 TRP CE2 C 4.475 2.811 1.293 1.00 . A A . 1 TRP CE2 1 1
3 423 1 1 1 TRP CE3 C 2.106 2.410 1.535 1.00 . A A . 1 TRP CE3 1 1
3 424 1 1 1 TRP CG C 3.523 1.958 -0.603 1.00 . A A . 1 TRP CG 1 1
3 425 1 1 1 TRP CH2 C 3.432 3.313 3.352 1.00 . A A . 1 TRP CH2 1 1
3 426 1 1 1 TRP CZ2 C 4.574 3.284 2.599 1.00 . A A . 1 TRP CZ2 1 1
3 427 1 1 1 TRP CZ3 C 2.205 2.880 2.830 1.00 . A A . 1 TRP CZ3 1 1
3 428 1 1 1 TRP H1 H 1.817 -0.015 0.846 1.00 . A A . 1 TRP H1 1 1
3 429 1 1 1 TRP HA H 1.404 -0.348 -2.036 1.00 . A A . 1 TRP HA 1 1
3 430 1 1 1 TRP HB2 H 2.998 1.414 -2.562 1.00 . A A . 1 TRP HB2 1 1
3 431 1 1 1 TRP HB3 H 1.677 2.071 -1.599 1.00 . A A . 1 TRP HB3 1 1
3 432 1 1 1 TRP HD1 H 5.370 1.942 -1.733 1.00 . A A . 1 TRP HD1 1 1
3 433 1 1 1 TRP HE1 H 6.385 2.902 0.429 1.00 . A A . 1 TRP HE1 1 1
3 434 1 1 1 TRP HE3 H 1.151 2.081 1.150 1.00 . A A . 1 TRP HE3 1 1
3 435 1 1 1 TRP HH2 H 3.463 3.672 4.369 1.00 . A A . 1 TRP HH2 1 1
3 436 1 1 1 TRP HZ2 H 5.512 3.622 3.015 1.00 . A A . 1 TRP HZ2 1 1
3 437 1 1 1 TRP HZ3 H 1.327 2.919 3.458 1.00 . A A . 1 TRP HZ3 1 1
3 438 1 1 1 TRP N N 1.324 -0.014 -0.001 1.00 . A A . 1 TRP N 1 1
3 439 1 1 1 TRP NE1 N 5.437 2.672 0.328 1.00 . A A . 1 TRP NE1 1 1
3 440 1 1 1 TRP O O 3.204 -2.002 -0.558 1.00 . A A . 1 TRP O 1 1
3 441 1 1 2 LYS C C 6.014 -1.695 -0.415 1.00 . A A . 2 LYS C 1 1
3 442 1 1 2 LYS CA C 5.576 -1.356 -1.837 1.00 . A A . 2 LYS CA 1 1
3 443 1 1 2 LYS CB C 6.700 -0.613 -2.564 1.00 . A A . 2 LYS CB 1 1
3 444 1 1 2 LYS CD C 8.064 0.618 -0.851 1.00 . A A . 2 LYS CD 1 1
3 445 1 1 2 LYS CE C 8.763 1.803 -1.499 1.00 . A A . 2 LYS CE 1 1
3 446 1 1 2 LYS CG C 8.005 -0.576 -1.789 1.00 . A A . 2 LYS CG 1 1
3 447 1 1 2 LYS H H 4.350 0.304 -2.310 1.00 . A A . 2 LYS H 1 1
3 448 1 1 2 LYS HA H 5.363 -2.273 -2.364 1.00 . A A . 2 LYS HA 1 1
3 449 1 1 2 LYS HB2 H 6.881 -1.098 -3.511 1.00 . A A . 2 LYS HB2 1 1
3 450 1 1 2 LYS HB3 H 6.384 0.405 -2.745 1.00 . A A . 2 LYS HB3 1 1
3 451 1 1 2 LYS HD2 H 7.057 0.909 -0.589 1.00 . A A . 2 LYS HD2 1 1
3 452 1 1 2 LYS HD3 H 8.603 0.337 0.043 1.00 . A A . 2 LYS HD3 1 1
3 453 1 1 2 LYS HE2 H 8.709 1.694 -2.571 1.00 . A A . 2 LYS HE2 1 1
3 454 1 1 2 LYS HE3 H 8.256 2.709 -1.203 1.00 . A A . 2 LYS HE3 1 1
3 455 1 1 2 LYS HG2 H 8.094 -1.481 -1.207 1.00 . A A . 2 LYS HG2 1 1
3 456 1 1 2 LYS HG3 H 8.827 -0.513 -2.488 1.00 . A A . 2 LYS HG3 1 1
3 457 1 1 2 LYS HZ1 H 10.765 1.223 -1.646 1.00 . A A . 2 LYS HZ1 1 1
3 458 1 1 2 LYS HZ2 H 10.292 1.665 -0.083 1.00 . A A . 2 LYS HZ2 1 1
3 459 1 1 2 LYS HZ3 H 10.551 2.855 -1.256 1.00 . A A . 2 LYS HZ3 1 1
3 460 1 1 2 LYS N N 4.361 -0.551 -1.829 1.00 . A A . 2 LYS N 1 1
3 461 1 1 2 LYS NZ N 10.193 1.892 -1.093 1.00 . A A . 2 LYS NZ 1 1
3 462 1 1 2 LYS O O 6.529 -2.783 -0.156 1.00 . A A . 2 LYS O 1 1
3 463 1 1 3 LEU C C 5.209 -1.915 2.588 1.00 . A A . 3 LEU C 1 1
3 464 1 1 3 LEU CA C 6.176 -0.958 1.899 1.00 . A A . 3 LEU CA 1 1
3 465 1 1 3 LEU CB C 6.199 0.381 2.638 1.00 . A A . 3 LEU CB 1 1
3 466 1 1 3 LEU CD1 C 5.398 -0.005 4.982 1.00 . A A . 3 LEU CD1 1 1
3 467 1 1 3 LEU CD2 C 7.712 -0.691 4.326 1.00 . A A . 3 LEU CD2 1 1
3 468 1 1 3 LEU CG C 6.601 0.327 4.113 1.00 . A A . 3 LEU CG 1 1
3 469 1 1 3 LEU H H 5.391 0.089 0.236 1.00 . A A . 3 LEU H 1 1
3 470 1 1 3 LEU HA H 7.166 -1.389 1.920 1.00 . A A . 3 LEU HA 1 1
3 471 1 1 3 LEU HB2 H 6.898 1.028 2.129 1.00 . A A . 3 LEU HB2 1 1
3 472 1 1 3 LEU HB3 H 5.208 0.808 2.580 1.00 . A A . 3 LEU HB3 1 1
3 473 1 1 3 LEU HD11 H 5.517 -0.993 5.399 1.00 . A A . 3 LEU HD11 1 1
3 474 1 1 3 LEU HD12 H 4.501 0.027 4.382 1.00 . A A . 3 LEU HD12 1 1
3 475 1 1 3 LEU HD13 H 5.322 0.717 5.781 1.00 . A A . 3 LEU HD13 1 1
3 476 1 1 3 LEU HD21 H 7.880 -0.825 5.384 1.00 . A A . 3 LEU HD21 1 1
3 477 1 1 3 LEU HD22 H 8.619 -0.335 3.859 1.00 . A A . 3 LEU HD22 1 1
3 478 1 1 3 LEU HD23 H 7.426 -1.634 3.883 1.00 . A A . 3 LEU HD23 1 1
3 479 1 1 3 LEU HG H 6.972 1.297 4.414 1.00 . A A . 3 LEU HG 1 1
3 480 1 1 3 LEU N N 5.805 -0.758 0.503 1.00 . A A . 3 LEU N 1 1
3 481 1 1 3 LEU O O 5.494 -2.431 3.669 1.00 . A A . 3 LEU O 1 1
3 482 1 1 4 LEU C C 3.166 -4.437 1.884 1.00 . A A . 4 LEU C 1 1
3 483 1 1 4 LEU CA C 3.056 -3.048 2.504 1.00 . A A . 4 LEU CA 1 1
3 484 1 1 4 LEU CB C 1.656 -2.480 2.265 1.00 . A A . 4 LEU CB 1 1
3 485 1 1 4 LEU CD1 C 1.132 -2.175 4.698 1.00 . A A . 4 LEU CD1 1 1
3 486 1 1 4 LEU CD2 C 1.968 -0.241 3.349 1.00 . A A . 4 LEU CD2 1 1
3 487 1 1 4 LEU CG C 1.133 -1.513 3.328 1.00 . A A . 4 LEU CG 1 1
3 488 1 1 4 LEU H H 3.895 -1.710 1.095 1.00 . A A . 4 LEU H 1 1
3 489 1 1 4 LEU HA H 3.227 -3.127 3.567 1.00 . A A . 4 LEU HA 1 1
3 490 1 1 4 LEU HB2 H 1.667 -1.958 1.321 1.00 . A A . 4 LEU HB2 1 1
3 491 1 1 4 LEU HB3 H 0.968 -3.312 2.207 1.00 . A A . 4 LEU HB3 1 1
3 492 1 1 4 LEU HD11 H 1.715 -1.581 5.385 1.00 . A A . 4 LEU HD11 1 1
3 493 1 1 4 LEU HD12 H 1.563 -3.162 4.621 1.00 . A A . 4 LEU HD12 1 1
3 494 1 1 4 LEU HD13 H 0.118 -2.253 5.059 1.00 . A A . 4 LEU HD13 1 1
3 495 1 1 4 LEU HD21 H 1.317 0.617 3.274 1.00 . A A . 4 LEU HD21 1 1
3 496 1 1 4 LEU HD22 H 2.653 -0.248 2.514 1.00 . A A . 4 LEU HD22 1 1
3 497 1 1 4 LEU HD23 H 2.526 -0.192 4.273 1.00 . A A . 4 LEU HD23 1 1
3 498 1 1 4 LEU HG H 0.114 -1.242 3.089 1.00 . A A . 4 LEU HG 1 1
3 499 1 1 4 LEU N N 4.065 -2.150 1.954 1.00 . A A . 4 LEU N 1 1
3 500 1 1 4 LEU O O 2.933 -5.445 2.550 1.00 . A A . 4 LEU O 1 1
3 501 1 1 5 SER C C 5.021 -6.387 0.186 1.00 . A A . 5 SER C 1 1
3 502 1 1 5 SER CA C 3.667 -5.747 -0.105 1.00 . A A . 5 SER CA 1 1
3 503 1 1 5 SER CB C 3.506 -5.532 -1.611 1.00 . A A . 5 SER CB 1 1
3 504 1 1 5 SER H H 3.699 -3.643 0.128 1.00 . A A . 5 SER H 1 1
3 505 1 1 5 SER HA H 2.888 -6.410 0.240 1.00 . A A . 5 SER HA 1 1
3 506 1 1 5 SER HB2 H 4.361 -4.993 -1.989 1.00 . A A . 5 SER HB2 1 1
3 507 1 1 5 SER HB3 H 3.438 -6.491 -2.104 1.00 . A A . 5 SER HB3 1 1
3 508 1 1 5 SER HG H 2.512 -4.174 -2.614 1.00 . A A . 5 SER HG 1 1
3 509 1 1 5 SER N N 3.527 -4.482 0.606 1.00 . A A . 5 SER N 1 1
3 510 1 1 5 SER O O 5.143 -7.610 0.251 1.00 . A A . 5 SER O 1 1
3 511 1 1 5 SER OG O 2.334 -4.787 -1.897 1.00 . A A . 5 SER OG 1 1
3 512 1 1 6 LYS C C 7.458 -6.649 2.038 1.00 . A A . 6 LYS C 1 1
3 513 1 1 6 LYS CA C 7.385 -6.030 0.647 1.00 . A A . 6 LYS CA 1 1
3 514 1 1 6 LYS CB C 8.392 -4.883 0.534 1.00 . A A . 6 LYS CB 1 1
3 515 1 1 6 LYS CD C 9.172 -4.293 2.848 1.00 . A A . 6 LYS CD 1 1
3 516 1 1 6 LYS CE C 10.298 -3.298 3.084 1.00 . A A . 6 LYS CE 1 1
3 517 1 1 6 LYS CG C 8.302 -3.881 1.672 1.00 . A A . 6 LYS CG 1 1
3 518 1 1 6 LYS H H 5.879 -4.584 0.297 1.00 . A A . 6 LYS H 1 1
3 519 1 1 6 LYS HA H 7.630 -6.785 -0.084 1.00 . A A . 6 LYS HA 1 1
3 520 1 1 6 LYS HB2 H 9.390 -5.296 0.524 1.00 . A A . 6 LYS HB2 1 1
3 521 1 1 6 LYS HB3 H 8.220 -4.358 -0.395 1.00 . A A . 6 LYS HB3 1 1
3 522 1 1 6 LYS HD2 H 8.560 -4.344 3.736 1.00 . A A . 6 LYS HD2 1 1
3 523 1 1 6 LYS HD3 H 9.598 -5.265 2.646 1.00 . A A . 6 LYS HD3 1 1
3 524 1 1 6 LYS HE2 H 10.896 -3.232 2.188 1.00 . A A . 6 LYS HE2 1 1
3 525 1 1 6 LYS HE3 H 9.867 -2.332 3.301 1.00 . A A . 6 LYS HE3 1 1
3 526 1 1 6 LYS HG2 H 8.631 -2.915 1.316 1.00 . A A . 6 LYS HG2 1 1
3 527 1 1 6 LYS HG3 H 7.275 -3.815 2.001 1.00 . A A . 6 LYS HG3 1 1
3 528 1 1 6 LYS HZ1 H 12.145 -3.851 3.889 1.00 . A A . 6 LYS HZ1 1 1
3 529 1 1 6 LYS HZ2 H 10.822 -4.595 4.636 1.00 . A A . 6 LYS HZ2 1 1
3 530 1 1 6 LYS HZ3 H 11.169 -2.971 4.954 1.00 . A A . 6 LYS HZ3 1 1
3 531 1 1 6 LYS N N 6.038 -5.549 0.361 1.00 . A A . 6 LYS N 1 1
3 532 1 1 6 LYS NZ N 11.170 -3.707 4.220 1.00 . A A . 6 LYS NZ 1 1
3 533 1 1 6 LYS O O 8.167 -7.632 2.254 1.00 . A A . 6 LYS O 1 1
3 534 1 1 7 ALA C C 5.685 -7.697 4.506 1.00 . A A . 7 ALA C 1 1
3 535 1 1 7 ALA CA C 6.697 -6.568 4.348 1.00 . A A . 7 ALA CA 1 1
3 536 1 1 7 ALA CB C 6.384 -5.436 5.316 1.00 . A A . 7 ALA CB 1 1
3 537 1 1 7 ALA H H 6.174 -5.290 2.745 1.00 . A A . 7 ALA H 1 1
3 538 1 1 7 ALA HA H 7.682 -6.946 4.582 1.00 . A A . 7 ALA HA 1 1
3 539 1 1 7 ALA HB1 H 5.923 -5.842 6.205 1.00 . A A . 7 ALA HB1 1 1
3 540 1 1 7 ALA HB2 H 7.299 -4.929 5.584 1.00 . A A . 7 ALA HB2 1 1
3 541 1 1 7 ALA HB3 H 5.708 -4.738 4.846 1.00 . A A . 7 ALA HB3 1 1
3 542 1 1 7 ALA N N 6.719 -6.070 2.979 1.00 . A A . 7 ALA N 1 1
3 543 1 1 7 ALA O O 5.918 -8.652 5.246 1.00 . A A . 7 ALA O 1 1
3 544 1 1 8 GLN C C 3.902 -9.831 3.073 1.00 . A A . 8 GLN C 1 1
3 545 1 1 8 GLN CA C 3.512 -8.591 3.871 1.00 . A A . 8 GLN CA 1 1
3 546 1 1 8 GLN CB C 2.194 -8.023 3.343 1.00 . A A . 8 GLN CB 1 1
3 547 1 1 8 GLN CD C -0.265 -8.501 3.676 1.00 . A A . 8 GLN CD 1 1
3 548 1 1 8 GLN CG C 1.081 -9.055 3.250 1.00 . A A . 8 GLN CG 1 1
3 549 1 1 8 GLN H H 4.433 -6.795 3.235 1.00 . A A . 8 GLN H 1 1
3 550 1 1 8 GLN HA H 3.384 -8.870 4.906 1.00 . A A . 8 GLN HA 1 1
3 551 1 1 8 GLN HB2 H 1.867 -7.231 4.000 1.00 . A A . 8 GLN HB2 1 1
3 552 1 1 8 GLN HB3 H 2.360 -7.616 2.356 1.00 . A A . 8 GLN HB3 1 1
3 553 1 1 8 GLN HE21 H 0.420 -8.182 5.515 1.00 . A A . 8 GLN HE21 1 1
3 554 1 1 8 GLN HE22 H -1.226 -7.737 5.239 1.00 . A A . 8 GLN HE22 1 1
3 555 1 1 8 GLN HG2 H 1.006 -9.394 2.228 1.00 . A A . 8 GLN HG2 1 1
3 556 1 1 8 GLN HG3 H 1.328 -9.890 3.888 1.00 . A A . 8 GLN HG3 1 1
3 557 1 1 8 GLN N N 4.560 -7.580 3.807 1.00 . A A . 8 GLN N 1 1
3 558 1 1 8 GLN NE2 N -0.368 -8.100 4.937 1.00 . A A . 8 GLN NE2 1 1
3 559 1 1 8 GLN O O 3.479 -10.942 3.390 1.00 . A A . 8 GLN O 1 1
3 560 1 1 8 GLN OE1 O -1.202 -8.434 2.879 1.00 . A A . 8 GLN OE1 1 1
3 561 1 1 9 GLU C C 5.790 -11.840 2.032 1.00 . A A . 9 GLU C 1 1
3 562 1 1 9 GLU CA C 5.155 -10.734 1.193 1.00 . A A . 9 GLU CA 1 1
3 563 1 1 9 GLU CB C 6.155 -10.235 0.148 1.00 . A A . 9 GLU CB 1 1
3 564 1 1 9 GLU CD C 7.282 -10.985 -1.985 1.00 . A A . 9 GLU CD 1 1
3 565 1 1 9 GLU CG C 6.901 -11.351 -0.563 1.00 . A A . 9 GLU CG 1 1
3 566 1 1 9 GLU H H 5.014 -8.722 1.835 1.00 . A A . 9 GLU H 1 1
3 567 1 1 9 GLU HA H 4.290 -11.135 0.687 1.00 . A A . 9 GLU HA 1 1
3 568 1 1 9 GLU HB2 H 5.623 -9.656 -0.593 1.00 . A A . 9 GLU HB2 1 1
3 569 1 1 9 GLU HB3 H 6.879 -9.600 0.635 1.00 . A A . 9 GLU HB3 1 1
3 570 1 1 9 GLU HG2 H 7.802 -11.573 -0.011 1.00 . A A . 9 GLU HG2 1 1
3 571 1 1 9 GLU HG3 H 6.271 -12.228 -0.590 1.00 . A A . 9 GLU HG3 1 1
3 572 1 1 9 GLU N N 4.710 -9.631 2.037 1.00 . A A . 9 GLU N 1 1
3 573 1 1 9 GLU O O 5.628 -13.025 1.743 1.00 . A A . 9 GLU O 1 1
3 574 1 1 9 GLU OE1 O 8.093 -10.051 -2.159 1.00 . A A . 9 GLU OE1 1 1
3 575 1 1 9 GLU OE2 O 6.770 -11.632 -2.922 1.00 . A A . 9 GLU OE2 1 1
3 576 1 1 10 LYS C C 6.251 -12.808 5.098 1.00 . A A . 10 LYS C 1 1
3 577 1 1 10 LYS CA C 7.174 -12.397 3.956 1.00 . A A . 10 LYS CA 1 1
3 578 1 1 10 LYS CB C 8.463 -11.795 4.519 1.00 . A A . 10 LYS CB 1 1
3 579 1 1 10 LYS CD C 8.669 -9.319 4.891 1.00 . A A . 10 LYS CD 1 1
3 580 1 1 10 LYS CE C 10.172 -9.284 4.661 1.00 . A A . 10 LYS CE 1 1
3 581 1 1 10 LYS CG C 8.227 -10.646 5.485 1.00 . A A . 10 LYS CG 1 1
3 582 1 1 10 LYS H H 6.607 -10.482 3.252 1.00 . A A . 10 LYS H 1 1
3 583 1 1 10 LYS HA H 7.420 -13.272 3.374 1.00 . A A . 10 LYS HA 1 1
3 584 1 1 10 LYS HB2 H 9.010 -12.568 5.039 1.00 . A A . 10 LYS HB2 1 1
3 585 1 1 10 LYS HB3 H 9.064 -11.430 3.699 1.00 . A A . 10 LYS HB3 1 1
3 586 1 1 10 LYS HD2 H 8.168 -9.172 3.946 1.00 . A A . 10 LYS HD2 1 1
3 587 1 1 10 LYS HD3 H 8.399 -8.523 5.571 1.00 . A A . 10 LYS HD3 1 1
3 588 1 1 10 LYS HE2 H 10.418 -9.978 3.872 1.00 . A A . 10 LYS HE2 1 1
3 589 1 1 10 LYS HE3 H 10.454 -8.285 4.362 1.00 . A A . 10 LYS HE3 1 1
3 590 1 1 10 LYS HG2 H 7.174 -10.592 5.715 1.00 . A A . 10 LYS HG2 1 1
3 591 1 1 10 LYS HG3 H 8.787 -10.829 6.391 1.00 . A A . 10 LYS HG3 1 1
3 592 1 1 10 LYS HZ1 H 10.564 -9.131 6.707 1.00 . A A . 10 LYS HZ1 1 1
3 593 1 1 10 LYS HZ2 H 11.938 -9.430 5.766 1.00 . A A . 10 LYS HZ2 1 1
3 594 1 1 10 LYS HZ3 H 10.835 -10.675 6.071 1.00 . A A . 10 LYS HZ3 1 1
3 595 1 1 10 LYS N N 6.514 -11.442 3.073 1.00 . A A . 10 LYS N 1 1
3 596 1 1 10 LYS NZ N 10.930 -9.656 5.887 1.00 . A A . 10 LYS NZ 1 1
3 597 1 1 10 LYS O O 6.690 -13.415 6.076 1.00 . A A . 10 LYS O 1 1
3 598 1 1 11 PHE C C 2.887 -13.701 5.415 1.00 . A A . 11 PHE C 1 1
3 599 1 1 11 PHE CA C 3.986 -12.812 5.990 1.00 . A A . 11 PHE CA 1 1
3 600 1 1 11 PHE CB C 3.373 -11.539 6.576 1.00 . A A . 11 PHE CB 1 1
3 601 1 1 11 PHE CD1 C 5.491 -11.219 7.883 1.00 . A A . 11 PHE CD1 1 1
3 602 1 1 11 PHE CD2 C 4.179 -9.297 7.364 1.00 . A A . 11 PHE CD2 1 1
3 603 1 1 11 PHE CE1 C 6.409 -10.420 8.539 1.00 . A A . 11 PHE CE1 1 1
3 604 1 1 11 PHE CE2 C 5.094 -8.493 8.018 1.00 . A A . 11 PHE CE2 1 1
3 605 1 1 11 PHE CG C 4.368 -10.667 7.288 1.00 . A A . 11 PHE CG 1 1
3 606 1 1 11 PHE CZ C 6.209 -9.055 8.608 1.00 . A A . 11 PHE CZ 1 1
3 607 1 1 11 PHE H H 4.682 -11.992 4.166 1.00 . A A . 11 PHE H 1 1
3 608 1 1 11 PHE HA H 4.495 -13.351 6.775 1.00 . A A . 11 PHE HA 1 1
3 609 1 1 11 PHE HB2 H 2.936 -10.958 5.778 1.00 . A A . 11 PHE HB2 1 1
3 610 1 1 11 PHE HB3 H 2.603 -11.811 7.282 1.00 . A A . 11 PHE HB3 1 1
3 611 1 1 11 PHE HD1 H 5.648 -12.287 7.830 1.00 . A A . 11 PHE HD1 1 1
3 612 1 1 11 PHE HD2 H 3.307 -8.855 6.905 1.00 . A A . 11 PHE HD2 1 1
3 613 1 1 11 PHE HE1 H 7.280 -10.864 8.999 1.00 . A A . 11 PHE HE1 1 1
3 614 1 1 11 PHE HE2 H 4.935 -7.426 8.071 1.00 . A A . 11 PHE HE2 1 1
3 615 1 1 11 PHE HZ H 6.925 -8.429 9.119 1.00 . A A . 11 PHE HZ 1 1
3 616 1 1 11 PHE N N 4.971 -12.476 4.968 1.00 . A A . 11 PHE N 1 1
3 617 1 1 11 PHE O O 2.335 -14.552 6.110 1.00 . A A . 11 PHE O 1 1
3 618 1 1 12 GLY C C 2.087 -15.560 2.881 1.00 . A A . 12 GLY C 1 1
3 619 1 1 12 GLY CA C 1.543 -14.284 3.491 1.00 . A A . 12 GLY CA 1 1
3 620 1 1 12 GLY H H 3.049 -12.802 3.633 1.00 . A A . 12 GLY H 1 1
3 621 1 1 12 GLY HA2 H 0.789 -14.538 4.220 1.00 . A A . 12 GLY HA2 1 1
3 622 1 1 12 GLY HA3 H 1.090 -13.690 2.710 1.00 . A A . 12 GLY HA3 1 1
3 623 1 1 12 GLY N N 2.575 -13.495 4.139 1.00 . A A . 12 GLY N 1 1
3 624 1 1 12 GLY O O 1.373 -16.556 2.770 1.00 . A A . 12 GLY O 1 1
4 625 1 1 1 TRP C C 3.421 -1.004 -1.079 1.00 . A A . 1 TRP C 1 1
4 626 1 1 1 TRP CA C 2.246 -0.035 -1.154 1.00 . A A . 1 TRP CA 1 1
4 627 1 1 1 TRP CB C 2.753 1.378 -1.444 1.00 . A A . 1 TRP CB 1 1
4 628 1 1 1 TRP CD1 C 5.080 2.046 -0.603 1.00 . A A . 1 TRP CD1 1 1
4 629 1 1 1 TRP CD2 C 3.452 2.269 0.919 1.00 . A A . 1 TRP CD2 1 1
4 630 1 1 1 TRP CE2 C 4.671 2.666 1.503 1.00 . A A . 1 TRP CE2 1 1
4 631 1 1 1 TRP CE3 C 2.287 2.326 1.688 1.00 . A A . 1 TRP CE3 1 1
4 632 1 1 1 TRP CG C 3.736 1.877 -0.428 1.00 . A A . 1 TRP CG 1 1
4 633 1 1 1 TRP CH2 C 3.599 3.156 3.550 1.00 . A A . 1 TRP CH2 1 1
4 634 1 1 1 TRP CZ2 C 4.755 3.110 2.820 1.00 . A A . 1 TRP CZ2 1 1
4 635 1 1 1 TRP CZ3 C 2.372 2.767 2.995 1.00 . A A . 1 TRP CZ3 1 1
4 636 1 1 1 TRP H1 H 1.953 -0.077 0.943 1.00 . A A . 1 TRP H1 1 1
4 637 1 1 1 TRP HA H 1.590 -0.344 -1.954 1.00 . A A . 1 TRP HA 1 1
4 638 1 1 1 TRP HB2 H 3.236 1.390 -2.409 1.00 . A A . 1 TRP HB2 1 1
4 639 1 1 1 TRP HB3 H 1.913 2.058 -1.457 1.00 . A A . 1 TRP HB3 1 1
4 640 1 1 1 TRP HD1 H 5.605 1.832 -1.521 1.00 . A A . 1 TRP HD1 1 1
4 641 1 1 1 TRP HE1 H 6.600 2.721 0.680 1.00 . A A . 1 TRP HE1 1 1
4 642 1 1 1 TRP HE3 H 1.332 2.031 1.279 1.00 . A A . 1 TRP HE3 1 1
4 643 1 1 1 TRP HH2 H 3.619 3.494 4.575 1.00 . A A . 1 TRP HH2 1 1
4 644 1 1 1 TRP HZ2 H 5.693 3.414 3.262 1.00 . A A . 1 TRP HZ2 1 1
4 645 1 1 1 TRP HZ3 H 1.482 2.818 3.605 1.00 . A A . 1 TRP HZ3 1 1
4 646 1 1 1 TRP N N 1.477 -0.053 0.086 1.00 . A A . 1 TRP N 1 1
4 647 1 1 1 TRP NE1 N 5.649 2.519 0.555 1.00 . A A . 1 TRP NE1 1 1
4 648 1 1 1 TRP O O 3.321 -2.072 -0.475 1.00 . A A . 1 TRP O 1 1
4 649 1 1 2 LYS C C 6.133 -1.839 -0.278 1.00 . A A . 2 LYS C 1 1
4 650 1 1 2 LYS CA C 5.731 -1.460 -1.700 1.00 . A A . 2 LYS CA 1 1
4 651 1 1 2 LYS CB C 6.885 -0.730 -2.390 1.00 . A A . 2 LYS CB 1 1
4 652 1 1 2 LYS CD C 8.005 0.820 -0.762 1.00 . A A . 2 LYS CD 1 1
4 653 1 1 2 LYS CE C 9.330 1.182 -0.108 1.00 . A A . 2 LYS CE 1 1
4 654 1 1 2 LYS CG C 8.090 -0.510 -1.492 1.00 . A A . 2 LYS CG 1 1
4 655 1 1 2 LYS H H 4.553 0.238 -2.162 1.00 . A A . 2 LYS H 1 1
4 656 1 1 2 LYS HA H 5.505 -2.361 -2.250 1.00 . A A . 2 LYS HA 1 1
4 657 1 1 2 LYS HB2 H 7.201 -1.309 -3.245 1.00 . A A . 2 LYS HB2 1 1
4 658 1 1 2 LYS HB3 H 6.534 0.234 -2.729 1.00 . A A . 2 LYS HB3 1 1
4 659 1 1 2 LYS HD2 H 7.744 1.593 -1.469 1.00 . A A . 2 LYS HD2 1 1
4 660 1 1 2 LYS HD3 H 7.243 0.755 0.001 1.00 . A A . 2 LYS HD3 1 1
4 661 1 1 2 LYS HE2 H 9.198 1.188 0.963 1.00 . A A . 2 LYS HE2 1 1
4 662 1 1 2 LYS HE3 H 10.064 0.436 -0.375 1.00 . A A . 2 LYS HE3 1 1
4 663 1 1 2 LYS HG2 H 8.134 -1.306 -0.763 1.00 . A A . 2 LYS HG2 1 1
4 664 1 1 2 LYS HG3 H 8.985 -0.523 -2.096 1.00 . A A . 2 LYS HG3 1 1
4 665 1 1 2 LYS HZ1 H 10.001 3.121 0.284 1.00 . A A . 2 LYS HZ1 1 1
4 666 1 1 2 LYS HZ2 H 9.104 2.981 -1.144 1.00 . A A . 2 LYS HZ2 1 1
4 667 1 1 2 LYS HZ3 H 10.698 2.419 -1.089 1.00 . A A . 2 LYS HZ3 1 1
4 668 1 1 2 LYS N N 4.535 -0.625 -1.697 1.00 . A A . 2 LYS N 1 1
4 669 1 1 2 LYS NZ N 9.817 2.520 -0.544 1.00 . A A . 2 LYS NZ 1 1
4 670 1 1 2 LYS O O 6.623 -2.942 -0.034 1.00 . A A . 2 LYS O 1 1
4 671 1 1 3 LEU C C 5.265 -2.116 2.702 1.00 . A A . 3 LEU C 1 1
4 672 1 1 3 LEU CA C 6.260 -1.158 2.056 1.00 . A A . 3 LEU CA 1 1
4 673 1 1 3 LEU CB C 6.288 0.163 2.827 1.00 . A A . 3 LEU CB 1 1
4 674 1 1 3 LEU CD1 C 5.423 -0.278 5.137 1.00 . A A . 3 LEU CD1 1 1
4 675 1 1 3 LEU CD2 C 7.748 -0.964 4.524 1.00 . A A . 3 LEU CD2 1 1
4 676 1 1 3 LEU CG C 6.651 0.067 4.309 1.00 . A A . 3 LEU CG 1 1
4 677 1 1 3 LEU H H 5.528 -0.059 0.402 1.00 . A A . 3 LEU H 1 1
4 678 1 1 3 LEU HA H 7.243 -1.604 2.087 1.00 . A A . 3 LEU HA 1 1
4 679 1 1 3 LEU HB2 H 7.011 0.808 2.351 1.00 . A A . 3 LEU HB2 1 1
4 680 1 1 3 LEU HB3 H 5.307 0.609 2.753 1.00 . A A . 3 LEU HB3 1 1
4 681 1 1 3 LEU HD11 H 4.539 -0.198 4.522 1.00 . A A . 3 LEU HD11 1 1
4 682 1 1 3 LEU HD12 H 5.345 0.407 5.969 1.00 . A A . 3 LEU HD12 1 1
4 683 1 1 3 LEU HD13 H 5.512 -1.287 5.510 1.00 . A A . 3 LEU HD13 1 1
4 684 1 1 3 LEU HD21 H 8.671 -0.604 4.094 1.00 . A A . 3 LEU HD21 1 1
4 685 1 1 3 LEU HD22 H 7.468 -1.893 4.049 1.00 . A A . 3 LEU HD22 1 1
4 686 1 1 3 LEU HD23 H 7.884 -1.130 5.583 1.00 . A A . 3 LEU HD23 1 1
4 687 1 1 3 LEU HG H 7.021 1.026 4.645 1.00 . A A . 3 LEU HG 1 1
4 688 1 1 3 LEU N N 5.921 -0.919 0.657 1.00 . A A . 3 LEU N 1 1
4 689 1 1 3 LEU O O 5.537 -2.695 3.754 1.00 . A A . 3 LEU O 1 1
4 690 1 1 4 LEU C C 3.168 -4.546 1.923 1.00 . A A . 4 LEU C 1 1
4 691 1 1 4 LEU CA C 3.074 -3.170 2.575 1.00 . A A . 4 LEU CA 1 1
4 692 1 1 4 LEU CB C 1.690 -2.569 2.327 1.00 . A A . 4 LEU CB 1 1
4 693 1 1 4 LEU CD1 C 1.149 -2.288 4.758 1.00 . A A . 4 LEU CD1 1 1
4 694 1 1 4 LEU CD2 C 2.029 -0.350 3.444 1.00 . A A . 4 LEU CD2 1 1
4 695 1 1 4 LEU CG C 1.173 -1.608 3.398 1.00 . A A . 4 LEU CG 1 1
4 696 1 1 4 LEU H H 3.951 -1.791 1.230 1.00 . A A . 4 LEU H 1 1
4 697 1 1 4 LEU HA H 3.225 -3.278 3.639 1.00 . A A . 4 LEU HA 1 1
4 698 1 1 4 LEU HB2 H 1.726 -2.032 1.391 1.00 . A A . 4 LEU HB2 1 1
4 699 1 1 4 LEU HB3 H 0.985 -3.384 2.245 1.00 . A A . 4 LEU HB3 1 1
4 700 1 1 4 LEU HD11 H 0.133 -2.335 5.119 1.00 . A A . 4 LEU HD11 1 1
4 701 1 1 4 LEU HD12 H 1.752 -1.723 5.454 1.00 . A A . 4 LEU HD12 1 1
4 702 1 1 4 LEU HD13 H 1.546 -3.288 4.667 1.00 . A A . 4 LEU HD13 1 1
4 703 1 1 4 LEU HD21 H 1.395 0.520 3.354 1.00 . A A . 4 LEU HD21 1 1
4 704 1 1 4 LEU HD22 H 2.736 -0.367 2.627 1.00 . A A . 4 LEU HD22 1 1
4 705 1 1 4 LEU HD23 H 2.564 -0.312 4.382 1.00 . A A . 4 LEU HD23 1 1
4 706 1 1 4 LEU HG H 0.161 -1.316 3.153 1.00 . A A . 4 LEU HG 1 1
4 707 1 1 4 LEU N N 4.111 -2.280 2.064 1.00 . A A . 4 LEU N 1 1
4 708 1 1 4 LEU O O 2.895 -5.564 2.558 1.00 . A A . 4 LEU O 1 1
4 709 1 1 5 SER C C 5.016 -6.499 0.225 1.00 . A A . 5 SER C 1 1
4 710 1 1 5 SER CA C 3.686 -5.818 -0.086 1.00 . A A . 5 SER CA 1 1
4 711 1 1 5 SER CB C 3.572 -5.561 -1.590 1.00 . A A . 5 SER CB 1 1
4 712 1 1 5 SER H H 3.761 -3.722 0.201 1.00 . A A . 5 SER H 1 1
4 713 1 1 5 SER HA H 2.882 -6.469 0.222 1.00 . A A . 5 SER HA 1 1
4 714 1 1 5 SER HB2 H 4.446 -5.028 -1.929 1.00 . A A . 5 SER HB2 1 1
4 715 1 1 5 SER HB3 H 3.502 -6.506 -2.109 1.00 . A A . 5 SER HB3 1 1
4 716 1 1 5 SER HG H 1.994 -5.142 -2.672 1.00 . A A . 5 SER HG 1 1
4 717 1 1 5 SER N N 3.558 -4.568 0.653 1.00 . A A . 5 SER N 1 1
4 718 1 1 5 SER O O 5.094 -7.724 0.317 1.00 . A A . 5 SER O 1 1
4 719 1 1 5 SER OG O 2.422 -4.789 -1.889 1.00 . A A . 5 SER OG 1 1
4 720 1 1 6 LYS C C 7.430 -6.824 2.086 1.00 . A A . 6 LYS C 1 1
4 721 1 1 6 LYS CA C 7.389 -6.216 0.688 1.00 . A A . 6 LYS CA 1 1
4 722 1 1 6 LYS CB C 8.435 -5.104 0.573 1.00 . A A . 6 LYS CB 1 1
4 723 1 1 6 LYS CD C 9.357 -2.969 1.522 1.00 . A A . 6 LYS CD 1 1
4 724 1 1 6 LYS CE C 10.800 -3.381 1.272 1.00 . A A . 6 LYS CE 1 1
4 725 1 1 6 LYS CG C 8.469 -4.176 1.775 1.00 . A A . 6 LYS CG 1 1
4 726 1 1 6 LYS H H 5.937 -4.726 0.300 1.00 . A A . 6 LYS H 1 1
4 727 1 1 6 LYS HA H 7.615 -6.986 -0.034 1.00 . A A . 6 LYS HA 1 1
4 728 1 1 6 LYS HB2 H 9.410 -5.554 0.463 1.00 . A A . 6 LYS HB2 1 1
4 729 1 1 6 LYS HB3 H 8.219 -4.513 -0.305 1.00 . A A . 6 LYS HB3 1 1
4 730 1 1 6 LYS HD2 H 8.991 -2.439 0.655 1.00 . A A . 6 LYS HD2 1 1
4 731 1 1 6 LYS HD3 H 9.322 -2.319 2.385 1.00 . A A . 6 LYS HD3 1 1
4 732 1 1 6 LYS HE2 H 11.155 -3.938 2.126 1.00 . A A . 6 LYS HE2 1 1
4 733 1 1 6 LYS HE3 H 10.834 -4.009 0.394 1.00 . A A . 6 LYS HE3 1 1
4 734 1 1 6 LYS HG2 H 7.467 -3.834 1.983 1.00 . A A . 6 LYS HG2 1 1
4 735 1 1 6 LYS HG3 H 8.851 -4.720 2.627 1.00 . A A . 6 LYS HG3 1 1
4 736 1 1 6 LYS HZ1 H 12.429 -2.433 0.371 1.00 . A A . 6 LYS HZ1 1 1
4 737 1 1 6 LYS HZ2 H 12.132 -1.926 1.958 1.00 . A A . 6 LYS HZ2 1 1
4 738 1 1 6 LYS HZ3 H 11.131 -1.399 0.701 1.00 . A A . 6 LYS HZ3 1 1
4 739 1 1 6 LYS N N 6.061 -5.694 0.386 1.00 . A A . 6 LYS N 1 1
4 740 1 1 6 LYS NZ N 11.685 -2.202 1.060 1.00 . A A . 6 LYS NZ 1 1
4 741 1 1 6 LYS O O 8.122 -7.814 2.323 1.00 . A A . 6 LYS O 1 1
4 742 1 1 7 ALA C C 5.611 -7.835 4.529 1.00 . A A . 7 ALA C 1 1
4 743 1 1 7 ALA CA C 6.631 -6.712 4.382 1.00 . A A . 7 ALA CA 1 1
4 744 1 1 7 ALA CB C 6.304 -5.570 5.333 1.00 . A A . 7 ALA CB 1 1
4 745 1 1 7 ALA H H 6.153 -5.441 2.759 1.00 . A A . 7 ALA H 1 1
4 746 1 1 7 ALA HA H 7.610 -7.092 4.638 1.00 . A A . 7 ALA HA 1 1
4 747 1 1 7 ALA HB1 H 5.795 -5.962 6.202 1.00 . A A . 7 ALA HB1 1 1
4 748 1 1 7 ALA HB2 H 7.218 -5.084 5.639 1.00 . A A . 7 ALA HB2 1 1
4 749 1 1 7 ALA HB3 H 5.666 -4.857 4.833 1.00 . A A . 7 ALA HB3 1 1
4 750 1 1 7 ALA N N 6.683 -6.226 3.008 1.00 . A A . 7 ALA N 1 1
4 751 1 1 7 ALA O O 5.830 -8.791 5.272 1.00 . A A . 7 ALA O 1 1
4 752 1 1 8 GLN C C 3.825 -9.953 3.065 1.00 . A A . 8 GLN C 1 1
4 753 1 1 8 GLN CA C 3.440 -8.717 3.871 1.00 . A A . 8 GLN CA 1 1
4 754 1 1 8 GLN CB C 2.127 -8.137 3.343 1.00 . A A . 8 GLN CB 1 1
4 755 1 1 8 GLN CD C -0.333 -8.602 3.684 1.00 . A A . 8 GLN CD 1 1
4 756 1 1 8 GLN CG C 1.006 -9.160 3.244 1.00 . A A . 8 GLN CG 1 1
4 757 1 1 8 GLN H H 4.378 -6.926 3.244 1.00 . A A . 8 GLN H 1 1
4 758 1 1 8 GLN HA H 3.307 -9.002 4.904 1.00 . A A . 8 GLN HA 1 1
4 759 1 1 8 GLN HB2 H 1.805 -7.345 4.002 1.00 . A A . 8 GLN HB2 1 1
4 760 1 1 8 GLN HB3 H 2.298 -7.728 2.358 1.00 . A A . 8 GLN HB3 1 1
4 761 1 1 8 GLN HE21 H 0.375 -8.275 5.513 1.00 . A A . 8 GLN HE21 1 1
4 762 1 1 8 GLN HE22 H -1.274 -7.829 5.256 1.00 . A A . 8 GLN HE22 1 1
4 763 1 1 8 GLN HG2 H 0.923 -9.486 2.218 1.00 . A A . 8 GLN HG2 1 1
4 764 1 1 8 GLN HG3 H 1.251 -10.004 3.871 1.00 . A A . 8 GLN HG3 1 1
4 765 1 1 8 GLN N N 4.495 -7.711 3.818 1.00 . A A . 8 GLN N 1 1
4 766 1 1 8 GLN NE2 N -0.420 -8.195 4.945 1.00 . A A . 8 GLN NE2 1 1
4 767 1 1 8 GLN O O 3.395 -11.064 3.374 1.00 . A A . 8 GLN O 1 1
4 768 1 1 8 GLN OE1 O -1.280 -8.538 2.899 1.00 . A A . 8 GLN OE1 1 1
4 769 1 1 9 GLU C C 5.704 -11.965 2.014 1.00 . A A . 9 GLU C 1 1
4 770 1 1 9 GLU CA C 5.077 -10.850 1.182 1.00 . A A . 9 GLU CA 1 1
4 771 1 1 9 GLU CB C 6.082 -10.349 0.142 1.00 . A A . 9 GLU CB 1 1
4 772 1 1 9 GLU CD C 7.608 -10.962 -1.775 1.00 . A A . 9 GLU CD 1 1
4 773 1 1 9 GLU CG C 6.810 -11.465 -0.588 1.00 . A A . 9 GLU CG 1 1
4 774 1 1 9 GLU H H 4.945 -8.842 1.837 1.00 . A A . 9 GLU H 1 1
4 775 1 1 9 GLU HA H 4.211 -11.243 0.671 1.00 . A A . 9 GLU HA 1 1
4 776 1 1 9 GLU HB2 H 5.557 -9.750 -0.588 1.00 . A A . 9 GLU HB2 1 1
4 777 1 1 9 GLU HB3 H 6.817 -9.733 0.638 1.00 . A A . 9 GLU HB3 1 1
4 778 1 1 9 GLU HG2 H 7.486 -11.948 0.102 1.00 . A A . 9 GLU HG2 1 1
4 779 1 1 9 GLU HG3 H 6.083 -12.182 -0.940 1.00 . A A . 9 GLU HG3 1 1
4 780 1 1 9 GLU N N 4.636 -9.751 2.032 1.00 . A A . 9 GLU N 1 1
4 781 1 1 9 GLU O O 5.520 -13.148 1.728 1.00 . A A . 9 GLU O 1 1
4 782 1 1 9 GLU OE1 O 7.277 -9.875 -2.294 1.00 . A A . 9 GLU OE1 1 1
4 783 1 1 9 GLU OE2 O 8.563 -11.654 -2.185 1.00 . A A . 9 GLU OE2 1 1
4 784 1 1 10 LYS C C 6.169 -12.970 5.053 1.00 . A A . 10 LYS C 1 1
4 785 1 1 10 LYS CA C 7.100 -12.543 3.923 1.00 . A A . 10 LYS CA 1 1
4 786 1 1 10 LYS CB C 8.384 -11.946 4.503 1.00 . A A . 10 LYS CB 1 1
4 787 1 1 10 LYS CD C 8.671 -9.510 5.044 1.00 . A A . 10 LYS CD 1 1
4 788 1 1 10 LYS CE C 9.000 -8.590 6.210 1.00 . A A . 10 LYS CE 1 1
4 789 1 1 10 LYS CG C 8.138 -10.849 5.525 1.00 . A A . 10 LYS CG 1 1
4 790 1 1 10 LYS H H 6.555 -10.620 3.224 1.00 . A A . 10 LYS H 1 1
4 791 1 1 10 LYS HA H 7.351 -13.411 3.332 1.00 . A A . 10 LYS HA 1 1
4 792 1 1 10 LYS HB2 H 8.949 -12.733 4.980 1.00 . A A . 10 LYS HB2 1 1
4 793 1 1 10 LYS HB3 H 8.971 -11.532 3.696 1.00 . A A . 10 LYS HB3 1 1
4 794 1 1 10 LYS HD2 H 9.569 -9.676 4.467 1.00 . A A . 10 LYS HD2 1 1
4 795 1 1 10 LYS HD3 H 7.924 -9.037 4.423 1.00 . A A . 10 LYS HD3 1 1
4 796 1 1 10 LYS HE2 H 8.077 -8.215 6.626 1.00 . A A . 10 LYS HE2 1 1
4 797 1 1 10 LYS HE3 H 9.528 -9.158 6.962 1.00 . A A . 10 LYS HE3 1 1
4 798 1 1 10 LYS HG2 H 7.075 -10.761 5.695 1.00 . A A . 10 LYS HG2 1 1
4 799 1 1 10 LYS HG3 H 8.632 -11.113 6.449 1.00 . A A . 10 LYS HG3 1 1
4 800 1 1 10 LYS HZ1 H 9.750 -6.658 6.467 1.00 . A A . 10 LYS HZ1 1 1
4 801 1 1 10 LYS HZ2 H 9.550 -7.106 4.848 1.00 . A A . 10 LYS HZ2 1 1
4 802 1 1 10 LYS HZ3 H 10.843 -7.727 5.744 1.00 . A A . 10 LYS HZ3 1 1
4 803 1 1 10 LYS N N 6.446 -11.578 3.047 1.00 . A A . 10 LYS N 1 1
4 804 1 1 10 LYS NZ N 9.845 -7.439 5.788 1.00 . A A . 10 LYS NZ 1 1
4 805 1 1 10 LYS O O 6.586 -13.650 5.991 1.00 . A A . 10 LYS O 1 1
4 806 1 1 11 PHE C C 2.807 -13.774 5.380 1.00 . A A . 11 PHE C 1 1
4 807 1 1 11 PHE CA C 3.916 -12.909 5.972 1.00 . A A . 11 PHE CA 1 1
4 808 1 1 11 PHE CB C 3.318 -11.639 6.580 1.00 . A A . 11 PHE CB 1 1
4 809 1 1 11 PHE CD1 C 5.489 -11.329 7.800 1.00 . A A . 11 PHE CD1 1 1
4 810 1 1 11 PHE CD2 C 4.119 -9.414 7.421 1.00 . A A . 11 PHE CD2 1 1
4 811 1 1 11 PHE CE1 C 6.420 -10.538 8.447 1.00 . A A . 11 PHE CE1 1 1
4 812 1 1 11 PHE CE2 C 5.047 -8.618 8.066 1.00 . A A . 11 PHE CE2 1 1
4 813 1 1 11 PHE CG C 4.329 -10.777 7.281 1.00 . A A . 11 PHE CG 1 1
4 814 1 1 11 PHE CZ C 6.199 -9.181 8.578 1.00 . A A . 11 PHE CZ 1 1
4 815 1 1 11 PHE H H 4.634 -12.027 4.186 1.00 . A A . 11 PHE H 1 1
4 816 1 1 11 PHE HA H 4.417 -13.468 6.748 1.00 . A A . 11 PHE HA 1 1
4 817 1 1 11 PHE HB2 H 2.868 -11.050 5.795 1.00 . A A . 11 PHE HB2 1 1
4 818 1 1 11 PHE HB3 H 2.560 -11.914 7.298 1.00 . A A . 11 PHE HB3 1 1
4 819 1 1 11 PHE HD1 H 5.663 -12.390 7.697 1.00 . A A . 11 PHE HD1 1 1
4 820 1 1 11 PHE HD2 H 3.218 -8.973 7.019 1.00 . A A . 11 PHE HD2 1 1
4 821 1 1 11 PHE HE1 H 7.320 -10.980 8.846 1.00 . A A . 11 PHE HE1 1 1
4 822 1 1 11 PHE HE2 H 4.871 -7.558 8.167 1.00 . A A . 11 PHE HE2 1 1
4 823 1 1 11 PHE HZ H 6.925 -8.561 9.083 1.00 . A A . 11 PHE HZ 1 1
4 824 1 1 11 PHE N N 4.906 -12.568 4.958 1.00 . A A . 11 PHE N 1 1
4 825 1 1 11 PHE O O 2.227 -14.615 6.066 1.00 . A A . 11 PHE O 1 1
4 826 1 1 12 GLY C C 1.969 -15.679 2.963 1.00 . A A . 12 GLY C 1 1
4 827 1 1 12 GLY CA C 1.478 -14.326 3.437 1.00 . A A . 12 GLY CA 1 1
4 828 1 1 12 GLY H H 3.012 -12.876 3.603 1.00 . A A . 12 GLY H 1 1
4 829 1 1 12 GLY HA2 H 0.659 -14.472 4.125 1.00 . A A . 12 GLY HA2 1 1
4 830 1 1 12 GLY HA3 H 1.123 -13.766 2.584 1.00 . A A . 12 GLY HA3 1 1
4 831 1 1 12 GLY N N 2.517 -13.560 4.100 1.00 . A A . 12 GLY N 1 1
4 832 1 1 12 GLY O O 1.259 -16.389 2.250 1.00 . A A . 12 GLY O 1 1
5 833 1 1 1 TRP C C 3.393 -0.969 -1.113 1.00 . A A . 1 TRP C 1 1
5 834 1 1 1 TRP CA C 2.212 -0.006 -1.167 1.00 . A A . 1 TRP CA 1 1
5 835 1 1 1 TRP CB C 2.705 1.408 -1.478 1.00 . A A . 1 TRP CB 1 1
5 836 1 1 1 TRP CD1 C 5.047 2.092 -0.693 1.00 . A A . 1 TRP CD1 1 1
5 837 1 1 1 TRP CD2 C 3.452 2.319 0.862 1.00 . A A . 1 TRP CD2 1 1
5 838 1 1 1 TRP CE2 C 4.682 2.725 1.417 1.00 . A A . 1 TRP CE2 1 1
5 839 1 1 1 TRP CE3 C 2.304 2.377 1.657 1.00 . A A . 1 TRP CE3 1 1
5 840 1 1 1 TRP CG C 3.708 1.918 -0.488 1.00 . A A . 1 TRP CG 1 1
5 841 1 1 1 TRP CH2 C 3.653 3.226 3.483 1.00 . A A . 1 TRP CH2 1 1
5 842 1 1 1 TRP CZ2 C 4.793 3.180 2.728 1.00 . A A . 1 TRP CZ2 1 1
5 843 1 1 1 TRP CZ3 C 2.416 2.828 2.958 1.00 . A A . 1 TRP CZ3 1 1
5 844 1 1 1 TRP H1 H 1.966 -0.032 0.936 1.00 . A A . 1 TRP H1 1 1
5 845 1 1 1 TRP HA H 1.539 -0.323 -1.950 1.00 . A A . 1 TRP HA 1 1
5 846 1 1 1 TRP HB2 H 3.166 1.415 -2.454 1.00 . A A . 1 TRP HB2 1 1
5 847 1 1 1 TRP HB3 H 1.862 2.084 -1.477 1.00 . A A . 1 TRP HB3 1 1
5 848 1 1 1 TRP HD1 H 5.553 1.874 -1.622 1.00 . A A . 1 TRP HD1 1 1
5 849 1 1 1 TRP HE1 H 6.592 2.783 0.551 1.00 . A A . 1 TRP HE1 1 1
5 850 1 1 1 TRP HE3 H 1.342 2.074 1.270 1.00 . A A . 1 TRP HE3 1 1
5 851 1 1 1 TRP HH2 H 3.693 3.572 4.504 1.00 . A A . 1 TRP HH2 1 1
5 852 1 1 1 TRP HZ2 H 5.739 3.491 3.147 1.00 . A A . 1 TRP HZ2 1 1
5 853 1 1 1 TRP HZ3 H 1.539 2.879 3.587 1.00 . A A . 1 TRP HZ3 1 1
5 854 1 1 1 TRP N N 1.471 -0.019 0.090 1.00 . A A . 1 TRP N 1 1
5 855 1 1 1 TRP NE1 N 5.639 2.576 0.448 1.00 . A A . 1 TRP NE1 1 1
5 856 1 1 1 TRP O O 3.311 -2.034 -0.500 1.00 . A A . 1 TRP O 1 1
5 857 1 1 2 LYS C C 6.126 -1.785 -0.366 1.00 . A A . 2 LYS C 1 1
5 858 1 1 2 LYS CA C 5.690 -1.418 -1.781 1.00 . A A . 2 LYS CA 1 1
5 859 1 1 2 LYS CB C 6.825 -0.688 -2.502 1.00 . A A . 2 LYS CB 1 1
5 860 1 1 2 LYS CD C 7.980 0.873 -0.908 1.00 . A A . 2 LYS CD 1 1
5 861 1 1 2 LYS CE C 9.314 1.234 -0.274 1.00 . A A . 2 LYS CE 1 1
5 862 1 1 2 LYS CG C 8.051 -0.460 -1.634 1.00 . A A . 2 LYS CG 1 1
5 863 1 1 2 LYS H H 4.495 0.272 -2.227 1.00 . A A . 2 LYS H 1 1
5 864 1 1 2 LYS HA H 5.456 -2.324 -2.319 1.00 . A A . 2 LYS HA 1 1
5 865 1 1 2 LYS HB2 H 7.122 -1.270 -3.362 1.00 . A A . 2 LYS HB2 1 1
5 866 1 1 2 LYS HB3 H 6.463 0.274 -2.836 1.00 . A A . 2 LYS HB3 1 1
5 867 1 1 2 LYS HD2 H 7.709 1.644 -1.613 1.00 . A A . 2 LYS HD2 1 1
5 868 1 1 2 LYS HD3 H 7.228 0.811 -0.133 1.00 . A A . 2 LYS HD3 1 1
5 869 1 1 2 LYS HE2 H 9.630 0.418 0.359 1.00 . A A . 2 LYS HE2 1 1
5 870 1 1 2 LYS HE3 H 10.042 1.383 -1.058 1.00 . A A . 2 LYS HE3 1 1
5 871 1 1 2 LYS HG2 H 8.115 -1.253 -0.903 1.00 . A A . 2 LYS HG2 1 1
5 872 1 1 2 LYS HG3 H 8.931 -0.472 -2.260 1.00 . A A . 2 LYS HG3 1 1
5 873 1 1 2 LYS HZ1 H 8.396 2.427 1.175 1.00 . A A . 2 LYS HZ1 1 1
5 874 1 1 2 LYS HZ2 H 9.125 3.304 -0.075 1.00 . A A . 2 LYS HZ2 1 1
5 875 1 1 2 LYS HZ3 H 10.079 2.586 1.123 1.00 . A A . 2 LYS HZ3 1 1
5 876 1 1 2 LYS N N 4.491 -0.589 -1.757 1.00 . A A . 2 LYS N 1 1
5 877 1 1 2 LYS NZ N 9.222 2.474 0.545 1.00 . A A . 2 LYS NZ 1 1
5 878 1 1 2 LYS O O 6.629 -2.884 -0.126 1.00 . A A . 2 LYS O 1 1
5 879 1 1 3 LEU C C 5.324 -2.046 2.635 1.00 . A A . 3 LEU C 1 1
5 880 1 1 3 LEU CA C 6.301 -1.088 1.960 1.00 . A A . 3 LEU CA 1 1
5 881 1 1 3 LEU CB C 6.340 0.238 2.721 1.00 . A A . 3 LEU CB 1 1
5 882 1 1 3 LEU CD1 C 5.523 -0.188 5.052 1.00 . A A . 3 LEU CD1 1 1
5 883 1 1 3 LEU CD2 C 7.837 -0.874 4.397 1.00 . A A . 3 LEU CD2 1 1
5 884 1 1 3 LEU CG C 6.733 0.154 4.197 1.00 . A A . 3 LEU CG 1 1
5 885 1 1 3 LEU H H 5.525 -0.005 0.316 1.00 . A A . 3 LEU H 1 1
5 886 1 1 3 LEU HA H 7.286 -1.531 1.972 1.00 . A A . 3 LEU HA 1 1
5 887 1 1 3 LEU HB2 H 7.051 0.882 2.226 1.00 . A A . 3 LEU HB2 1 1
5 888 1 1 3 LEU HB3 H 5.356 0.681 2.664 1.00 . A A . 3 LEU HB3 1 1
5 889 1 1 3 LEU HD11 H 4.627 -0.118 4.453 1.00 . A A . 3 LEU HD11 1 1
5 890 1 1 3 LEU HD12 H 5.459 0.504 5.878 1.00 . A A . 3 LEU HD12 1 1
5 891 1 1 3 LEU HD13 H 5.624 -1.194 5.432 1.00 . A A . 3 LEU HD13 1 1
5 892 1 1 3 LEU HD21 H 7.992 -1.035 5.453 1.00 . A A . 3 LEU HD21 1 1
5 893 1 1 3 LEU HD22 H 8.751 -0.511 3.950 1.00 . A A . 3 LEU HD22 1 1
5 894 1 1 3 LEU HD23 H 7.553 -1.804 3.927 1.00 . A A . 3 LEU HD23 1 1
5 895 1 1 3 LEU HG H 7.107 1.116 4.518 1.00 . A A . 3 LEU HG 1 1
5 896 1 1 3 LEU N N 5.929 -0.861 0.568 1.00 . A A . 3 LEU N 1 1
5 897 1 1 3 LEU O O 5.621 -2.615 3.686 1.00 . A A . 3 LEU O 1 1
5 898 1 1 4 LEU C C 3.222 -4.492 1.918 1.00 . A A . 4 LEU C 1 1
5 899 1 1 4 LEU CA C 3.137 -3.113 2.563 1.00 . A A . 4 LEU CA 1 1
5 900 1 1 4 LEU CB C 1.745 -2.518 2.342 1.00 . A A . 4 LEU CB 1 1
5 901 1 1 4 LEU CD1 C 1.266 -2.221 4.785 1.00 . A A . 4 LEU CD1 1 1
5 902 1 1 4 LEU CD2 C 2.096 -0.288 3.431 1.00 . A A . 4 LEU CD2 1 1
5 903 1 1 4 LEU CG C 1.249 -1.552 3.419 1.00 . A A . 4 LEU CG 1 1
5 904 1 1 4 LEU H H 3.978 -1.741 1.188 1.00 . A A . 4 LEU H 1 1
5 905 1 1 4 LEU HA H 3.313 -3.213 3.624 1.00 . A A . 4 LEU HA 1 1
5 906 1 1 4 LEU HB2 H 1.757 -1.988 1.403 1.00 . A A . 4 LEU HB2 1 1
5 907 1 1 4 LEU HB3 H 1.042 -3.338 2.282 1.00 . A A . 4 LEU HB3 1 1
5 908 1 1 4 LEU HD11 H 0.262 -2.261 5.178 1.00 . A A . 4 LEU HD11 1 1
5 909 1 1 4 LEU HD12 H 1.894 -1.653 5.456 1.00 . A A . 4 LEU HD12 1 1
5 910 1 1 4 LEU HD13 H 1.657 -3.223 4.690 1.00 . A A . 4 LEU HD13 1 1
5 911 1 1 4 LEU HD21 H 2.644 -0.231 4.360 1.00 . A A . 4 LEU HD21 1 1
5 912 1 1 4 LEU HD22 H 1.453 0.576 3.338 1.00 . A A . 4 LEU HD22 1 1
5 913 1 1 4 LEU HD23 H 2.789 -0.311 2.603 1.00 . A A . 4 LEU HD23 1 1
5 914 1 1 4 LEU HG H 0.229 -1.271 3.198 1.00 . A A . 4 LEU HG 1 1
5 915 1 1 4 LEU N N 4.158 -2.221 2.023 1.00 . A A . 4 LEU N 1 1
5 916 1 1 4 LEU O O 2.967 -5.508 2.565 1.00 . A A . 4 LEU O 1 1
5 917 1 1 5 SER C C 5.040 -6.448 0.189 1.00 . A A . 5 SER C 1 1
5 918 1 1 5 SER CA C 3.700 -5.775 -0.095 1.00 . A A . 5 SER CA 1 1
5 919 1 1 5 SER CB C 3.549 -5.528 -1.597 1.00 . A A . 5 SER CB 1 1
5 920 1 1 5 SER H H 3.773 -3.677 0.177 1.00 . A A . 5 SER H 1 1
5 921 1 1 5 SER HA H 2.906 -6.428 0.236 1.00 . A A . 5 SER HA 1 1
5 922 1 1 5 SER HB2 H 4.412 -4.991 -1.960 1.00 . A A . 5 SER HB2 1 1
5 923 1 1 5 SER HB3 H 3.474 -6.476 -2.109 1.00 . A A . 5 SER HB3 1 1
5 924 1 1 5 SER HG H 1.686 -5.348 -2.176 1.00 . A A . 5 SER HG 1 1
5 925 1 1 5 SER N N 3.583 -4.520 0.639 1.00 . A A . 5 SER N 1 1
5 926 1 1 5 SER O O 5.125 -7.672 0.286 1.00 . A A . 5 SER O 1 1
5 927 1 1 5 SER OG O 2.387 -4.766 -1.874 1.00 . A A . 5 SER OG 1 1
5 928 1 1 6 LYS C C 7.497 -6.752 1.996 1.00 . A A . 6 LYS C 1 1
5 929 1 1 6 LYS CA C 7.421 -6.151 0.596 1.00 . A A . 6 LYS CA 1 1
5 930 1 1 6 LYS CB C 8.458 -5.035 0.452 1.00 . A A . 6 LYS CB 1 1
5 931 1 1 6 LYS CD C 9.392 -2.891 1.368 1.00 . A A . 6 LYS CD 1 1
5 932 1 1 6 LYS CE C 10.835 -3.295 1.104 1.00 . A A . 6 LYS CE 1 1
5 933 1 1 6 LYS CG C 8.517 -4.101 1.648 1.00 . A A . 6 LYS CG 1 1
5 934 1 1 6 LYS H H 5.953 -4.670 0.234 1.00 . A A . 6 LYS H 1 1
5 935 1 1 6 LYS HA H 7.634 -6.925 -0.126 1.00 . A A . 6 LYS HA 1 1
5 936 1 1 6 LYS HB2 H 9.433 -5.481 0.321 1.00 . A A . 6 LYS HB2 1 1
5 937 1 1 6 LYS HB3 H 8.219 -4.449 -0.424 1.00 . A A . 6 LYS HB3 1 1
5 938 1 1 6 LYS HD2 H 9.011 -2.374 0.500 1.00 . A A . 6 LYS HD2 1 1
5 939 1 1 6 LYS HD3 H 9.363 -2.231 2.223 1.00 . A A . 6 LYS HD3 1 1
5 940 1 1 6 LYS HE2 H 10.899 -4.372 1.108 1.00 . A A . 6 LYS HE2 1 1
5 941 1 1 6 LYS HE3 H 11.128 -2.921 0.134 1.00 . A A . 6 LYS HE3 1 1
5 942 1 1 6 LYS HG2 H 7.518 -3.763 1.879 1.00 . A A . 6 LYS HG2 1 1
5 943 1 1 6 LYS HG3 H 8.922 -4.639 2.493 1.00 . A A . 6 LYS HG3 1 1
5 944 1 1 6 LYS HZ1 H 12.391 -3.500 2.482 1.00 . A A . 6 LYS HZ1 1 1
5 945 1 1 6 LYS HZ2 H 11.218 -2.367 2.936 1.00 . A A . 6 LYS HZ2 1 1
5 946 1 1 6 LYS HZ3 H 12.339 -1.987 1.727 1.00 . A A . 6 LYS HZ3 1 1
5 947 1 1 6 LYS N N 6.084 -5.638 0.322 1.00 . A A . 6 LYS N 1 1
5 948 1 1 6 LYS NZ N 11.761 -2.749 2.134 1.00 . A A . 6 LYS NZ 1 1
5 949 1 1 6 LYS O O 8.201 -7.735 2.223 1.00 . A A . 6 LYS O 1 1
5 950 1 1 7 ALA C C 5.733 -7.757 4.486 1.00 . A A . 7 ALA C 1 1
5 951 1 1 7 ALA CA C 6.748 -6.632 4.309 1.00 . A A . 7 ALA CA 1 1
5 952 1 1 7 ALA CB C 6.441 -5.486 5.261 1.00 . A A . 7 ALA CB 1 1
5 953 1 1 7 ALA H H 6.225 -5.373 2.690 1.00 . A A . 7 ALA H 1 1
5 954 1 1 7 ALA HA H 7.733 -7.009 4.544 1.00 . A A . 7 ALA HA 1 1
5 955 1 1 7 ALA HB1 H 7.358 -4.976 5.517 1.00 . A A . 7 ALA HB1 1 1
5 956 1 1 7 ALA HB2 H 5.764 -4.794 4.784 1.00 . A A . 7 ALA HB2 1 1
5 957 1 1 7 ALA HB3 H 5.984 -5.877 6.158 1.00 . A A . 7 ALA HB3 1 1
5 958 1 1 7 ALA N N 6.766 -6.154 2.932 1.00 . A A . 7 ALA N 1 1
5 959 1 1 7 ALA O O 5.973 -8.709 5.228 1.00 . A A . 7 ALA O 1 1
5 960 1 1 8 GLN C C 3.914 -9.883 3.070 1.00 . A A . 8 GLN C 1 1
5 961 1 1 8 GLN CA C 3.549 -8.646 3.884 1.00 . A A . 8 GLN CA 1 1
5 962 1 1 8 GLN CB C 2.221 -8.069 3.391 1.00 . A A . 8 GLN CB 1 1
5 963 1 1 8 GLN CD C -0.257 -8.483 3.657 1.00 . A A . 8 GLN CD 1 1
5 964 1 1 8 GLN CG C 1.096 -9.090 3.341 1.00 . A A . 8 GLN CG 1 1
5 965 1 1 8 GLN H H 4.469 -6.857 3.226 1.00 . A A . 8 GLN H 1 1
5 966 1 1 8 GLN HA H 3.445 -8.930 4.920 1.00 . A A . 8 GLN HA 1 1
5 967 1 1 8 GLN HB2 H 1.923 -7.268 4.051 1.00 . A A . 8 GLN HB2 1 1
5 968 1 1 8 GLN HB3 H 2.362 -7.672 2.396 1.00 . A A . 8 GLN HB3 1 1
5 969 1 1 8 GLN HE21 H -0.676 -9.994 4.880 1.00 . A A . 8 GLN HE21 1 1
5 970 1 1 8 GLN HE22 H -1.902 -8.786 4.730 1.00 . A A . 8 GLN HE22 1 1
5 971 1 1 8 GLN HG2 H 1.058 -9.517 2.350 1.00 . A A . 8 GLN HG2 1 1
5 972 1 1 8 GLN HG3 H 1.302 -9.869 4.060 1.00 . A A . 8 GLN HG3 1 1
5 973 1 1 8 GLN N N 4.601 -7.639 3.800 1.00 . A A . 8 GLN N 1 1
5 974 1 1 8 GLN NE2 N -1.023 -9.155 4.508 1.00 . A A . 8 GLN NE2 1 1
5 975 1 1 8 GLN O O 3.483 -10.992 3.383 1.00 . A A . 8 GLN O 1 1
5 976 1 1 8 GLN OE1 O -0.610 -7.422 3.142 1.00 . A A . 8 GLN OE1 1 1
5 977 1 1 9 GLU C C 5.752 -11.910 1.988 1.00 . A A . 9 GLU C 1 1
5 978 1 1 9 GLU CA C 5.132 -10.783 1.165 1.00 . A A . 9 GLU CA 1 1
5 979 1 1 9 GLU CB C 6.134 -10.289 0.120 1.00 . A A . 9 GLU CB 1 1
5 980 1 1 9 GLU CD C 5.913 -12.371 -1.293 1.00 . A A . 9 GLU CD 1 1
5 981 1 1 9 GLU CG C 6.862 -11.409 -0.604 1.00 . A A . 9 GLU CG 1 1
5 982 1 1 9 GLU H H 5.022 -8.775 1.826 1.00 . A A . 9 GLU H 1 1
5 983 1 1 9 GLU HA H 4.257 -11.163 0.660 1.00 . A A . 9 GLU HA 1 1
5 984 1 1 9 GLU HB2 H 5.608 -9.696 -0.613 1.00 . A A . 9 GLU HB2 1 1
5 985 1 1 9 GLU HB3 H 6.870 -9.669 0.611 1.00 . A A . 9 GLU HB3 1 1
5 986 1 1 9 GLU HG2 H 7.514 -10.976 -1.347 1.00 . A A . 9 GLU HG2 1 1
5 987 1 1 9 GLU HG3 H 7.451 -11.961 0.114 1.00 . A A . 9 GLU HG3 1 1
5 988 1 1 9 GLU N N 4.711 -9.683 2.025 1.00 . A A . 9 GLU N 1 1
5 989 1 1 9 GLU O O 5.546 -13.089 1.701 1.00 . A A . 9 GLU O 1 1
5 990 1 1 9 GLU OE1 O 4.976 -11.897 -1.969 1.00 . A A . 9 GLU OE1 1 1
5 991 1 1 9 GLU OE2 O 6.107 -13.597 -1.157 1.00 . A A . 9 GLU OE2 1 1
5 992 1 1 10 LYS C C 6.253 -12.903 5.038 1.00 . A A . 10 LYS C 1 1
5 993 1 1 10 LYS CA C 7.162 -12.513 3.877 1.00 . A A . 10 LYS CA 1 1
5 994 1 1 10 LYS CB C 8.480 -11.951 4.415 1.00 . A A . 10 LYS CB 1 1
5 995 1 1 10 LYS CD C 8.810 -9.468 4.596 1.00 . A A . 10 LYS CD 1 1
5 996 1 1 10 LYS CE C 9.527 -8.543 5.568 1.00 . A A . 10 LYS CE 1 1
5 997 1 1 10 LYS CG C 8.305 -10.722 5.289 1.00 . A A . 10 LYS CG 1 1
5 998 1 1 10 LYS H H 6.638 -10.581 3.190 1.00 . A A . 10 LYS H 1 1
5 999 1 1 10 LYS HA H 7.370 -13.393 3.288 1.00 . A A . 10 LYS HA 1 1
5 1000 1 1 10 LYS HB2 H 8.972 -12.715 4.998 1.00 . A A . 10 LYS HB2 1 1
5 1001 1 1 10 LYS HB3 H 9.112 -11.686 3.579 1.00 . A A . 10 LYS HB3 1 1
5 1002 1 1 10 LYS HD2 H 9.498 -9.751 3.813 1.00 . A A . 10 LYS HD2 1 1
5 1003 1 1 10 LYS HD3 H 7.970 -8.942 4.165 1.00 . A A . 10 LYS HD3 1 1
5 1004 1 1 10 LYS HE2 H 10.373 -9.067 5.985 1.00 . A A . 10 LYS HE2 1 1
5 1005 1 1 10 LYS HE3 H 9.872 -7.673 5.028 1.00 . A A . 10 LYS HE3 1 1
5 1006 1 1 10 LYS HG2 H 7.257 -10.598 5.515 1.00 . A A . 10 LYS HG2 1 1
5 1007 1 1 10 LYS HG3 H 8.859 -10.862 6.207 1.00 . A A . 10 LYS HG3 1 1
5 1008 1 1 10 LYS HZ1 H 8.674 -8.786 7.459 1.00 . A A . 10 LYS HZ1 1 1
5 1009 1 1 10 LYS HZ2 H 7.652 -8.037 6.338 1.00 . A A . 10 LYS HZ2 1 1
5 1010 1 1 10 LYS HZ3 H 8.931 -7.171 7.026 1.00 . A A . 10 LYS HZ3 1 1
5 1011 1 1 10 LYS N N 6.512 -11.537 3.012 1.00 . A A . 10 LYS N 1 1
5 1012 1 1 10 LYS NZ N 8.634 -8.103 6.675 1.00 . A A . 10 LYS NZ 1 1
5 1013 1 1 10 LYS O O 6.690 -13.542 5.995 1.00 . A A . 10 LYS O 1 1
5 1014 1 1 11 PHE C C 2.887 -13.696 5.441 1.00 . A A . 11 PHE C 1 1
5 1015 1 1 11 PHE CA C 4.013 -12.824 5.988 1.00 . A A . 11 PHE CA 1 1
5 1016 1 1 11 PHE CB C 3.436 -11.535 6.575 1.00 . A A . 11 PHE CB 1 1
5 1017 1 1 11 PHE CD1 C 5.612 -11.239 7.788 1.00 . A A . 11 PHE CD1 1 1
5 1018 1 1 11 PHE CD2 C 4.269 -9.311 7.384 1.00 . A A . 11 PHE CD2 1 1
5 1019 1 1 11 PHE CE1 C 6.557 -10.453 8.421 1.00 . A A . 11 PHE CE1 1 1
5 1020 1 1 11 PHE CE2 C 5.211 -8.520 8.016 1.00 . A A . 11 PHE CE2 1 1
5 1021 1 1 11 PHE CG C 4.460 -10.678 7.263 1.00 . A A . 11 PHE CG 1 1
5 1022 1 1 11 PHE CZ C 6.355 -9.092 8.536 1.00 . A A . 11 PHE CZ 1 1
5 1023 1 1 11 PHE H H 4.696 -12.008 4.158 1.00 . A A . 11 PHE H 1 1
5 1024 1 1 11 PHE HA H 4.526 -13.367 6.768 1.00 . A A . 11 PHE HA 1 1
5 1025 1 1 11 PHE HB2 H 2.995 -10.952 5.781 1.00 . A A . 11 PHE HB2 1 1
5 1026 1 1 11 PHE HB3 H 2.673 -11.787 7.297 1.00 . A A . 11 PHE HB3 1 1
5 1027 1 1 11 PHE HD1 H 5.771 -12.305 7.699 1.00 . A A . 11 PHE HD1 1 1
5 1028 1 1 11 PHE HD2 H 3.374 -8.862 6.979 1.00 . A A . 11 PHE HD2 1 1
5 1029 1 1 11 PHE HE1 H 7.451 -10.904 8.826 1.00 . A A . 11 PHE HE1 1 1
5 1030 1 1 11 PHE HE2 H 5.050 -7.456 8.104 1.00 . A A . 11 PHE HE2 1 1
5 1031 1 1 11 PHE HZ H 7.092 -8.476 9.029 1.00 . A A . 11 PHE HZ 1 1
5 1032 1 1 11 PHE N N 4.985 -12.515 4.946 1.00 . A A . 11 PHE N 1 1
5 1033 1 1 11 PHE O O 2.314 -14.513 6.160 1.00 . A A . 11 PHE O 1 1
5 1034 1 1 12 GLY C C 1.725 -15.784 3.697 1.00 . A A . 12 GLY C 1 1
5 1035 1 1 12 GLY CA C 1.518 -14.291 3.538 1.00 . A A . 12 GLY CA 1 1
5 1036 1 1 12 GLY H H 3.066 -12.849 3.636 1.00 . A A . 12 GLY H 1 1
5 1037 1 1 12 GLY HA2 H 0.575 -14.019 3.987 1.00 . A A . 12 GLY HA2 1 1
5 1038 1 1 12 GLY HA3 H 1.487 -14.054 2.485 1.00 . A A . 12 GLY HA3 1 1
5 1039 1 1 12 GLY N N 2.575 -13.515 4.161 1.00 . A A . 12 GLY N 1 1
5 1040 1 1 12 GLY O O 2.498 -16.393 2.956 1.00 . A A . 12 GLY O 1 1
6 1041 1 1 1 TRP C C 3.344 -0.921 -1.081 1.00 . A A . 1 TRP C 1 1
6 1042 1 1 1 TRP CA C 2.155 0.031 -1.148 1.00 . A A . 1 TRP CA 1 1
6 1043 1 1 1 TRP CB C 2.635 1.444 -1.480 1.00 . A A . 1 TRP CB 1 1
6 1044 1 1 1 TRP CD1 C 4.969 2.167 -0.709 1.00 . A A . 1 TRP CD1 1 1
6 1045 1 1 1 TRP CD2 C 3.375 2.392 0.848 1.00 . A A . 1 TRP CD2 1 1
6 1046 1 1 1 TRP CE2 C 4.600 2.820 1.394 1.00 . A A . 1 TRP CE2 1 1
6 1047 1 1 1 TRP CE3 C 2.227 2.443 1.644 1.00 . A A . 1 TRP CE3 1 1
6 1048 1 1 1 TRP CG C 3.633 1.979 -0.499 1.00 . A A . 1 TRP CG 1 1
6 1049 1 1 1 TRP CH2 C 3.569 3.331 3.457 1.00 . A A . 1 TRP CH2 1 1
6 1050 1 1 1 TRP CZ2 C 4.708 3.291 2.700 1.00 . A A . 1 TRP CZ2 1 1
6 1051 1 1 1 TRP CZ3 C 2.336 2.911 2.939 1.00 . A A . 1 TRP CZ3 1 1
6 1052 1 1 1 TRP H1 H 1.912 0.019 0.955 1.00 . A A . 1 TRP H1 1 1
6 1053 1 1 1 TRP HA H 1.484 -0.304 -1.925 1.00 . A A . 1 TRP HA 1 1
6 1054 1 1 1 TRP HB2 H 3.096 1.441 -2.457 1.00 . A A . 1 TRP HB2 1 1
6 1055 1 1 1 TRP HB3 H 1.785 2.112 -1.490 1.00 . A A . 1 TRP HB3 1 1
6 1056 1 1 1 TRP HD1 H 5.476 1.945 -1.636 1.00 . A A . 1 TRP HD1 1 1
6 1057 1 1 1 TRP HE1 H 6.507 2.893 0.524 1.00 . A A . 1 TRP HE1 1 1
6 1058 1 1 1 TRP HE3 H 1.268 2.124 1.263 1.00 . A A . 1 TRP HE3 1 1
6 1059 1 1 1 TRP HH2 H 3.607 3.689 4.474 1.00 . A A . 1 TRP HH2 1 1
6 1060 1 1 1 TRP HZ2 H 5.651 3.619 3.113 1.00 . A A . 1 TRP HZ2 1 1
6 1061 1 1 1 TRP HZ3 H 1.460 2.958 3.570 1.00 . A A . 1 TRP HZ3 1 1
6 1062 1 1 1 TRP N N 1.416 0.030 0.110 1.00 . A A . 1 TRP N 1 1
6 1063 1 1 1 TRP NE1 N 5.557 2.672 0.426 1.00 . A A . 1 TRP NE1 1 1
6 1064 1 1 1 TRP O O 3.271 -1.980 -0.457 1.00 . A A . 1 TRP O 1 1
6 1065 1 1 2 LYS C C 6.088 -1.698 -0.323 1.00 . A A . 2 LYS C 1 1
6 1066 1 1 2 LYS CA C 5.646 -1.356 -1.742 1.00 . A A . 2 LYS CA 1 1
6 1067 1 1 2 LYS CB C 6.774 -0.627 -2.476 1.00 . A A . 2 LYS CB 1 1
6 1068 1 1 2 LYS CD C 8.161 0.576 -0.762 1.00 . A A . 2 LYS CD 1 1
6 1069 1 1 2 LYS CE C 8.895 1.750 -1.393 1.00 . A A . 2 LYS CE 1 1
6 1070 1 1 2 LYS CG C 8.086 -0.609 -1.711 1.00 . A A . 2 LYS CG 1 1
6 1071 1 1 2 LYS H H 4.437 0.317 -2.209 1.00 . A A . 2 LYS H 1 1
6 1072 1 1 2 LYS HA H 5.420 -2.272 -2.267 1.00 . A A . 2 LYS HA 1 1
6 1073 1 1 2 LYS HB2 H 6.942 -1.112 -3.426 1.00 . A A . 2 LYS HB2 1 1
6 1074 1 1 2 LYS HB3 H 6.470 0.395 -2.652 1.00 . A A . 2 LYS HB3 1 1
6 1075 1 1 2 LYS HD2 H 7.159 0.887 -0.508 1.00 . A A . 2 LYS HD2 1 1
6 1076 1 1 2 LYS HD3 H 8.685 0.275 0.134 1.00 . A A . 2 LYS HD3 1 1
6 1077 1 1 2 LYS HE2 H 8.889 2.576 -0.699 1.00 . A A . 2 LYS HE2 1 1
6 1078 1 1 2 LYS HE3 H 9.915 1.455 -1.592 1.00 . A A . 2 LYS HE3 1 1
6 1079 1 1 2 LYS HG2 H 8.171 -1.520 -1.139 1.00 . A A . 2 LYS HG2 1 1
6 1080 1 1 2 LYS HG3 H 8.902 -0.546 -2.416 1.00 . A A . 2 LYS HG3 1 1
6 1081 1 1 2 LYS HZ1 H 7.238 2.331 -2.525 1.00 . A A . 2 LYS HZ1 1 1
6 1082 1 1 2 LYS HZ2 H 8.391 1.454 -3.398 1.00 . A A . 2 LYS HZ2 1 1
6 1083 1 1 2 LYS HZ3 H 8.685 3.070 -2.997 1.00 . A A . 2 LYS HZ3 1 1
6 1084 1 1 2 LYS N N 4.440 -0.538 -1.729 1.00 . A A . 2 LYS N 1 1
6 1085 1 1 2 LYS NZ N 8.257 2.182 -2.667 1.00 . A A . 2 LYS NZ 1 1
6 1086 1 1 2 LYS O O 6.600 -2.789 -0.067 1.00 . A A . 2 LYS O 1 1
6 1087 1 1 3 LEU C C 5.285 -1.910 2.686 1.00 . A A . 3 LEU C 1 1
6 1088 1 1 3 LEU CA C 6.260 -0.965 1.992 1.00 . A A . 3 LEU CA 1 1
6 1089 1 1 3 LEU CB C 6.302 0.375 2.730 1.00 . A A . 3 LEU CB 1 1
6 1090 1 1 3 LEU CD1 C 5.515 0.006 5.081 1.00 . A A . 3 LEU CD1 1 1
6 1091 1 1 3 LEU CD2 C 7.813 -0.715 4.407 1.00 . A A . 3 LEU CD2 1 1
6 1092 1 1 3 LEU CG C 6.715 0.318 4.201 1.00 . A A . 3 LEU CG 1 1
6 1093 1 1 3 LEU H H 5.472 0.087 0.333 1.00 . A A . 3 LEU H 1 1
6 1094 1 1 3 LEU HA H 7.245 -1.407 2.009 1.00 . A A . 3 LEU HA 1 1
6 1095 1 1 3 LEU HB2 H 7.002 1.014 2.214 1.00 . A A . 3 LEU HB2 1 1
6 1096 1 1 3 LEU HB3 H 5.314 0.811 2.679 1.00 . A A . 3 LEU HB3 1 1
6 1097 1 1 3 LEU HD11 H 5.451 0.735 5.874 1.00 . A A . 3 LEU HD11 1 1
6 1098 1 1 3 LEU HD12 H 5.627 -0.980 5.506 1.00 . A A . 3 LEU HD12 1 1
6 1099 1 1 3 LEU HD13 H 4.614 0.041 4.486 1.00 . A A . 3 LEU HD13 1 1
6 1100 1 1 3 LEU HD21 H 8.722 -0.374 3.933 1.00 . A A . 3 LEU HD21 1 1
6 1101 1 1 3 LEU HD22 H 7.509 -1.655 3.970 1.00 . A A . 3 LEU HD22 1 1
6 1102 1 1 3 LEU HD23 H 7.986 -0.850 5.465 1.00 . A A . 3 LEU HD23 1 1
6 1103 1 1 3 LEU HG H 7.103 1.283 4.496 1.00 . A A . 3 LEU HG 1 1
6 1104 1 1 3 LEU N N 5.884 -0.762 0.597 1.00 . A A . 3 LEU N 1 1
6 1105 1 1 3 LEU O O 5.562 -2.415 3.775 1.00 . A A . 3 LEU O 1 1
6 1106 1 1 4 LEU C C 3.213 -4.422 1.975 1.00 . A A . 4 LEU C 1 1
6 1107 1 1 4 LEU CA C 3.127 -3.035 2.604 1.00 . A A . 4 LEU CA 1 1
6 1108 1 1 4 LEU CB C 1.733 -2.447 2.382 1.00 . A A . 4 LEU CB 1 1
6 1109 1 1 4 LEU CD1 C 1.256 -2.141 4.823 1.00 . A A . 4 LEU CD1 1 1
6 1110 1 1 4 LEU CD2 C 2.073 -0.209 3.460 1.00 . A A . 4 LEU CD2 1 1
6 1111 1 1 4 LEU CG C 1.234 -1.479 3.455 1.00 . A A . 4 LEU CG 1 1
6 1112 1 1 4 LEU H H 3.980 -1.716 1.185 1.00 . A A . 4 LEU H 1 1
6 1113 1 1 4 LEU HA H 3.308 -3.122 3.665 1.00 . A A . 4 LEU HA 1 1
6 1114 1 1 4 LEU HB2 H 1.742 -1.920 1.440 1.00 . A A . 4 LEU HB2 1 1
6 1115 1 1 4 LEU HB3 H 1.033 -3.269 2.325 1.00 . A A . 4 LEU HB3 1 1
6 1116 1 1 4 LEU HD11 H 0.252 -2.188 5.217 1.00 . A A . 4 LEU HD11 1 1
6 1117 1 1 4 LEU HD12 H 1.878 -1.564 5.492 1.00 . A A . 4 LEU HD12 1 1
6 1118 1 1 4 LEU HD13 H 1.656 -3.140 4.733 1.00 . A A . 4 LEU HD13 1 1
6 1119 1 1 4 LEU HD21 H 1.426 0.651 3.379 1.00 . A A . 4 LEU HD21 1 1
6 1120 1 1 4 LEU HD22 H 2.756 -0.227 2.623 1.00 . A A . 4 LEU HD22 1 1
6 1121 1 1 4 LEU HD23 H 2.634 -0.153 4.382 1.00 . A A . 4 LEU HD23 1 1
6 1122 1 1 4 LEU HG H 0.211 -1.203 3.235 1.00 . A A . 4 LEU HG 1 1
6 1123 1 1 4 LEU N N 4.144 -2.147 2.049 1.00 . A A . 4 LEU N 1 1
6 1124 1 1 4 LEU O O 2.976 -5.431 2.639 1.00 . A A . 4 LEU O 1 1
6 1125 1 1 5 SER C C 5.021 -6.387 0.248 1.00 . A A . 5 SER C 1 1
6 1126 1 1 5 SER CA C 3.673 -5.727 -0.027 1.00 . A A . 5 SER CA 1 1
6 1127 1 1 5 SER CB C 3.501 -5.500 -1.531 1.00 . A A . 5 SER CB 1 1
6 1128 1 1 5 SER H H 3.734 -3.625 0.217 1.00 . A A . 5 SER H 1 1
6 1129 1 1 5 SER HA H 2.888 -6.380 0.322 1.00 . A A . 5 SER HA 1 1
6 1130 1 1 5 SER HB2 H 4.344 -4.942 -1.907 1.00 . A A . 5 SER HB2 1 1
6 1131 1 1 5 SER HB3 H 3.448 -6.455 -2.032 1.00 . A A . 5 SER HB3 1 1
6 1132 1 1 5 SER HG H 2.346 -3.928 -1.353 1.00 . A A . 5 SER HG 1 1
6 1133 1 1 5 SER N N 3.557 -4.464 0.692 1.00 . A A . 5 SER N 1 1
6 1134 1 1 5 SER O O 5.127 -7.612 0.296 1.00 . A A . 5 SER O 1 1
6 1135 1 1 5 SER OG O 2.315 -4.774 -1.804 1.00 . A A . 5 SER OG 1 1
6 1136 1 1 6 LYS C C 7.456 -6.734 2.068 1.00 . A A . 6 LYS C 1 1
6 1137 1 1 6 LYS CA C 7.391 -6.065 0.698 1.00 . A A . 6 LYS CA 1 1
6 1138 1 1 6 LYS CB C 8.408 -4.923 0.628 1.00 . A A . 6 LYS CB 1 1
6 1139 1 1 6 LYS CD C 9.870 -4.509 2.628 1.00 . A A . 6 LYS CD 1 1
6 1140 1 1 6 LYS CE C 10.977 -3.468 2.573 1.00 . A A . 6 LYS CE 1 1
6 1141 1 1 6 LYS CG C 9.729 -5.243 1.305 1.00 . A A . 6 LYS CG 1 1
6 1142 1 1 6 LYS H H 5.901 -4.596 0.376 1.00 . A A . 6 LYS H 1 1
6 1143 1 1 6 LYS HA H 7.632 -6.797 -0.058 1.00 . A A . 6 LYS HA 1 1
6 1144 1 1 6 LYS HB2 H 8.604 -4.695 -0.409 1.00 . A A . 6 LYS HB2 1 1
6 1145 1 1 6 LYS HB3 H 7.985 -4.051 1.105 1.00 . A A . 6 LYS HB3 1 1
6 1146 1 1 6 LYS HD2 H 8.937 -4.015 2.857 1.00 . A A . 6 LYS HD2 1 1
6 1147 1 1 6 LYS HD3 H 10.099 -5.226 3.405 1.00 . A A . 6 LYS HD3 1 1
6 1148 1 1 6 LYS HE2 H 11.864 -3.926 2.163 1.00 . A A . 6 LYS HE2 1 1
6 1149 1 1 6 LYS HE3 H 10.660 -2.659 1.932 1.00 . A A . 6 LYS HE3 1 1
6 1150 1 1 6 LYS HG2 H 9.782 -6.306 1.488 1.00 . A A . 6 LYS HG2 1 1
6 1151 1 1 6 LYS HG3 H 10.538 -4.947 0.652 1.00 . A A . 6 LYS HG3 1 1
6 1152 1 1 6 LYS HZ1 H 10.501 -2.344 4.269 1.00 . A A . 6 LYS HZ1 1 1
6 1153 1 1 6 LYS HZ2 H 12.147 -2.330 3.877 1.00 . A A . 6 LYS HZ2 1 1
6 1154 1 1 6 LYS HZ3 H 11.459 -3.700 4.593 1.00 . A A . 6 LYS HZ3 1 1
6 1155 1 1 6 LYS N N 6.049 -5.564 0.427 1.00 . A A . 6 LYS N 1 1
6 1156 1 1 6 LYS NZ N 11.293 -2.922 3.923 1.00 . A A . 6 LYS NZ 1 1
6 1157 1 1 6 LYS O O 8.080 -7.782 2.228 1.00 . A A . 6 LYS O 1 1
6 1158 1 1 7 ALA C C 5.753 -7.773 4.540 1.00 . A A . 7 ALA C 1 1
6 1159 1 1 7 ALA CA C 6.786 -6.660 4.406 1.00 . A A . 7 ALA CA 1 1
6 1160 1 1 7 ALA CB C 6.505 -5.552 5.410 1.00 . A A . 7 ALA CB 1 1
6 1161 1 1 7 ALA H H 6.326 -5.288 2.861 1.00 . A A . 7 ALA H 1 1
6 1162 1 1 7 ALA HA H 7.766 -7.064 4.618 1.00 . A A . 7 ALA HA 1 1
6 1163 1 1 7 ALA HB1 H 6.199 -5.988 6.350 1.00 . A A . 7 ALA HB1 1 1
6 1164 1 1 7 ALA HB2 H 7.399 -4.965 5.559 1.00 . A A . 7 ALA HB2 1 1
6 1165 1 1 7 ALA HB3 H 5.716 -4.918 5.034 1.00 . A A . 7 ALA HB3 1 1
6 1166 1 1 7 ALA N N 6.805 -6.121 3.052 1.00 . A A . 7 ALA N 1 1
6 1167 1 1 7 ALA O O 5.971 -8.751 5.254 1.00 . A A . 7 ALA O 1 1
6 1168 1 1 8 GLN C C 3.921 -9.833 3.057 1.00 . A A . 8 GLN C 1 1
6 1169 1 1 8 GLN CA C 3.561 -8.609 3.893 1.00 . A A . 8 GLN CA 1 1
6 1170 1 1 8 GLN CB C 2.250 -8.001 3.391 1.00 . A A . 8 GLN CB 1 1
6 1171 1 1 8 GLN CD C -0.221 -8.393 3.745 1.00 . A A . 8 GLN CD 1 1
6 1172 1 1 8 GLN CG C 1.104 -8.998 3.323 1.00 . A A . 8 GLN CG 1 1
6 1173 1 1 8 GLN H H 4.514 -6.815 3.297 1.00 . A A . 8 GLN H 1 1
6 1174 1 1 8 GLN HA H 3.435 -8.915 4.920 1.00 . A A . 8 GLN HA 1 1
6 1175 1 1 8 GLN HB2 H 1.962 -7.198 4.053 1.00 . A A . 8 GLN HB2 1 1
6 1176 1 1 8 GLN HB3 H 2.409 -7.601 2.400 1.00 . A A . 8 GLN HB3 1 1
6 1177 1 1 8 GLN HE21 H -0.739 -10.091 4.640 1.00 . A A . 8 GLN HE21 1 1
6 1178 1 1 8 GLN HE22 H -1.898 -8.813 4.726 1.00 . A A . 8 GLN HE22 1 1
6 1179 1 1 8 GLN HG2 H 1.012 -9.353 2.308 1.00 . A A . 8 GLN HG2 1 1
6 1180 1 1 8 GLN HG3 H 1.328 -9.828 3.976 1.00 . A A . 8 GLN HG3 1 1
6 1181 1 1 8 GLN N N 4.628 -7.616 3.849 1.00 . A A . 8 GLN N 1 1
6 1182 1 1 8 GLN NE2 N -1.036 -9.178 4.440 1.00 . A A . 8 GLN NE2 1 1
6 1183 1 1 8 GLN O O 3.463 -10.941 3.334 1.00 . A A . 8 GLN O 1 1
6 1184 1 1 8 GLN OE1 O -0.509 -7.233 3.449 1.00 . A A . 8 GLN OE1 1 1
6 1185 1 1 9 GLU C C 5.737 -11.870 1.965 1.00 . A A . 9 GLU C 1 1
6 1186 1 1 9 GLU CA C 5.162 -10.710 1.157 1.00 . A A . 9 GLU CA 1 1
6 1187 1 1 9 GLU CB C 6.201 -10.212 0.150 1.00 . A A . 9 GLU CB 1 1
6 1188 1 1 9 GLU CD C 7.599 -10.868 -1.849 1.00 . A A . 9 GLU CD 1 1
6 1189 1 1 9 GLU CG C 6.945 -11.329 -0.561 1.00 . A A . 9 GLU CG 1 1
6 1190 1 1 9 GLU H H 5.074 -8.717 1.863 1.00 . A A . 9 GLU H 1 1
6 1191 1 1 9 GLU HA H 4.293 -11.058 0.620 1.00 . A A . 9 GLU HA 1 1
6 1192 1 1 9 GLU HB2 H 5.704 -9.608 -0.594 1.00 . A A . 9 GLU HB2 1 1
6 1193 1 1 9 GLU HB3 H 6.925 -9.601 0.671 1.00 . A A . 9 GLU HB3 1 1
6 1194 1 1 9 GLU HG2 H 7.712 -11.710 0.097 1.00 . A A . 9 GLU HG2 1 1
6 1195 1 1 9 GLU HG3 H 6.246 -12.120 -0.792 1.00 . A A . 9 GLU HG3 1 1
6 1196 1 1 9 GLU N N 4.743 -9.623 2.033 1.00 . A A . 9 GLU N 1 1
6 1197 1 1 9 GLU O O 5.505 -13.037 1.649 1.00 . A A . 9 GLU O 1 1
6 1198 1 1 9 GLU OE1 O 7.636 -9.643 -2.089 1.00 . A A . 9 GLU OE1 1 1
6 1199 1 1 9 GLU OE2 O 8.073 -11.731 -2.617 1.00 . A A . 9 GLU OE2 1 1
6 1200 1 1 10 LYS C C 6.157 -12.940 5.002 1.00 . A A . 10 LYS C 1 1
6 1201 1 1 10 LYS CA C 7.097 -12.552 3.865 1.00 . A A . 10 LYS CA 1 1
6 1202 1 1 10 LYS CB C 8.420 -12.038 4.437 1.00 . A A . 10 LYS CB 1 1
6 1203 1 1 10 LYS CD C 8.788 -9.556 4.555 1.00 . A A . 10 LYS CD 1 1
6 1204 1 1 10 LYS CE C 9.595 -8.658 5.481 1.00 . A A . 10 LYS CE 1 1
6 1205 1 1 10 LYS CG C 8.272 -10.786 5.283 1.00 . A A . 10 LYS CG 1 1
6 1206 1 1 10 LYS H H 6.637 -10.592 3.211 1.00 . A A . 10 LYS H 1 1
6 1207 1 1 10 LYS HA H 7.291 -13.425 3.261 1.00 . A A . 10 LYS HA 1 1
6 1208 1 1 10 LYS HB2 H 8.859 -12.812 5.049 1.00 . A A . 10 LYS HB2 1 1
6 1209 1 1 10 LYS HB3 H 9.090 -11.816 3.618 1.00 . A A . 10 LYS HB3 1 1
6 1210 1 1 10 LYS HD2 H 9.418 -9.870 3.737 1.00 . A A . 10 LYS HD2 1 1
6 1211 1 1 10 LYS HD3 H 7.947 -8.997 4.170 1.00 . A A . 10 LYS HD3 1 1
6 1212 1 1 10 LYS HE2 H 10.478 -9.192 5.798 1.00 . A A . 10 LYS HE2 1 1
6 1213 1 1 10 LYS HE3 H 9.886 -7.772 4.937 1.00 . A A . 10 LYS HE3 1 1
6 1214 1 1 10 LYS HG2 H 7.227 -10.641 5.516 1.00 . A A . 10 LYS HG2 1 1
6 1215 1 1 10 LYS HG3 H 8.832 -10.913 6.199 1.00 . A A . 10 LYS HG3 1 1
6 1216 1 1 10 LYS HZ1 H 8.895 -7.229 6.834 1.00 . A A . 10 LYS HZ1 1 1
6 1217 1 1 10 LYS HZ2 H 9.173 -8.748 7.525 1.00 . A A . 10 LYS HZ2 1 1
6 1218 1 1 10 LYS HZ3 H 7.811 -8.497 6.555 1.00 . A A . 10 LYS HZ3 1 1
6 1219 1 1 10 LYS N N 6.489 -11.540 3.010 1.00 . A A . 10 LYS N 1 1
6 1220 1 1 10 LYS NZ N 8.814 -8.255 6.683 1.00 . A A . 10 LYS NZ 1 1
6 1221 1 1 10 LYS O O 6.567 -13.586 5.966 1.00 . A A . 10 LYS O 1 1
6 1222 1 1 11 PHE C C 2.754 -13.671 5.310 1.00 . A A . 11 PHE C 1 1
6 1223 1 1 11 PHE CA C 3.896 -12.849 5.899 1.00 . A A . 11 PHE CA 1 1
6 1224 1 1 11 PHE CB C 3.348 -11.559 6.511 1.00 . A A . 11 PHE CB 1 1
6 1225 1 1 11 PHE CD1 C 5.487 -11.378 7.810 1.00 . A A . 11 PHE CD1 1 1
6 1226 1 1 11 PHE CD2 C 4.250 -9.385 7.383 1.00 . A A . 11 PHE CD2 1 1
6 1227 1 1 11 PHE CE1 C 6.442 -10.645 8.489 1.00 . A A . 11 PHE CE1 1 1
6 1228 1 1 11 PHE CE2 C 5.201 -8.646 8.060 1.00 . A A . 11 PHE CE2 1 1
6 1229 1 1 11 PHE CG C 4.383 -10.758 7.249 1.00 . A A . 11 PHE CG 1 1
6 1230 1 1 11 PHE CZ C 6.298 -9.277 8.615 1.00 . A A . 11 PHE CZ 1 1
6 1231 1 1 11 PHE H H 4.628 -12.030 4.089 1.00 . A A . 11 PHE H 1 1
6 1232 1 1 11 PHE HA H 4.379 -13.428 6.672 1.00 . A A . 11 PHE HA 1 1
6 1233 1 1 11 PHE HB2 H 2.947 -10.937 5.725 1.00 . A A . 11 PHE HB2 1 1
6 1234 1 1 11 PHE HB3 H 2.559 -11.805 7.206 1.00 . A A . 11 PHE HB3 1 1
6 1235 1 1 11 PHE HD1 H 5.601 -12.449 7.712 1.00 . A A . 11 PHE HD1 1 1
6 1236 1 1 11 PHE HD2 H 3.393 -8.891 6.950 1.00 . A A . 11 PHE HD2 1 1
6 1237 1 1 11 PHE HE1 H 7.298 -11.141 8.921 1.00 . A A . 11 PHE HE1 1 1
6 1238 1 1 11 PHE HE2 H 5.086 -7.577 8.158 1.00 . A A . 11 PHE HE2 1 1
6 1239 1 1 11 PHE HZ H 7.042 -8.702 9.145 1.00 . A A . 11 PHE HZ 1 1
6 1240 1 1 11 PHE N N 4.895 -12.543 4.882 1.00 . A A . 11 PHE N 1 1
6 1241 1 1 11 PHE O O 2.162 -14.509 5.990 1.00 . A A . 11 PHE O 1 1
6 1242 1 1 12 GLY C C 1.894 -15.272 2.500 1.00 . A A . 12 GLY C 1 1
6 1243 1 1 12 GLY CA C 1.379 -14.149 3.379 1.00 . A A . 12 GLY CA 1 1
6 1244 1 1 12 GLY H H 2.955 -12.746 3.546 1.00 . A A . 12 GLY H 1 1
6 1245 1 1 12 GLY HA2 H 0.724 -14.565 4.130 1.00 . A A . 12 GLY HA2 1 1
6 1246 1 1 12 GLY HA3 H 0.816 -13.458 2.768 1.00 . A A . 12 GLY HA3 1 1
6 1247 1 1 12 GLY N N 2.449 -13.425 4.039 1.00 . A A . 12 GLY N 1 1
6 1248 1 1 12 GLY O O 3.002 -15.195 1.970 1.00 . A A . 12 GLY O 1 1
7 1249 1 1 1 TRP C C 3.301 -0.848 -1.027 1.00 . A A . 1 TRP C 1 1
7 1250 1 1 1 TRP CA C 2.113 0.106 -1.067 1.00 . A A . 1 TRP CA 1 1
7 1251 1 1 1 TRP CB C 2.590 1.523 -1.389 1.00 . A A . 1 TRP CB 1 1
7 1252 1 1 1 TRP CD1 C 4.936 2.233 -0.640 1.00 . A A . 1 TRP CD1 1 1
7 1253 1 1 1 TRP CD2 C 3.362 2.442 0.940 1.00 . A A . 1 TRP CD2 1 1
7 1254 1 1 1 TRP CE2 C 4.595 2.862 1.476 1.00 . A A . 1 TRP CE2 1 1
7 1255 1 1 1 TRP CE3 C 2.225 2.486 1.751 1.00 . A A . 1 TRP CE3 1 1
7 1256 1 1 1 TRP CG C 3.602 2.044 -0.414 1.00 . A A . 1 TRP CG 1 1
7 1257 1 1 1 TRP CH2 C 3.591 3.350 3.557 1.00 . A A . 1 TRP CH2 1 1
7 1258 1 1 1 TRP CZ2 C 4.720 3.318 2.785 1.00 . A A . 1 TRP CZ2 1 1
7 1259 1 1 1 TRP CZ3 C 2.351 2.938 3.051 1.00 . A A . 1 TRP CZ3 1 1
7 1260 1 1 1 TRP H1 H 1.897 0.071 1.039 1.00 . A A . 1 TRP H1 1 1
7 1261 1 1 1 TRP HA H 1.431 -0.219 -1.840 1.00 . A A . 1 TRP HA 1 1
7 1262 1 1 1 TRP HB2 H 3.039 1.530 -2.371 1.00 . A A . 1 TRP HB2 1 1
7 1263 1 1 1 TRP HB3 H 1.742 2.191 -1.380 1.00 . A A . 1 TRP HB3 1 1
7 1264 1 1 1 TRP HD1 H 5.430 2.021 -1.575 1.00 . A A . 1 TRP HD1 1 1
7 1265 1 1 1 TRP HE1 H 6.491 2.942 0.582 1.00 . A A . 1 TRP HE1 1 1
7 1266 1 1 1 TRP HE3 H 1.261 2.173 1.379 1.00 . A A . 1 TRP HE3 1 1
7 1267 1 1 1 TRP HH2 H 3.643 3.696 4.578 1.00 . A A . 1 TRP HH2 1 1
7 1268 1 1 1 TRP HZ2 H 5.669 3.639 3.190 1.00 . A A . 1 TRP HZ2 1 1
7 1269 1 1 1 TRP HZ3 H 1.483 2.979 3.693 1.00 . A A . 1 TRP HZ3 1 1
7 1270 1 1 1 TRP N N 1.390 0.091 0.200 1.00 . A A . 1 TRP N 1 1
7 1271 1 1 1 TRP NE1 N 5.539 2.724 0.493 1.00 . A A . 1 TRP NE1 1 1
7 1272 1 1 1 TRP O O 3.235 -1.914 -0.414 1.00 . A A . 1 TRP O 1 1
7 1273 1 1 2 LYS C C 6.053 -1.638 -0.313 1.00 . A A . 2 LYS C 1 1
7 1274 1 1 2 LYS CA C 5.594 -1.279 -1.722 1.00 . A A . 2 LYS CA 1 1
7 1275 1 1 2 LYS CB C 6.713 -0.543 -2.462 1.00 . A A . 2 LYS CB 1 1
7 1276 1 1 2 LYS CD C 8.124 0.637 -0.752 1.00 . A A . 2 LYS CD 1 1
7 1277 1 1 2 LYS CE C 8.853 1.817 -1.377 1.00 . A A . 2 LYS CE 1 1
7 1278 1 1 2 LYS CG C 8.035 -0.535 -1.714 1.00 . A A . 2 LYS CG 1 1
7 1279 1 1 2 LYS H H 4.381 0.401 -2.154 1.00 . A A . 2 LYS H 1 1
7 1280 1 1 2 LYS HA H 5.360 -2.188 -2.255 1.00 . A A . 2 LYS HA 1 1
7 1281 1 1 2 LYS HB2 H 6.868 -1.017 -3.420 1.00 . A A . 2 LYS HB2 1 1
7 1282 1 1 2 LYS HB3 H 6.409 0.482 -2.623 1.00 . A A . 2 LYS HB3 1 1
7 1283 1 1 2 LYS HD2 H 7.126 0.947 -0.482 1.00 . A A . 2 LYS HD2 1 1
7 1284 1 1 2 LYS HD3 H 8.658 0.324 0.135 1.00 . A A . 2 LYS HD3 1 1
7 1285 1 1 2 LYS HE2 H 8.849 2.638 -0.677 1.00 . A A . 2 LYS HE2 1 1
7 1286 1 1 2 LYS HE3 H 9.872 1.525 -1.584 1.00 . A A . 2 LYS HE3 1 1
7 1287 1 1 2 LYS HG2 H 8.127 -1.454 -1.154 1.00 . A A . 2 LYS HG2 1 1
7 1288 1 1 2 LYS HG3 H 8.842 -0.465 -2.429 1.00 . A A . 2 LYS HG3 1 1
7 1289 1 1 2 LYS HZ1 H 8.633 3.150 -2.971 1.00 . A A . 2 LYS HZ1 1 1
7 1290 1 1 2 LYS HZ2 H 7.189 2.407 -2.494 1.00 . A A . 2 LYS HZ2 1 1
7 1291 1 1 2 LYS HZ3 H 8.336 1.535 -3.381 1.00 . A A . 2 LYS HZ3 1 1
7 1292 1 1 2 LYS N N 4.389 -0.459 -1.684 1.00 . A A . 2 LYS N 1 1
7 1293 1 1 2 LYS NZ N 8.208 2.258 -2.645 1.00 . A A . 2 LYS NZ 1 1
7 1294 1 1 2 LYS O O 6.568 -2.732 -0.076 1.00 . A A . 2 LYS O 1 1
7 1295 1 1 3 LEU C C 5.288 -1.884 2.704 1.00 . A A . 3 LEU C 1 1
7 1296 1 1 3 LEU CA C 6.256 -0.932 2.008 1.00 . A A . 3 LEU CA 1 1
7 1297 1 1 3 LEU CB C 6.309 0.399 2.761 1.00 . A A . 3 LEU CB 1 1
7 1298 1 1 3 LEU CD1 C 5.552 0.004 5.117 1.00 . A A . 3 LEU CD1 1 1
7 1299 1 1 3 LEU CD2 C 7.840 -0.713 4.405 1.00 . A A . 3 LEU CD2 1 1
7 1300 1 1 3 LEU CG C 6.741 0.325 4.225 1.00 . A A . 3 LEU CG 1 1
7 1301 1 1 3 LEU H H 5.448 0.140 0.372 1.00 . A A . 3 LEU H 1 1
7 1302 1 1 3 LEU HA H 7.240 -1.375 2.007 1.00 . A A . 3 LEU HA 1 1
7 1303 1 1 3 LEU HB2 H 7.003 1.043 2.243 1.00 . A A . 3 LEU HB2 1 1
7 1304 1 1 3 LEU HB3 H 5.321 0.836 2.728 1.00 . A A . 3 LEU HB3 1 1
7 1305 1 1 3 LEU HD11 H 5.501 0.723 5.921 1.00 . A A . 3 LEU HD11 1 1
7 1306 1 1 3 LEU HD12 H 5.668 -0.988 5.529 1.00 . A A . 3 LEU HD12 1 1
7 1307 1 1 3 LEU HD13 H 4.644 0.047 4.535 1.00 . A A . 3 LEU HD13 1 1
7 1308 1 1 3 LEU HD21 H 8.743 -0.368 3.923 1.00 . A A . 3 LEU HD21 1 1
7 1309 1 1 3 LEU HD22 H 7.529 -1.647 3.961 1.00 . A A . 3 LEU HD22 1 1
7 1310 1 1 3 LEU HD23 H 8.027 -0.860 5.459 1.00 . A A . 3 LEU HD23 1 1
7 1311 1 1 3 LEU HG H 7.135 1.286 4.527 1.00 . A A . 3 LEU HG 1 1
7 1312 1 1 3 LEU N N 5.863 -0.712 0.620 1.00 . A A . 3 LEU N 1 1
7 1313 1 1 3 LEU O O 5.578 -2.402 3.783 1.00 . A A . 3 LEU O 1 1
7 1314 1 1 4 LEU C C 3.203 -4.385 1.988 1.00 . A A . 4 LEU C 1 1
7 1315 1 1 4 LEU CA C 3.129 -3.006 2.635 1.00 . A A . 4 LEU CA 1 1
7 1316 1 1 4 LEU CB C 1.732 -2.413 2.440 1.00 . A A . 4 LEU CB 1 1
7 1317 1 1 4 LEU CD1 C 1.294 -2.134 4.892 1.00 . A A . 4 LEU CD1 1 1
7 1318 1 1 4 LEU CD2 C 2.091 -0.188 3.538 1.00 . A A . 4 LEU CD2 1 1
7 1319 1 1 4 LEU CG C 1.250 -1.456 3.531 1.00 . A A . 4 LEU CG 1 1
7 1320 1 1 4 LEU H H 3.965 -1.672 1.221 1.00 . A A . 4 LEU H 1 1
7 1321 1 1 4 LEU HA H 3.323 -3.107 3.693 1.00 . A A . 4 LEU HA 1 1
7 1322 1 1 4 LEU HB2 H 1.730 -1.875 1.504 1.00 . A A . 4 LEU HB2 1 1
7 1323 1 1 4 LEU HB3 H 1.031 -3.233 2.384 1.00 . A A . 4 LEU HB3 1 1
7 1324 1 1 4 LEU HD11 H 1.688 -3.133 4.784 1.00 . A A . 4 LEU HD11 1 1
7 1325 1 1 4 LEU HD12 H 0.296 -2.182 5.302 1.00 . A A . 4 LEU HD12 1 1
7 1326 1 1 4 LEU HD13 H 1.929 -1.566 5.557 1.00 . A A . 4 LEU HD13 1 1
7 1327 1 1 4 LEU HD21 H 1.443 0.674 3.472 1.00 . A A . 4 LEU HD21 1 1
7 1328 1 1 4 LEU HD22 H 2.763 -0.198 2.693 1.00 . A A . 4 LEU HD22 1 1
7 1329 1 1 4 LEU HD23 H 2.663 -0.140 4.453 1.00 . A A . 4 LEU HD23 1 1
7 1330 1 1 4 LEU HG H 0.225 -1.178 3.330 1.00 . A A . 4 LEU HG 1 1
7 1331 1 1 4 LEU N N 4.139 -2.113 2.078 1.00 . A A . 4 LEU N 1 1
7 1332 1 1 4 LEU O O 2.972 -5.402 2.641 1.00 . A A . 4 LEU O 1 1
7 1333 1 1 5 SER C C 4.984 -6.332 0.214 1.00 . A A . 5 SER C 1 1
7 1334 1 1 5 SER CA C 3.634 -5.665 -0.037 1.00 . A A . 5 SER CA 1 1
7 1335 1 1 5 SER CB C 3.445 -5.418 -1.535 1.00 . A A . 5 SER CB 1 1
7 1336 1 1 5 SER H H 3.703 -3.566 0.233 1.00 . A A . 5 SER H 1 1
7 1337 1 1 5 SER HA H 2.851 -6.321 0.313 1.00 . A A . 5 SER HA 1 1
7 1338 1 1 5 SER HB2 H 4.290 -4.865 -1.915 1.00 . A A . 5 SER HB2 1 1
7 1339 1 1 5 SER HB3 H 3.376 -6.367 -2.047 1.00 . A A . 5 SER HB3 1 1
7 1340 1 1 5 SER HG H 2.024 -4.758 -2.711 1.00 . A A . 5 SER HG 1 1
7 1341 1 1 5 SER N N 3.530 -4.411 0.700 1.00 . A A . 5 SER N 1 1
7 1342 1 1 5 SER O O 5.087 -7.558 0.247 1.00 . A A . 5 SER O 1 1
7 1343 1 1 5 SER OG O 2.263 -4.677 -1.784 1.00 . A A . 5 SER OG 1 1
7 1344 1 1 6 LYS C C 7.441 -6.703 2.001 1.00 . A A . 6 LYS C 1 1
7 1345 1 1 6 LYS CA C 7.361 -6.023 0.638 1.00 . A A . 6 LYS CA 1 1
7 1346 1 1 6 LYS CB C 8.380 -4.885 0.563 1.00 . A A . 6 LYS CB 1 1
7 1347 1 1 6 LYS CD C 9.880 -4.488 2.538 1.00 . A A . 6 LYS CD 1 1
7 1348 1 1 6 LYS CE C 10.474 -5.397 3.603 1.00 . A A . 6 LYS CE 1 1
7 1349 1 1 6 LYS CG C 9.711 -5.216 1.215 1.00 . A A . 6 LYS CG 1 1
7 1350 1 1 6 LYS H H 5.871 -4.546 0.351 1.00 . A A . 6 LYS H 1 1
7 1351 1 1 6 LYS HA H 7.588 -6.750 -0.128 1.00 . A A . 6 LYS HA 1 1
7 1352 1 1 6 LYS HB2 H 8.561 -4.647 -0.475 1.00 . A A . 6 LYS HB2 1 1
7 1353 1 1 6 LYS HB3 H 7.968 -4.015 1.055 1.00 . A A . 6 LYS HB3 1 1
7 1354 1 1 6 LYS HD2 H 10.538 -3.644 2.394 1.00 . A A . 6 LYS HD2 1 1
7 1355 1 1 6 LYS HD3 H 8.913 -4.139 2.873 1.00 . A A . 6 LYS HD3 1 1
7 1356 1 1 6 LYS HE2 H 10.203 -6.417 3.379 1.00 . A A . 6 LYS HE2 1 1
7 1357 1 1 6 LYS HE3 H 11.549 -5.297 3.584 1.00 . A A . 6 LYS HE3 1 1
7 1358 1 1 6 LYS HG2 H 9.759 -6.280 1.394 1.00 . A A . 6 LYS HG2 1 1
7 1359 1 1 6 LYS HG3 H 10.511 -4.924 0.550 1.00 . A A . 6 LYS HG3 1 1
7 1360 1 1 6 LYS HZ1 H 9.814 -4.029 5.037 1.00 . A A . 6 LYS HZ1 1 1
7 1361 1 1 6 LYS HZ2 H 10.682 -5.330 5.680 1.00 . A A . 6 LYS HZ2 1 1
7 1362 1 1 6 LYS HZ3 H 9.089 -5.552 5.159 1.00 . A A . 6 LYS HZ3 1 1
7 1363 1 1 6 LYS N N 6.017 -5.515 0.389 1.00 . A A . 6 LYS N 1 1
7 1364 1 1 6 LYS NZ N 9.980 -5.052 4.965 1.00 . A A . 6 LYS NZ 1 1
7 1365 1 1 6 LYS O O 8.064 -7.755 2.144 1.00 . A A . 6 LYS O 1 1
7 1366 1 1 7 ALA C C 5.776 -7.763 4.485 1.00 . A A . 7 ALA C 1 1
7 1367 1 1 7 ALA CA C 6.804 -6.645 4.348 1.00 . A A . 7 ALA CA 1 1
7 1368 1 1 7 ALA CB C 6.530 -5.546 5.365 1.00 . A A . 7 ALA CB 1 1
7 1369 1 1 7 ALA H H 6.328 -5.260 2.821 1.00 . A A . 7 ALA H 1 1
7 1370 1 1 7 ALA HA H 7.787 -7.048 4.547 1.00 . A A . 7 ALA HA 1 1
7 1371 1 1 7 ALA HB1 H 7.264 -5.597 6.155 1.00 . A A . 7 ALA HB1 1 1
7 1372 1 1 7 ALA HB2 H 6.590 -4.584 4.879 1.00 . A A . 7 ALA HB2 1 1
7 1373 1 1 7 ALA HB3 H 5.543 -5.680 5.781 1.00 . A A . 7 ALA HB3 1 1
7 1374 1 1 7 ALA N N 6.807 -6.096 2.998 1.00 . A A . 7 ALA N 1 1
7 1375 1 1 7 ALA O O 6.007 -8.748 5.185 1.00 . A A . 7 ALA O 1 1
7 1376 1 1 8 GLN C C 3.940 -9.822 3.025 1.00 . A A . 8 GLN C 1 1
7 1377 1 1 8 GLN CA C 3.578 -8.598 3.860 1.00 . A A . 8 GLN CA 1 1
7 1378 1 1 8 GLN CB C 2.263 -7.996 3.360 1.00 . A A . 8 GLN CB 1 1
7 1379 1 1 8 GLN CD C -0.189 -8.452 3.765 1.00 . A A . 8 GLN CD 1 1
7 1380 1 1 8 GLN CG C 1.130 -9.005 3.262 1.00 . A A . 8 GLN CG 1 1
7 1381 1 1 8 GLN H H 4.516 -6.795 3.271 1.00 . A A . 8 GLN H 1 1
7 1382 1 1 8 GLN HA H 3.455 -8.903 4.888 1.00 . A A . 8 GLN HA 1 1
7 1383 1 1 8 GLN HB2 H 1.960 -7.211 4.037 1.00 . A A . 8 GLN HB2 1 1
7 1384 1 1 8 GLN HB3 H 2.425 -7.573 2.380 1.00 . A A . 8 GLN HB3 1 1
7 1385 1 1 8 GLN HE21 H -0.939 -8.499 1.924 1.00 . A A . 8 GLN HE21 1 1
7 1386 1 1 8 GLN HE22 H -2.002 -7.913 3.153 1.00 . A A . 8 GLN HE22 1 1
7 1387 1 1 8 GLN HG2 H 1.011 -9.294 2.229 1.00 . A A . 8 GLN HG2 1 1
7 1388 1 1 8 GLN HG3 H 1.387 -9.874 3.850 1.00 . A A . 8 GLN HG3 1 1
7 1389 1 1 8 GLN N N 4.641 -7.602 3.812 1.00 . A A . 8 GLN N 1 1
7 1390 1 1 8 GLN NE2 N -1.139 -8.269 2.856 1.00 . A A . 8 GLN NE2 1 1
7 1391 1 1 8 GLN O O 3.522 -10.939 3.330 1.00 . A A . 8 GLN O 1 1
7 1392 1 1 8 GLN OE1 O -0.352 -8.192 4.958 1.00 . A A . 8 GLN OE1 1 1
7 1393 1 1 9 GLU C C 5.764 -11.827 1.891 1.00 . A A . 9 GLU C 1 1
7 1394 1 1 9 GLU CA C 5.135 -10.690 1.091 1.00 . A A . 9 GLU CA 1 1
7 1395 1 1 9 GLU CB C 6.128 -10.177 0.045 1.00 . A A . 9 GLU CB 1 1
7 1396 1 1 9 GLU CD C 7.507 -10.794 -1.979 1.00 . A A . 9 GLU CD 1 1
7 1397 1 1 9 GLU CG C 6.849 -11.285 -0.704 1.00 . A A . 9 GLU CG 1 1
7 1398 1 1 9 GLU H H 5.019 -8.691 1.778 1.00 . A A . 9 GLU H 1 1
7 1399 1 1 9 GLU HA H 4.257 -11.063 0.586 1.00 . A A . 9 GLU HA 1 1
7 1400 1 1 9 GLU HB2 H 5.596 -9.571 -0.673 1.00 . A A . 9 GLU HB2 1 1
7 1401 1 1 9 GLU HB3 H 6.868 -9.565 0.540 1.00 . A A . 9 GLU HB3 1 1
7 1402 1 1 9 GLU HG2 H 7.610 -11.701 -0.061 1.00 . A A . 9 GLU HG2 1 1
7 1403 1 1 9 GLU HG3 H 6.134 -12.054 -0.958 1.00 . A A . 9 GLU HG3 1 1
7 1404 1 1 9 GLU N N 4.718 -9.603 1.970 1.00 . A A . 9 GLU N 1 1
7 1405 1 1 9 GLU O O 5.522 -13.002 1.616 1.00 . A A . 9 GLU O 1 1
7 1406 1 1 9 GLU OE1 O 8.592 -10.182 -1.888 1.00 . A A . 9 GLU OE1 1 1
7 1407 1 1 9 GLU OE2 O 6.938 -11.021 -3.067 1.00 . A A . 9 GLU OE2 1 1
7 1408 1 1 10 LYS C C 6.388 -12.788 4.946 1.00 . A A . 10 LYS C 1 1
7 1409 1 1 10 LYS CA C 7.237 -12.456 3.724 1.00 . A A . 10 LYS CA 1 1
7 1410 1 1 10 LYS CB C 8.608 -11.940 4.166 1.00 . A A . 10 LYS CB 1 1
7 1411 1 1 10 LYS CD C 8.989 -9.474 4.456 1.00 . A A . 10 LYS CD 1 1
7 1412 1 1 10 LYS CE C 9.746 -8.581 5.427 1.00 . A A . 10 LYS CE 1 1
7 1413 1 1 10 LYS CG C 8.535 -10.762 5.122 1.00 . A A . 10 LYS CG 1 1
7 1414 1 1 10 LYS H H 6.726 -10.514 3.052 1.00 . A A . 10 LYS H 1 1
7 1415 1 1 10 LYS HA H 7.371 -13.353 3.139 1.00 . A A . 10 LYS HA 1 1
7 1416 1 1 10 LYS HB2 H 9.140 -12.742 4.657 1.00 . A A . 10 LYS HB2 1 1
7 1417 1 1 10 LYS HB3 H 9.163 -11.633 3.292 1.00 . A A . 10 LYS HB3 1 1
7 1418 1 1 10 LYS HD2 H 9.638 -9.717 3.627 1.00 . A A . 10 LYS HD2 1 1
7 1419 1 1 10 LYS HD3 H 8.121 -8.941 4.092 1.00 . A A . 10 LYS HD3 1 1
7 1420 1 1 10 LYS HE2 H 10.569 -9.141 5.844 1.00 . A A . 10 LYS HE2 1 1
7 1421 1 1 10 LYS HE3 H 10.129 -7.728 4.887 1.00 . A A . 10 LYS HE3 1 1
7 1422 1 1 10 LYS HG2 H 7.514 -10.642 5.454 1.00 . A A . 10 LYS HG2 1 1
7 1423 1 1 10 LYS HG3 H 9.171 -10.960 5.973 1.00 . A A . 10 LYS HG3 1 1
7 1424 1 1 10 LYS HZ1 H 9.158 -7.144 6.824 1.00 . A A . 10 LYS HZ1 1 1
7 1425 1 1 10 LYS HZ2 H 8.956 -8.738 7.354 1.00 . A A . 10 LYS HZ2 1 1
7 1426 1 1 10 LYS HZ3 H 7.882 -8.080 6.225 1.00 . A A . 10 LYS HZ3 1 1
7 1427 1 1 10 LYS N N 6.573 -11.468 2.882 1.00 . A A . 10 LYS N 1 1
7 1428 1 1 10 LYS NZ N 8.875 -8.102 6.535 1.00 . A A . 10 LYS NZ 1 1
7 1429 1 1 10 LYS O O 6.861 -13.422 5.890 1.00 . A A . 10 LYS O 1 1
7 1430 1 1 11 PHE C C 3.139 -13.611 5.627 1.00 . A A . 11 PHE C 1 1
7 1431 1 1 11 PHE CA C 4.216 -12.608 6.030 1.00 . A A . 11 PHE CA 1 1
7 1432 1 1 11 PHE CB C 3.566 -11.302 6.490 1.00 . A A . 11 PHE CB 1 1
7 1433 1 1 11 PHE CD1 C 5.824 -10.731 7.423 1.00 . A A . 11 PHE CD1 1 1
7 1434 1 1 11 PHE CD2 C 4.158 -9.026 7.365 1.00 . A A . 11 PHE CD2 1 1
7 1435 1 1 11 PHE CE1 C 6.719 -9.843 7.989 1.00 . A A . 11 PHE CE1 1 1
7 1436 1 1 11 PHE CE2 C 5.049 -8.133 7.930 1.00 . A A . 11 PHE CE2 1 1
7 1437 1 1 11 PHE CG C 4.535 -10.334 7.105 1.00 . A A . 11 PHE CG 1 1
7 1438 1 1 11 PHE CZ C 6.330 -8.542 8.244 1.00 . A A . 11 PHE CZ 1 1
7 1439 1 1 11 PHE H H 4.812 -11.856 4.143 1.00 . A A . 11 PHE H 1 1
7 1440 1 1 11 PHE HA H 4.789 -13.022 6.845 1.00 . A A . 11 PHE HA 1 1
7 1441 1 1 11 PHE HB2 H 3.108 -10.817 5.640 1.00 . A A . 11 PHE HB2 1 1
7 1442 1 1 11 PHE HB3 H 2.806 -11.525 7.224 1.00 . A A . 11 PHE HB3 1 1
7 1443 1 1 11 PHE HD1 H 6.129 -11.749 7.224 1.00 . A A . 11 PHE HD1 1 1
7 1444 1 1 11 PHE HD2 H 3.156 -8.705 7.121 1.00 . A A . 11 PHE HD2 1 1
7 1445 1 1 11 PHE HE1 H 7.720 -10.166 8.233 1.00 . A A . 11 PHE HE1 1 1
7 1446 1 1 11 PHE HE2 H 4.743 -7.117 8.128 1.00 . A A . 11 PHE HE2 1 1
7 1447 1 1 11 PHE HZ H 7.028 -7.846 8.685 1.00 . A A . 11 PHE HZ 1 1
7 1448 1 1 11 PHE N N 5.131 -12.356 4.923 1.00 . A A . 11 PHE N 1 1
7 1449 1 1 11 PHE O O 2.616 -14.347 6.463 1.00 . A A . 11 PHE O 1 1
7 1450 1 1 12 GLY C C 2.364 -15.914 3.510 1.00 . A A . 12 GLY C 1 1
7 1451 1 1 12 GLY CA C 1.798 -14.549 3.847 1.00 . A A . 12 GLY CA 1 1
7 1452 1 1 12 GLY H H 3.261 -13.024 3.717 1.00 . A A . 12 GLY H 1 1
7 1453 1 1 12 GLY HA2 H 1.034 -14.663 4.602 1.00 . A A . 12 GLY HA2 1 1
7 1454 1 1 12 GLY HA3 H 1.350 -14.128 2.958 1.00 . A A . 12 GLY HA3 1 1
7 1455 1 1 12 GLY N N 2.811 -13.634 4.339 1.00 . A A . 12 GLY N 1 1
7 1456 1 1 12 GLY O O 3.251 -16.414 4.202 1.00 . A A . 12 GLY O 1 1
8 1457 1 1 1 TRP C C 3.225 -0.875 -1.113 1.00 . A A . 1 TRP C 1 1
8 1458 1 1 1 TRP CA C 2.041 0.084 -1.156 1.00 . A A . 1 TRP CA 1 1
8 1459 1 1 1 TRP CB C 2.528 1.501 -1.462 1.00 . A A . 1 TRP CB 1 1
8 1460 1 1 1 TRP CD1 C 4.873 2.189 -0.687 1.00 . A A . 1 TRP CD1 1 1
8 1461 1 1 1 TRP CD2 C 3.286 2.403 0.878 1.00 . A A . 1 TRP CD2 1 1
8 1462 1 1 1 TRP CE2 C 4.517 2.811 1.428 1.00 . A A . 1 TRP CE2 1 1
8 1463 1 1 1 TRP CE3 C 2.142 2.453 1.679 1.00 . A A . 1 TRP CE3 1 1
8 1464 1 1 1 TRP CG C 3.535 2.010 -0.475 1.00 . A A . 1 TRP CG 1 1
8 1465 1 1 1 TRP CH2 C 3.498 3.297 3.502 1.00 . A A . 1 TRP CH2 1 1
8 1466 1 1 1 TRP CZ2 C 4.634 3.259 2.741 1.00 . A A . 1 TRP CZ2 1 1
8 1467 1 1 1 TRP CZ3 C 2.259 2.898 2.982 1.00 . A A . 1 TRP CZ3 1 1
8 1468 1 1 1 TRP H1 H 1.808 0.046 0.949 1.00 . A A . 1 TRP H1 1 1
8 1469 1 1 1 TRP HA H 1.365 -0.231 -1.936 1.00 . A A . 1 TRP HA 1 1
8 1470 1 1 1 TRP HB2 H 2.984 1.515 -2.441 1.00 . A A . 1 TRP HB2 1 1
8 1471 1 1 1 TRP HB3 H 1.683 2.174 -1.454 1.00 . A A . 1 TRP HB3 1 1
8 1472 1 1 1 TRP HD1 H 5.374 1.978 -1.619 1.00 . A A . 1 TRP HD1 1 1
8 1473 1 1 1 TRP HE1 H 6.422 2.879 0.552 1.00 . A A . 1 TRP HE1 1 1
8 1474 1 1 1 TRP HE3 H 1.178 2.149 1.297 1.00 . A A . 1 TRP HE3 1 1
8 1475 1 1 1 TRP HH2 H 3.543 3.638 4.525 1.00 . A A . 1 TRP HH2 1 1
8 1476 1 1 1 TRP HZ2 H 5.581 3.571 3.156 1.00 . A A . 1 TRP HZ2 1 1
8 1477 1 1 1 TRP HZ3 H 1.386 2.943 3.616 1.00 . A A . 1 TRP HZ3 1 1
8 1478 1 1 1 TRP N N 1.309 0.063 0.105 1.00 . A A . 1 TRP N 1 1
8 1479 1 1 1 TRP NE1 N 5.469 2.670 0.453 1.00 . A A . 1 TRP NE1 1 1
8 1480 1 1 1 TRP O O 3.150 -1.944 -0.506 1.00 . A A . 1 TRP O 1 1
8 1481 1 1 2 LYS C C 5.966 -1.686 -0.386 1.00 . A A . 2 LYS C 1 1
8 1482 1 1 2 LYS CA C 5.520 -1.313 -1.797 1.00 . A A . 2 LYS CA 1 1
8 1483 1 1 2 LYS CB C 6.649 -0.576 -2.522 1.00 . A A . 2 LYS CB 1 1
8 1484 1 1 2 LYS CD C 7.807 0.980 -0.926 1.00 . A A . 2 LYS CD 1 1
8 1485 1 1 2 LYS CE C 9.144 1.341 -0.297 1.00 . A A . 2 LYS CE 1 1
8 1486 1 1 2 LYS CG C 7.879 -0.349 -1.660 1.00 . A A . 2 LYS CG 1 1
8 1487 1 1 2 LYS H H 4.318 0.375 -2.227 1.00 . A A . 2 LYS H 1 1
8 1488 1 1 2 LYS HA H 5.286 -2.217 -2.338 1.00 . A A . 2 LYS HA 1 1
8 1489 1 1 2 LYS HB2 H 6.942 -1.153 -3.386 1.00 . A A . 2 LYS HB2 1 1
8 1490 1 1 2 LYS HB3 H 6.282 0.386 -2.850 1.00 . A A . 2 LYS HB3 1 1
8 1491 1 1 2 LYS HD2 H 7.531 1.754 -1.626 1.00 . A A . 2 LYS HD2 1 1
8 1492 1 1 2 LYS HD3 H 7.060 0.912 -0.148 1.00 . A A . 2 LYS HD3 1 1
8 1493 1 1 2 LYS HE2 H 9.923 1.200 -1.031 1.00 . A A . 2 LYS HE2 1 1
8 1494 1 1 2 LYS HE3 H 9.117 2.378 0.004 1.00 . A A . 2 LYS HE3 1 1
8 1495 1 1 2 LYS HG2 H 7.951 -1.145 -0.934 1.00 . A A . 2 LYS HG2 1 1
8 1496 1 1 2 LYS HG3 H 8.756 -0.354 -2.292 1.00 . A A . 2 LYS HG3 1 1
8 1497 1 1 2 LYS HZ1 H 10.084 -0.276 0.633 1.00 . A A . 2 LYS HZ1 1 1
8 1498 1 1 2 LYS HZ2 H 8.563 0.094 1.275 1.00 . A A . 2 LYS HZ2 1 1
8 1499 1 1 2 LYS HZ3 H 9.894 1.074 1.634 1.00 . A A . 2 LYS HZ3 1 1
8 1500 1 1 2 LYS N N 4.319 -0.488 -1.761 1.00 . A A . 2 LYS N 1 1
8 1501 1 1 2 LYS NZ N 9.442 0.499 0.895 1.00 . A A . 2 LYS NZ 1 1
8 1502 1 1 2 LYS O O 6.476 -2.783 -0.155 1.00 . A A . 2 LYS O 1 1
8 1503 1 1 3 LEU C C 5.183 -1.965 2.618 1.00 . A A . 3 LEU C 1 1
8 1504 1 1 3 LEU CA C 6.151 -1.000 1.942 1.00 . A A . 3 LEU CA 1 1
8 1505 1 1 3 LEU CB C 6.189 0.323 2.710 1.00 . A A . 3 LEU CB 1 1
8 1506 1 1 3 LEU CD1 C 5.385 -0.119 5.042 1.00 . A A . 3 LEU CD1 1 1
8 1507 1 1 3 LEU CD2 C 7.699 -0.791 4.373 1.00 . A A . 3 LEU CD2 1 1
8 1508 1 1 3 LEU CG C 6.589 0.233 4.183 1.00 . A A . 3 LEU CG 1 1
8 1509 1 1 3 LEU H H 5.361 0.088 0.308 1.00 . A A . 3 LEU H 1 1
8 1510 1 1 3 LEU HA H 7.139 -1.438 1.946 1.00 . A A . 3 LEU HA 1 1
8 1511 1 1 3 LEU HB2 H 6.895 0.972 2.215 1.00 . A A . 3 LEU HB2 1 1
8 1512 1 1 3 LEU HB3 H 5.203 0.762 2.659 1.00 . A A . 3 LEU HB3 1 1
8 1513 1 1 3 LEU HD11 H 5.491 -1.125 5.417 1.00 . A A . 3 LEU HD11 1 1
8 1514 1 1 3 LEU HD12 H 4.486 -0.050 4.447 1.00 . A A . 3 LEU HD12 1 1
8 1515 1 1 3 LEU HD13 H 5.321 0.571 5.871 1.00 . A A . 3 LEU HD13 1 1
8 1516 1 1 3 LEU HD21 H 7.417 -1.719 3.898 1.00 . A A . 3 LEU HD21 1 1
8 1517 1 1 3 LEU HD22 H 7.856 -0.959 5.428 1.00 . A A . 3 LEU HD22 1 1
8 1518 1 1 3 LEU HD23 H 8.611 -0.420 3.927 1.00 . A A . 3 LEU HD23 1 1
8 1519 1 1 3 LEU HG H 6.961 1.194 4.508 1.00 . A A . 3 LEU HG 1 1
8 1520 1 1 3 LEU N N 5.771 -0.767 0.553 1.00 . A A . 3 LEU N 1 1
8 1521 1 1 3 LEU O O 5.489 -2.538 3.665 1.00 . A A . 3 LEU O 1 1
8 1522 1 1 4 LEU C C 3.083 -4.416 1.894 1.00 . A A . 4 LEU C 1 1
8 1523 1 1 4 LEU CA C 3.001 -3.043 2.553 1.00 . A A . 4 LEU CA 1 1
8 1524 1 1 4 LEU CB C 1.605 -2.450 2.351 1.00 . A A . 4 LEU CB 1 1
8 1525 1 1 4 LEU CD1 C 1.168 -2.165 4.803 1.00 . A A . 4 LEU CD1 1 1
8 1526 1 1 4 LEU CD2 C 1.951 -0.219 3.440 1.00 . A A . 4 LEU CD2 1 1
8 1527 1 1 4 LEU CG C 1.119 -1.493 3.439 1.00 . A A . 4 LEU CG 1 1
8 1528 1 1 4 LEU H H 3.828 -1.661 1.180 1.00 . A A . 4 LEU H 1 1
8 1529 1 1 4 LEU HA H 3.187 -3.153 3.611 1.00 . A A . 4 LEU HA 1 1
8 1530 1 1 4 LEU HB2 H 1.607 -1.913 1.415 1.00 . A A . 4 LEU HB2 1 1
8 1531 1 1 4 LEU HB3 H 0.904 -3.270 2.292 1.00 . A A . 4 LEU HB3 1 1
8 1532 1 1 4 LEU HD11 H 1.542 -3.172 4.694 1.00 . A A . 4 LEU HD11 1 1
8 1533 1 1 4 LEU HD12 H 0.176 -2.193 5.227 1.00 . A A . 4 LEU HD12 1 1
8 1534 1 1 4 LEU HD13 H 1.823 -1.607 5.456 1.00 . A A . 4 LEU HD13 1 1
8 1535 1 1 4 LEU HD21 H 2.498 -0.147 4.368 1.00 . A A . 4 LEU HD21 1 1
8 1536 1 1 4 LEU HD22 H 1.299 0.636 3.340 1.00 . A A . 4 LEU HD22 1 1
8 1537 1 1 4 LEU HD23 H 2.645 -0.242 2.613 1.00 . A A . 4 LEU HD23 1 1
8 1538 1 1 4 LEU HG H 0.091 -1.222 3.239 1.00 . A A . 4 LEU HG 1 1
8 1539 1 1 4 LEU N N 4.015 -2.144 2.011 1.00 . A A . 4 LEU N 1 1
8 1540 1 1 4 LEU O O 2.835 -5.438 2.533 1.00 . A A . 4 LEU O 1 1
8 1541 1 1 5 SER C C 4.889 -6.354 0.136 1.00 . A A . 5 SER C 1 1
8 1542 1 1 5 SER CA C 3.548 -5.679 -0.134 1.00 . A A . 5 SER CA 1 1
8 1543 1 1 5 SER CB C 3.389 -5.418 -1.633 1.00 . A A . 5 SER CB 1 1
8 1544 1 1 5 SER H H 3.619 -3.583 0.157 1.00 . A A . 5 SER H 1 1
8 1545 1 1 5 SER HA H 2.755 -6.335 0.194 1.00 . A A . 5 SER HA 1 1
8 1546 1 1 5 SER HB2 H 4.252 -4.880 -1.996 1.00 . A A . 5 SER HB2 1 1
8 1547 1 1 5 SER HB3 H 3.308 -6.361 -2.154 1.00 . A A . 5 SER HB3 1 1
8 1548 1 1 5 SER HG H 2.350 -4.152 -2.709 1.00 . A A . 5 SER HG 1 1
8 1549 1 1 5 SER N N 3.434 -4.432 0.612 1.00 . A A . 5 SER N 1 1
8 1550 1 1 5 SER O O 4.976 -7.580 0.216 1.00 . A A . 5 SER O 1 1
8 1551 1 1 5 SER OG O 2.228 -4.649 -1.897 1.00 . A A . 5 SER OG 1 1
8 1552 1 1 6 LYS C C 7.358 -6.659 1.942 1.00 . A A . 6 LYS C 1 1
8 1553 1 1 6 LYS CA C 7.271 -6.061 0.541 1.00 . A A . 6 LYS CA 1 1
8 1554 1 1 6 LYS CB C 8.310 -4.948 0.385 1.00 . A A . 6 LYS CB 1 1
8 1555 1 1 6 LYS CD C 9.238 -2.794 1.283 1.00 . A A . 6 LYS CD 1 1
8 1556 1 1 6 LYS CE C 10.703 -3.162 1.102 1.00 . A A . 6 LYS CE 1 1
8 1557 1 1 6 LYS CG C 8.389 -4.018 1.583 1.00 . A A . 6 LYS CG 1 1
8 1558 1 1 6 LYS H H 5.801 -4.576 0.204 1.00 . A A . 6 LYS H 1 1
8 1559 1 1 6 LYS HA H 7.476 -6.837 -0.181 1.00 . A A . 6 LYS HA 1 1
8 1560 1 1 6 LYS HB2 H 9.281 -5.396 0.238 1.00 . A A . 6 LYS HB2 1 1
8 1561 1 1 6 LYS HB3 H 8.060 -4.359 -0.486 1.00 . A A . 6 LYS HB3 1 1
8 1562 1 1 6 LYS HD2 H 8.881 -2.331 0.375 1.00 . A A . 6 LYS HD2 1 1
8 1563 1 1 6 LYS HD3 H 9.150 -2.095 2.103 1.00 . A A . 6 LYS HD3 1 1
8 1564 1 1 6 LYS HE2 H 10.814 -4.225 1.250 1.00 . A A . 6 LYS HE2 1 1
8 1565 1 1 6 LYS HE3 H 11.004 -2.905 0.097 1.00 . A A . 6 LYS HE3 1 1
8 1566 1 1 6 LYS HG2 H 7.392 -3.695 1.844 1.00 . A A . 6 LYS HG2 1 1
8 1567 1 1 6 LYS HG3 H 8.826 -4.553 2.414 1.00 . A A . 6 LYS HG3 1 1
8 1568 1 1 6 LYS HZ1 H 12.569 -2.485 1.753 1.00 . A A . 6 LYS HZ1 1 1
8 1569 1 1 6 LYS HZ2 H 11.507 -2.882 3.009 1.00 . A A . 6 LYS HZ2 1 1
8 1570 1 1 6 LYS HZ3 H 11.290 -1.448 2.141 1.00 . A A . 6 LYS HZ3 1 1
8 1571 1 1 6 LYS N N 5.933 -5.545 0.278 1.00 . A A . 6 LYS N 1 1
8 1572 1 1 6 LYS NZ N 11.579 -2.444 2.069 1.00 . A A . 6 LYS NZ 1 1
8 1573 1 1 6 LYS O O 8.063 -7.643 2.164 1.00 . A A . 6 LYS O 1 1
8 1574 1 1 7 ALA C C 5.627 -7.668 4.445 1.00 . A A . 7 ALA C 1 1
8 1575 1 1 7 ALA CA C 6.629 -6.533 4.260 1.00 . A A . 7 ALA CA 1 1
8 1576 1 1 7 ALA CB C 6.315 -5.389 5.212 1.00 . A A . 7 ALA CB 1 1
8 1577 1 1 7 ALA H H 6.094 -5.278 2.643 1.00 . A A . 7 ALA H 1 1
8 1578 1 1 7 ALA HA H 7.619 -6.900 4.492 1.00 . A A . 7 ALA HA 1 1
8 1579 1 1 7 ALA HB1 H 5.616 -5.728 5.963 1.00 . A A . 7 ALA HB1 1 1
8 1580 1 1 7 ALA HB2 H 7.225 -5.057 5.689 1.00 . A A . 7 ALA HB2 1 1
8 1581 1 1 7 ALA HB3 H 5.880 -4.570 4.658 1.00 . A A . 7 ALA HB3 1 1
8 1582 1 1 7 ALA N N 6.636 -6.058 2.882 1.00 . A A . 7 ALA N 1 1
8 1583 1 1 7 ALA O O 5.875 -8.610 5.197 1.00 . A A . 7 ALA O 1 1
8 1584 1 1 8 GLN C C 3.834 -9.825 3.037 1.00 . A A . 8 GLN C 1 1
8 1585 1 1 8 GLN CA C 3.456 -8.588 3.844 1.00 . A A . 8 GLN CA 1 1
8 1586 1 1 8 GLN CB C 2.121 -8.029 3.348 1.00 . A A . 8 GLN CB 1 1
8 1587 1 1 8 GLN CD C -0.334 -8.524 3.682 1.00 . A A . 8 GLN CD 1 1
8 1588 1 1 8 GLN CG C 1.018 -9.071 3.267 1.00 . A A . 8 GLN CG 1 1
8 1589 1 1 8 GLN H H 4.357 -6.795 3.171 1.00 . A A . 8 GLN H 1 1
8 1590 1 1 8 GLN HA H 3.355 -8.867 4.882 1.00 . A A . 8 GLN HA 1 1
8 1591 1 1 8 GLN HB2 H 1.800 -7.247 4.019 1.00 . A A . 8 GLN HB2 1 1
8 1592 1 1 8 GLN HB3 H 2.264 -7.610 2.362 1.00 . A A . 8 GLN HB3 1 1
8 1593 1 1 8 GLN HE21 H -1.070 -8.903 1.874 1.00 . A A . 8 GLN HE21 1 1
8 1594 1 1 8 GLN HE22 H -2.172 -8.194 3.000 1.00 . A A . 8 GLN HE22 1 1
8 1595 1 1 8 GLN HG2 H 0.948 -9.425 2.249 1.00 . A A . 8 GLN HG2 1 1
8 1596 1 1 8 GLN HG3 H 1.271 -9.896 3.917 1.00 . A A . 8 GLN HG3 1 1
8 1597 1 1 8 GLN N N 4.496 -7.570 3.754 1.00 . A A . 8 GLN N 1 1
8 1598 1 1 8 GLN NE2 N -1.288 -8.541 2.759 1.00 . A A . 8 GLN NE2 1 1
8 1599 1 1 8 GLN O O 3.459 -10.944 3.386 1.00 . A A . 8 GLN O 1 1
8 1600 1 1 8 GLN OE1 O -0.518 -8.090 4.819 1.00 . A A . 8 GLN OE1 1 1
8 1601 1 1 9 GLU C C 5.686 -11.810 1.916 1.00 . A A . 9 GLU C 1 1
8 1602 1 1 9 GLU CA C 5.006 -10.715 1.098 1.00 . A A . 9 GLU CA 1 1
8 1603 1 1 9 GLU CB C 5.960 -10.206 0.015 1.00 . A A . 9 GLU CB 1 1
8 1604 1 1 9 GLU CD C 7.077 -10.902 -2.140 1.00 . A A . 9 GLU CD 1 1
8 1605 1 1 9 GLU CG C 6.673 -11.315 -0.739 1.00 . A A . 9 GLU CG 1 1
8 1606 1 1 9 GLU H H 4.847 -8.700 1.729 1.00 . A A . 9 GLU H 1 1
8 1607 1 1 9 GLU HA H 4.128 -11.128 0.626 1.00 . A A . 9 GLU HA 1 1
8 1608 1 1 9 GLU HB2 H 5.397 -9.619 -0.696 1.00 . A A . 9 GLU HB2 1 1
8 1609 1 1 9 GLU HB3 H 6.706 -9.576 0.477 1.00 . A A . 9 GLU HB3 1 1
8 1610 1 1 9 GLU HG2 H 7.562 -11.592 -0.191 1.00 . A A . 9 GLU HG2 1 1
8 1611 1 1 9 GLU HG3 H 6.014 -12.168 -0.806 1.00 . A A . 9 GLU HG3 1 1
8 1612 1 1 9 GLU N N 4.579 -9.615 1.956 1.00 . A A . 9 GLU N 1 1
8 1613 1 1 9 GLU O O 5.469 -12.999 1.684 1.00 . A A . 9 GLU O 1 1
8 1614 1 1 9 GLU OE1 O 6.189 -10.830 -3.016 1.00 . A A . 9 GLU OE1 1 1
8 1615 1 1 9 GLU OE2 O 8.280 -10.650 -2.362 1.00 . A A . 9 GLU OE2 1 1
8 1616 1 1 10 LYS C C 6.437 -12.619 5.006 1.00 . A A . 10 LYS C 1 1
8 1617 1 1 10 LYS CA C 7.222 -12.343 3.728 1.00 . A A . 10 LYS CA 1 1
8 1618 1 1 10 LYS CB C 8.610 -11.800 4.076 1.00 . A A . 10 LYS CB 1 1
8 1619 1 1 10 LYS CD C 9.013 -10.482 6.176 1.00 . A A . 10 LYS CD 1 1
8 1620 1 1 10 LYS CE C 10.465 -10.917 6.310 1.00 . A A . 10 LYS CE 1 1
8 1621 1 1 10 LYS CG C 8.582 -10.425 4.720 1.00 . A A . 10 LYS CG 1 1
8 1622 1 1 10 LYS H H 6.642 -10.437 3.011 1.00 . A A . 10 LYS H 1 1
8 1623 1 1 10 LYS HA H 7.333 -13.267 3.181 1.00 . A A . 10 LYS HA 1 1
8 1624 1 1 10 LYS HB2 H 9.090 -12.485 4.759 1.00 . A A . 10 LYS HB2 1 1
8 1625 1 1 10 LYS HB3 H 9.197 -11.738 3.170 1.00 . A A . 10 LYS HB3 1 1
8 1626 1 1 10 LYS HD2 H 8.901 -9.502 6.614 1.00 . A A . 10 LYS HD2 1 1
8 1627 1 1 10 LYS HD3 H 8.385 -11.187 6.701 1.00 . A A . 10 LYS HD3 1 1
8 1628 1 1 10 LYS HE2 H 10.535 -11.967 6.072 1.00 . A A . 10 LYS HE2 1 1
8 1629 1 1 10 LYS HE3 H 11.063 -10.349 5.613 1.00 . A A . 10 LYS HE3 1 1
8 1630 1 1 10 LYS HG2 H 9.253 -9.771 4.182 1.00 . A A . 10 LYS HG2 1 1
8 1631 1 1 10 LYS HG3 H 7.576 -10.033 4.667 1.00 . A A . 10 LYS HG3 1 1
8 1632 1 1 10 LYS HZ1 H 10.724 -9.745 8.020 1.00 . A A . 10 LYS HZ1 1 1
8 1633 1 1 10 LYS HZ2 H 12.021 -10.783 7.696 1.00 . A A . 10 LYS HZ2 1 1
8 1634 1 1 10 LYS HZ3 H 10.584 -11.401 8.338 1.00 . A A . 10 LYS HZ3 1 1
8 1635 1 1 10 LYS N N 6.510 -11.399 2.874 1.00 . A A . 10 LYS N 1 1
8 1636 1 1 10 LYS NZ N 10.985 -10.696 7.688 1.00 . A A . 10 LYS NZ 1 1
8 1637 1 1 10 LYS O O 6.980 -13.146 5.977 1.00 . A A . 10 LYS O 1 1
8 1638 1 1 11 PHE C C 3.282 -13.575 5.888 1.00 . A A . 11 PHE C 1 1
8 1639 1 1 11 PHE CA C 4.299 -12.470 6.158 1.00 . A A . 11 PHE CA 1 1
8 1640 1 1 11 PHE CB C 3.574 -11.172 6.524 1.00 . A A . 11 PHE CB 1 1
8 1641 1 1 11 PHE CD1 C 5.790 -10.436 7.444 1.00 . A A . 11 PHE CD1 1 1
8 1642 1 1 11 PHE CD2 C 4.003 -8.858 7.393 1.00 . A A . 11 PHE CD2 1 1
8 1643 1 1 11 PHE CE1 C 6.619 -9.483 8.005 1.00 . A A . 11 PHE CE1 1 1
8 1644 1 1 11 PHE CE2 C 4.827 -7.901 7.954 1.00 . A A . 11 PHE CE2 1 1
8 1645 1 1 11 PHE CG C 4.473 -10.135 7.133 1.00 . A A . 11 PHE CG 1 1
8 1646 1 1 11 PHE CZ C 6.138 -8.214 8.259 1.00 . A A . 11 PHE CZ 1 1
8 1647 1 1 11 PHE H H 4.783 -11.843 4.195 1.00 . A A . 11 PHE H 1 1
8 1648 1 1 11 PHE HA H 4.925 -12.767 6.985 1.00 . A A . 11 PHE HA 1 1
8 1649 1 1 11 PHE HB2 H 3.136 -10.749 5.633 1.00 . A A . 11 PHE HB2 1 1
8 1650 1 1 11 PHE HB3 H 2.792 -11.394 7.234 1.00 . A A . 11 PHE HB3 1 1
8 1651 1 1 11 PHE HD1 H 6.168 -11.428 7.244 1.00 . A A . 11 PHE HD1 1 1
8 1652 1 1 11 PHE HD2 H 2.977 -8.612 7.155 1.00 . A A . 11 PHE HD2 1 1
8 1653 1 1 11 PHE HE1 H 7.643 -9.730 8.242 1.00 . A A . 11 PHE HE1 1 1
8 1654 1 1 11 PHE HE2 H 4.448 -6.909 8.151 1.00 . A A . 11 PHE HE2 1 1
8 1655 1 1 11 PHE HZ H 6.783 -7.468 8.697 1.00 . A A . 11 PHE HZ 1 1
8 1656 1 1 11 PHE N N 5.158 -12.260 4.999 1.00 . A A . 11 PHE N 1 1
8 1657 1 1 11 PHE O O 2.884 -14.302 6.797 1.00 . A A . 11 PHE O 1 1
8 1658 1 1 12 GLY C C 2.476 -16.110 4.325 1.00 . A A . 12 GLY C 1 1
8 1659 1 1 12 GLY CA C 1.897 -14.711 4.264 1.00 . A A . 12 GLY CA 1 1
8 1660 1 1 12 GLY H H 3.216 -13.085 3.948 1.00 . A A . 12 GLY H 1 1
8 1661 1 1 12 GLY HA2 H 1.055 -14.651 4.936 1.00 . A A . 12 GLY HA2 1 1
8 1662 1 1 12 GLY HA3 H 1.555 -14.519 3.257 1.00 . A A . 12 GLY HA3 1 1
8 1663 1 1 12 GLY N N 2.864 -13.693 4.631 1.00 . A A . 12 GLY N 1 1
8 1664 1 1 12 GLY O O 2.269 -16.915 3.417 1.00 . A A . 12 GLY O 1 1
9 1665 1 1 1 TRP C C 3.043 -0.782 -1.108 1.00 . A A . 1 TRP C 1 1
9 1666 1 1 1 TRP CA C 1.839 0.153 -1.124 1.00 . A A . 1 TRP CA 1 1
9 1667 1 1 1 TRP CB C 2.285 1.575 -1.466 1.00 . A A . 1 TRP CB 1 1
9 1668 1 1 1 TRP CD1 C 4.637 2.328 -0.780 1.00 . A A . 1 TRP CD1 1 1
9 1669 1 1 1 TRP CD2 C 3.099 2.521 0.837 1.00 . A A . 1 TRP CD2 1 1
9 1670 1 1 1 TRP CE2 C 4.338 2.964 1.340 1.00 . A A . 1 TRP CE2 1 1
9 1671 1 1 1 TRP CE3 C 1.982 2.552 1.676 1.00 . A A . 1 TRP CE3 1 1
9 1672 1 1 1 TRP CG C 3.312 2.119 -0.520 1.00 . A A . 1 TRP CG 1 1
9 1673 1 1 1 TRP CH2 C 3.378 3.450 3.443 1.00 . A A . 1 TRP CH2 1 1
9 1674 1 1 1 TRP CZ2 C 4.489 3.431 2.643 1.00 . A A . 1 TRP CZ2 1 1
9 1675 1 1 1 TRP CZ3 C 2.133 3.015 2.970 1.00 . A A . 1 TRP CZ3 1 1
9 1676 1 1 1 TRP H1 H 1.676 0.127 0.987 1.00 . A A . 1 TRP H1 1 1
9 1677 1 1 1 TRP HA H 1.143 -0.188 -1.877 1.00 . A A . 1 TRP HA 1 1
9 1678 1 1 1 TRP HB2 H 2.709 1.583 -2.459 1.00 . A A . 1 TRP HB2 1 1
9 1679 1 1 1 TRP HB3 H 1.427 2.230 -1.440 1.00 . A A . 1 TRP HB3 1 1
9 1680 1 1 1 TRP HD1 H 5.111 2.118 -1.726 1.00 . A A . 1 TRP HD1 1 1
9 1681 1 1 1 TRP HE1 H 6.210 3.069 0.398 1.00 . A A . 1 TRP HE1 1 1
9 1682 1 1 1 TRP HE3 H 1.014 2.221 1.330 1.00 . A A . 1 TRP HE3 1 1
9 1683 1 1 1 TRP HH2 H 3.450 3.803 4.460 1.00 . A A . 1 TRP HH2 1 1
9 1684 1 1 1 TRP HZ2 H 5.442 3.770 3.022 1.00 . A A . 1 TRP HZ2 1 1
9 1685 1 1 1 TRP HZ3 H 1.281 3.046 3.633 1.00 . A A . 1 TRP HZ3 1 1
9 1686 1 1 1 TRP N N 1.149 0.135 0.161 1.00 . A A . 1 TRP N 1 1
9 1687 1 1 1 TRP NE1 N 5.260 2.836 0.335 1.00 . A A . 1 TRP NE1 1 1
9 1688 1 1 1 TRP O O 3.009 -1.845 -0.487 1.00 . A A . 1 TRP O 1 1
9 1689 1 1 2 LYS C C 5.824 -1.523 -0.458 1.00 . A A . 2 LYS C 1 1
9 1690 1 1 2 LYS CA C 5.325 -1.181 -1.857 1.00 . A A . 2 LYS CA 1 1
9 1691 1 1 2 LYS CB C 6.413 -0.432 -2.630 1.00 . A A . 2 LYS CB 1 1
9 1692 1 1 2 LYS CD C 7.847 0.781 -0.962 1.00 . A A . 2 LYS CD 1 1
9 1693 1 1 2 LYS CE C 8.542 1.968 -1.611 1.00 . A A . 2 LYS CE 1 1
9 1694 1 1 2 LYS CG C 7.753 -0.398 -1.915 1.00 . A A . 2 LYS CG 1 1
9 1695 1 1 2 LYS H H 4.074 0.477 -2.269 1.00 . A A . 2 LYS H 1 1
9 1696 1 1 2 LYS HA H 5.092 -2.097 -2.378 1.00 . A A . 2 LYS HA 1 1
9 1697 1 1 2 LYS HB2 H 6.551 -0.910 -3.588 1.00 . A A . 2 LYS HB2 1 1
9 1698 1 1 2 LYS HB3 H 6.088 0.587 -2.789 1.00 . A A . 2 LYS HB3 1 1
9 1699 1 1 2 LYS HD2 H 6.851 1.078 -0.670 1.00 . A A . 2 LYS HD2 1 1
9 1700 1 1 2 LYS HD3 H 8.407 0.482 -0.087 1.00 . A A . 2 LYS HD3 1 1
9 1701 1 1 2 LYS HE2 H 8.093 2.148 -2.576 1.00 . A A . 2 LYS HE2 1 1
9 1702 1 1 2 LYS HE3 H 8.406 2.836 -0.983 1.00 . A A . 2 LYS HE3 1 1
9 1703 1 1 2 LYS HG2 H 7.873 -1.312 -1.353 1.00 . A A . 2 LYS HG2 1 1
9 1704 1 1 2 LYS HG3 H 8.541 -0.320 -2.651 1.00 . A A . 2 LYS HG3 1 1
9 1705 1 1 2 LYS HZ1 H 10.374 1.177 -0.992 1.00 . A A . 2 LYS HZ1 1 1
9 1706 1 1 2 LYS HZ2 H 10.509 2.631 -1.846 1.00 . A A . 2 LYS HZ2 1 1
9 1707 1 1 2 LYS HZ3 H 10.168 1.195 -2.671 1.00 . A A . 2 LYS HZ3 1 1
9 1708 1 1 2 LYS N N 4.108 -0.380 -1.794 1.00 . A A . 2 LYS N 1 1
9 1709 1 1 2 LYS NZ N 10.000 1.725 -1.793 1.00 . A A . 2 LYS NZ 1 1
9 1710 1 1 2 LYS O O 6.362 -2.607 -0.227 1.00 . A A . 2 LYS O 1 1
9 1711 1 1 3 LEU C C 5.139 -1.762 2.578 1.00 . A A . 3 LEU C 1 1
9 1712 1 1 3 LEU CA C 6.073 -0.799 1.853 1.00 . A A . 3 LEU CA 1 1
9 1713 1 1 3 LEU CB C 6.123 0.537 2.596 1.00 . A A . 3 LEU CB 1 1
9 1714 1 1 3 LEU CD1 C 5.431 0.145 4.973 1.00 . A A . 3 LEU CD1 1 1
9 1715 1 1 3 LEU CD2 C 7.712 -0.538 4.209 1.00 . A A . 3 LEU CD2 1 1
9 1716 1 1 3 LEU CG C 6.592 0.480 4.050 1.00 . A A . 3 LEU CG 1 1
9 1717 1 1 3 LEU H H 5.208 0.249 0.231 1.00 . A A . 3 LEU H 1 1
9 1718 1 1 3 LEU HA H 7.065 -1.226 1.830 1.00 . A A . 3 LEU HA 1 1
9 1719 1 1 3 LEU HB2 H 6.793 1.190 2.058 1.00 . A A . 3 LEU HB2 1 1
9 1720 1 1 3 LEU HB3 H 5.128 0.958 2.585 1.00 . A A . 3 LEU HB3 1 1
9 1721 1 1 3 LEU HD11 H 5.573 -0.841 5.388 1.00 . A A . 3 LEU HD11 1 1
9 1722 1 1 3 LEU HD12 H 4.508 0.170 4.413 1.00 . A A . 3 LEU HD12 1 1
9 1723 1 1 3 LEU HD13 H 5.386 0.870 5.773 1.00 . A A . 3 LEU HD13 1 1
9 1724 1 1 3 LEU HD21 H 7.407 -1.479 3.777 1.00 . A A . 3 LEU HD21 1 1
9 1725 1 1 3 LEU HD22 H 7.927 -0.676 5.259 1.00 . A A . 3 LEU HD22 1 1
9 1726 1 1 3 LEU HD23 H 8.598 -0.180 3.705 1.00 . A A . 3 LEU HD23 1 1
9 1727 1 1 3 LEU HG H 6.977 1.449 4.336 1.00 . A A . 3 LEU HG 1 1
9 1728 1 1 3 LEU N N 5.642 -0.594 0.474 1.00 . A A . 3 LEU N 1 1
9 1729 1 1 3 LEU O O 5.465 -2.269 3.653 1.00 . A A . 3 LEU O 1 1
9 1730 1 1 4 LEU C C 3.078 -4.300 1.929 1.00 . A A . 4 LEU C 1 1
9 1731 1 1 4 LEU CA C 2.998 -2.919 2.571 1.00 . A A . 4 LEU CA 1 1
9 1732 1 1 4 LEU CB C 1.587 -2.350 2.409 1.00 . A A . 4 LEU CB 1 1
9 1733 1 1 4 LEU CD1 C 1.212 -2.062 4.871 1.00 . A A . 4 LEU CD1 1 1
9 1734 1 1 4 LEU CD2 C 1.936 -0.111 3.483 1.00 . A A . 4 LEU CD2 1 1
9 1735 1 1 4 LEU CG C 1.119 -1.395 3.508 1.00 . A A . 4 LEU CG 1 1
9 1736 1 1 4 LEU H H 3.776 -1.581 1.128 1.00 . A A . 4 LEU H 1 1
9 1737 1 1 4 LEU HA H 3.221 -3.012 3.624 1.00 . A A . 4 LEU HA 1 1
9 1738 1 1 4 LEU HB2 H 1.552 -1.817 1.471 1.00 . A A . 4 LEU HB2 1 1
9 1739 1 1 4 LEU HB3 H 0.898 -3.181 2.376 1.00 . A A . 4 LEU HB3 1 1
9 1740 1 1 4 LEU HD11 H 1.616 -3.057 4.758 1.00 . A A . 4 LEU HD11 1 1
9 1741 1 1 4 LEU HD12 H 0.228 -2.121 5.311 1.00 . A A . 4 LEU HD12 1 1
9 1742 1 1 4 LEU HD13 H 1.859 -1.481 5.512 1.00 . A A . 4 LEU HD13 1 1
9 1743 1 1 4 LEU HD21 H 2.528 -0.044 4.383 1.00 . A A . 4 LEU HD21 1 1
9 1744 1 1 4 LEU HD22 H 1.270 0.738 3.425 1.00 . A A . 4 LEU HD22 1 1
9 1745 1 1 4 LEU HD23 H 2.588 -0.117 2.621 1.00 . A A . 4 LEU HD23 1 1
9 1746 1 1 4 LEU HG H 0.083 -1.136 3.334 1.00 . A A . 4 LEU HG 1 1
9 1747 1 1 4 LEU N N 3.979 -2.014 1.983 1.00 . A A . 4 LEU N 1 1
9 1748 1 1 4 LEU O O 2.879 -5.317 2.593 1.00 . A A . 4 LEU O 1 1
9 1749 1 1 5 SER C C 4.840 -6.232 0.123 1.00 . A A . 5 SER C 1 1
9 1750 1 1 5 SER CA C 3.477 -5.585 -0.100 1.00 . A A . 5 SER CA 1 1
9 1751 1 1 5 SER CB C 3.250 -5.348 -1.595 1.00 . A A . 5 SER CB 1 1
9 1752 1 1 5 SER H H 3.519 -3.484 0.158 1.00 . A A . 5 SER H 1 1
9 1753 1 1 5 SER HA H 2.711 -6.250 0.270 1.00 . A A . 5 SER HA 1 1
9 1754 1 1 5 SER HB2 H 4.077 -4.782 -1.996 1.00 . A A . 5 SER HB2 1 1
9 1755 1 1 5 SER HB3 H 3.186 -6.300 -2.101 1.00 . A A . 5 SER HB3 1 1
9 1756 1 1 5 SER HG H 1.394 -5.213 -2.205 1.00 . A A . 5 SER HG 1 1
9 1757 1 1 5 SER N N 3.372 -4.328 0.633 1.00 . A A . 5 SER N 1 1
9 1758 1 1 5 SER O O 4.960 -7.456 0.164 1.00 . A A . 5 SER O 1 1
9 1759 1 1 5 SER OG O 2.051 -4.628 -1.821 1.00 . A A . 5 SER OG 1 1
9 1760 1 1 6 LYS C C 7.347 -6.549 1.857 1.00 . A A . 6 LYS C 1 1
9 1761 1 1 6 LYS CA C 7.222 -5.888 0.488 1.00 . A A . 6 LYS CA 1 1
9 1762 1 1 6 LYS CB C 8.225 -4.738 0.372 1.00 . A A . 6 LYS CB 1 1
9 1763 1 1 6 LYS CD C 9.771 -4.294 2.302 1.00 . A A . 6 LYS CD 1 1
9 1764 1 1 6 LYS CE C 10.391 -5.184 3.368 1.00 . A A . 6 LYS CE 1 1
9 1765 1 1 6 LYS CG C 9.576 -5.044 0.995 1.00 . A A . 6 LYS CG 1 1
9 1766 1 1 6 LYS H H 5.707 -4.433 0.225 1.00 . A A . 6 LYS H 1 1
9 1767 1 1 6 LYS HA H 7.439 -6.621 -0.274 1.00 . A A . 6 LYS HA 1 1
9 1768 1 1 6 LYS HB2 H 8.377 -4.512 -0.673 1.00 . A A . 6 LYS HB2 1 1
9 1769 1 1 6 LYS HB3 H 7.815 -3.867 0.864 1.00 . A A . 6 LYS HB3 1 1
9 1770 1 1 6 LYS HD2 H 10.423 -3.451 2.129 1.00 . A A . 6 LYS HD2 1 1
9 1771 1 1 6 LYS HD3 H 8.810 -3.943 2.652 1.00 . A A . 6 LYS HD3 1 1
9 1772 1 1 6 LYS HE2 H 9.631 -5.439 4.091 1.00 . A A . 6 LYS HE2 1 1
9 1773 1 1 6 LYS HE3 H 10.757 -6.085 2.898 1.00 . A A . 6 LYS HE3 1 1
9 1774 1 1 6 LYS HG2 H 9.642 -6.105 1.188 1.00 . A A . 6 LYS HG2 1 1
9 1775 1 1 6 LYS HG3 H 10.355 -4.753 0.304 1.00 . A A . 6 LYS HG3 1 1
9 1776 1 1 6 LYS HZ1 H 11.200 -4.137 4.984 1.00 . A A . 6 LYS HZ1 1 1
9 1777 1 1 6 LYS HZ2 H 11.876 -3.721 3.490 1.00 . A A . 6 LYS HZ2 1 1
9 1778 1 1 6 LYS HZ3 H 12.294 -5.183 4.229 1.00 . A A . 6 LYS HZ3 1 1
9 1779 1 1 6 LYS N N 5.866 -5.400 0.267 1.00 . A A . 6 LYS N 1 1
9 1780 1 1 6 LYS NZ N 11.519 -4.509 4.067 1.00 . A A . 6 LYS NZ 1 1
9 1781 1 1 6 LYS O O 7.989 -7.589 1.998 1.00 . A A . 6 LYS O 1 1
9 1782 1 1 7 ALA C C 5.762 -7.605 4.392 1.00 . A A . 7 ALA C 1 1
9 1783 1 1 7 ALA CA C 6.766 -6.471 4.218 1.00 . A A . 7 ALA CA 1 1
9 1784 1 1 7 ALA CB C 6.495 -5.365 5.227 1.00 . A A . 7 ALA CB 1 1
9 1785 1 1 7 ALA H H 6.231 -5.113 2.686 1.00 . A A . 7 ALA H 1 1
9 1786 1 1 7 ALA HA H 7.760 -6.853 4.399 1.00 . A A . 7 ALA HA 1 1
9 1787 1 1 7 ALA HB1 H 6.481 -5.782 6.223 1.00 . A A . 7 ALA HB1 1 1
9 1788 1 1 7 ALA HB2 H 7.272 -4.618 5.160 1.00 . A A . 7 ALA HB2 1 1
9 1789 1 1 7 ALA HB3 H 5.539 -4.910 5.014 1.00 . A A . 7 ALA HB3 1 1
9 1790 1 1 7 ALA N N 6.727 -5.939 2.862 1.00 . A A . 7 ALA N 1 1
9 1791 1 1 7 ALA O O 6.023 -8.573 5.107 1.00 . A A . 7 ALA O 1 1
9 1792 1 1 8 GLN C C 3.939 -9.724 2.994 1.00 . A A . 8 GLN C 1 1
9 1793 1 1 8 GLN CA C 3.570 -8.495 3.819 1.00 . A A . 8 GLN CA 1 1
9 1794 1 1 8 GLN CB C 2.235 -7.925 3.337 1.00 . A A . 8 GLN CB 1 1
9 1795 1 1 8 GLN CD C -0.220 -8.407 3.685 1.00 . A A . 8 GLN CD 1 1
9 1796 1 1 8 GLN CG C 1.125 -8.960 3.258 1.00 . A A . 8 GLN CG 1 1
9 1797 1 1 8 GLN H H 4.465 -6.685 3.181 1.00 . A A . 8 GLN H 1 1
9 1798 1 1 8 GLN HA H 3.474 -8.786 4.853 1.00 . A A . 8 GLN HA 1 1
9 1799 1 1 8 GLN HB2 H 1.924 -7.145 4.016 1.00 . A A . 8 GLN HB2 1 1
9 1800 1 1 8 GLN HB3 H 2.372 -7.501 2.353 1.00 . A A . 8 GLN HB3 1 1
9 1801 1 1 8 GLN HE21 H -0.822 -8.339 1.792 1.00 . A A . 8 GLN HE21 1 1
9 1802 1 1 8 GLN HE22 H -1.969 -7.798 2.964 1.00 . A A . 8 GLN HE22 1 1
9 1803 1 1 8 GLN HG2 H 1.046 -9.308 2.238 1.00 . A A . 8 GLN HG2 1 1
9 1804 1 1 8 GLN HG3 H 1.378 -9.790 3.901 1.00 . A A . 8 GLN HG3 1 1
9 1805 1 1 8 GLN N N 4.614 -7.479 3.735 1.00 . A A . 8 GLN N 1 1
9 1806 1 1 8 GLN NE2 N -1.092 -8.155 2.716 1.00 . A A . 8 GLN NE2 1 1
9 1807 1 1 8 GLN O O 3.565 -10.845 3.335 1.00 . A A . 8 GLN O 1 1
9 1808 1 1 8 GLN OE1 O -0.473 -8.209 4.874 1.00 . A A . 8 GLN OE1 1 1
9 1809 1 1 9 GLU C C 5.831 -11.671 1.826 1.00 . A A . 9 GLU C 1 1
9 1810 1 1 9 GLU CA C 5.093 -10.594 1.036 1.00 . A A . 9 GLU CA 1 1
9 1811 1 1 9 GLU CB C 5.988 -10.065 -0.086 1.00 . A A . 9 GLU CB 1 1
9 1812 1 1 9 GLU CD C 7.428 -10.623 -2.085 1.00 . A A . 9 GLU CD 1 1
9 1813 1 1 9 GLU CG C 6.683 -11.160 -0.878 1.00 . A A . 9 GLU CG 1 1
9 1814 1 1 9 GLU H H 4.942 -8.587 1.690 1.00 . A A . 9 GLU H 1 1
9 1815 1 1 9 GLU HA H 4.206 -11.029 0.601 1.00 . A A . 9 GLU HA 1 1
9 1816 1 1 9 GLU HB2 H 5.386 -9.482 -0.767 1.00 . A A . 9 GLU HB2 1 1
9 1817 1 1 9 GLU HB3 H 6.745 -9.427 0.346 1.00 . A A . 9 GLU HB3 1 1
9 1818 1 1 9 GLU HG2 H 7.388 -11.661 -0.233 1.00 . A A . 9 GLU HG2 1 1
9 1819 1 1 9 GLU HG3 H 5.940 -11.867 -1.217 1.00 . A A . 9 GLU HG3 1 1
9 1820 1 1 9 GLU N N 4.675 -9.504 1.909 1.00 . A A . 9 GLU N 1 1
9 1821 1 1 9 GLU O O 5.717 -12.861 1.533 1.00 . A A . 9 GLU O 1 1
9 1822 1 1 9 GLU OE1 O 7.315 -9.410 -2.360 1.00 . A A . 9 GLU OE1 1 1
9 1823 1 1 9 GLU OE2 O 8.124 -11.415 -2.754 1.00 . A A . 9 GLU OE2 1 1
9 1824 1 1 10 LYS C C 6.528 -12.605 4.876 1.00 . A A . 10 LYS C 1 1
9 1825 1 1 10 LYS CA C 7.347 -12.169 3.665 1.00 . A A . 10 LYS CA 1 1
9 1826 1 1 10 LYS CB C 8.653 -11.519 4.127 1.00 . A A . 10 LYS CB 1 1
9 1827 1 1 10 LYS CD C 8.919 -11.115 6.591 1.00 . A A . 10 LYS CD 1 1
9 1828 1 1 10 LYS CE C 9.494 -10.045 7.507 1.00 . A A . 10 LYS CE 1 1
9 1829 1 1 10 LYS CG C 8.471 -10.529 5.263 1.00 . A A . 10 LYS CG 1 1
9 1830 1 1 10 LYS H H 6.640 -10.282 3.016 1.00 . A A . 10 LYS H 1 1
9 1831 1 1 10 LYS HA H 7.578 -13.040 3.070 1.00 . A A . 10 LYS HA 1 1
9 1832 1 1 10 LYS HB2 H 9.329 -12.294 4.457 1.00 . A A . 10 LYS HB2 1 1
9 1833 1 1 10 LYS HB3 H 9.097 -10.998 3.290 1.00 . A A . 10 LYS HB3 1 1
9 1834 1 1 10 LYS HD2 H 8.071 -11.572 7.079 1.00 . A A . 10 LYS HD2 1 1
9 1835 1 1 10 LYS HD3 H 9.677 -11.864 6.407 1.00 . A A . 10 LYS HD3 1 1
9 1836 1 1 10 LYS HE2 H 8.831 -9.194 7.505 1.00 . A A . 10 LYS HE2 1 1
9 1837 1 1 10 LYS HE3 H 9.563 -10.446 8.508 1.00 . A A . 10 LYS HE3 1 1
9 1838 1 1 10 LYS HG2 H 9.056 -9.645 5.056 1.00 . A A . 10 LYS HG2 1 1
9 1839 1 1 10 LYS HG3 H 7.426 -10.262 5.332 1.00 . A A . 10 LYS HG3 1 1
9 1840 1 1 10 LYS HZ1 H 11.572 -10.250 7.445 1.00 . A A . 10 LYS HZ1 1 1
9 1841 1 1 10 LYS HZ2 H 11.040 -8.644 7.410 1.00 . A A . 10 LYS HZ2 1 1
9 1842 1 1 10 LYS HZ3 H 10.904 -9.611 6.029 1.00 . A A . 10 LYS HZ3 1 1
9 1843 1 1 10 LYS N N 6.589 -11.244 2.831 1.00 . A A . 10 LYS N 1 1
9 1844 1 1 10 LYS NZ N 10.848 -9.607 7.067 1.00 . A A . 10 LYS NZ 1 1
9 1845 1 1 10 LYS O O 7.060 -13.191 5.819 1.00 . A A . 10 LYS O 1 1
9 1846 1 1 11 PHE C C 3.280 -13.676 5.469 1.00 . A A . 11 PHE C 1 1
9 1847 1 1 11 PHE CA C 4.339 -12.681 5.937 1.00 . A A . 11 PHE CA 1 1
9 1848 1 1 11 PHE CB C 3.664 -11.432 6.508 1.00 . A A . 11 PHE CB 1 1
9 1849 1 1 11 PHE CD1 C 5.674 -11.087 7.969 1.00 . A A . 11 PHE CD1 1 1
9 1850 1 1 11 PHE CD2 C 4.399 -9.177 7.327 1.00 . A A . 11 PHE CD2 1 1
9 1851 1 1 11 PHE CE1 C 6.534 -10.276 8.685 1.00 . A A . 11 PHE CE1 1 1
9 1852 1 1 11 PHE CE2 C 5.256 -8.361 8.041 1.00 . A A . 11 PHE CE2 1 1
9 1853 1 1 11 PHE CG C 4.597 -10.548 7.284 1.00 . A A . 11 PHE CG 1 1
9 1854 1 1 11 PHE CZ C 6.326 -8.911 8.719 1.00 . A A . 11 PHE CZ 1 1
9 1855 1 1 11 PHE H H 4.865 -11.849 4.062 1.00 . A A . 11 PHE H 1 1
9 1856 1 1 11 PHE HA H 4.934 -13.143 6.709 1.00 . A A . 11 PHE HA 1 1
9 1857 1 1 11 PHE HB2 H 3.254 -10.850 5.697 1.00 . A A . 11 PHE HB2 1 1
9 1858 1 1 11 PHE HB3 H 2.865 -11.734 7.169 1.00 . A A . 11 PHE HB3 1 1
9 1859 1 1 11 PHE HD1 H 5.839 -12.154 7.942 1.00 . A A . 11 PHE HD1 1 1
9 1860 1 1 11 PHE HD2 H 3.562 -8.746 6.796 1.00 . A A . 11 PHE HD2 1 1
9 1861 1 1 11 PHE HE1 H 7.370 -10.708 9.214 1.00 . A A . 11 PHE HE1 1 1
9 1862 1 1 11 PHE HE2 H 5.090 -7.294 8.066 1.00 . A A . 11 PHE HE2 1 1
9 1863 1 1 11 PHE HZ H 6.996 -8.275 9.278 1.00 . A A . 11 PHE HZ 1 1
9 1864 1 1 11 PHE N N 5.231 -12.318 4.842 1.00 . A A . 11 PHE N 1 1
9 1865 1 1 11 PHE O O 2.826 -14.522 6.237 1.00 . A A . 11 PHE O 1 1
9 1866 1 1 12 GLY C C 2.473 -15.796 3.235 1.00 . A A . 12 GLY C 1 1
9 1867 1 1 12 GLY CA C 1.891 -14.461 3.652 1.00 . A A . 12 GLY CA 1 1
9 1868 1 1 12 GLY H H 3.290 -12.872 3.635 1.00 . A A . 12 GLY H 1 1
9 1869 1 1 12 GLY HA2 H 1.127 -14.629 4.397 1.00 . A A . 12 GLY HA2 1 1
9 1870 1 1 12 GLY HA3 H 1.441 -13.992 2.789 1.00 . A A . 12 GLY HA3 1 1
9 1871 1 1 12 GLY N N 2.893 -13.566 4.202 1.00 . A A . 12 GLY N 1 1
9 1872 1 1 12 GLY O O 2.991 -15.936 2.127 1.00 . A A . 12 GLY O 1 1
10 1873 1 1 1 TRP C C 3.155 -0.909 -1.137 1.00 . A A . 1 TRP C 1 1
10 1874 1 1 1 TRP CA C 1.947 0.019 -1.206 1.00 . A A . 1 TRP CA 1 1
10 1875 1 1 1 TRP CB C 2.398 1.439 -1.551 1.00 . A A . 1 TRP CB 1 1
10 1876 1 1 1 TRP CD1 C 4.723 2.207 -0.795 1.00 . A A . 1 TRP CD1 1 1
10 1877 1 1 1 TRP CD2 C 3.130 2.422 0.765 1.00 . A A . 1 TRP CD2 1 1
10 1878 1 1 1 TRP CE2 C 4.350 2.875 1.303 1.00 . A A . 1 TRP CE2 1 1
10 1879 1 1 1 TRP CE3 C 1.985 2.463 1.564 1.00 . A A . 1 TRP CE3 1 1
10 1880 1 1 1 TRP CG C 3.391 1.999 -0.578 1.00 . A A . 1 TRP CG 1 1
10 1881 1 1 1 TRP CH2 C 3.317 3.390 3.364 1.00 . A A . 1 TRP CH2 1 1
10 1882 1 1 1 TRP CZ2 C 4.455 3.361 2.604 1.00 . A A . 1 TRP CZ2 1 1
10 1883 1 1 1 TRP CZ3 C 2.090 2.945 2.855 1.00 . A A . 1 TRP CZ3 1 1
10 1884 1 1 1 TRP H1 H 1.712 0.029 0.898 1.00 . A A . 1 TRP H1 1 1
10 1885 1 1 1 TRP HA H 1.280 -0.335 -1.979 1.00 . A A . 1 TRP HA 1 1
10 1886 1 1 1 TRP HB2 H 2.854 1.438 -2.529 1.00 . A A . 1 TRP HB2 1 1
10 1887 1 1 1 TRP HB3 H 1.535 2.090 -1.560 1.00 . A A . 1 TRP HB3 1 1
10 1888 1 1 1 TRP HD1 H 5.230 1.984 -1.721 1.00 . A A . 1 TRP HD1 1 1
10 1889 1 1 1 TRP HE1 H 6.253 2.970 0.426 1.00 . A A . 1 TRP HE1 1 1
10 1890 1 1 1 TRP HE3 H 1.030 2.125 1.190 1.00 . A A . 1 TRP HE3 1 1
10 1891 1 1 1 TRP HH2 H 3.353 3.759 4.378 1.00 . A A . 1 TRP HH2 1 1
10 1892 1 1 1 TRP HZ2 H 5.393 3.708 3.011 1.00 . A A . 1 TRP HZ2 1 1
10 1893 1 1 1 TRP HZ3 H 1.215 2.984 3.488 1.00 . A A . 1 TRP HZ3 1 1
10 1894 1 1 1 TRP N N 1.213 0.013 0.054 1.00 . A A . 1 TRP N 1 1
10 1895 1 1 1 TRP NE1 N 5.306 2.733 0.333 1.00 . A A . 1 TRP NE1 1 1
10 1896 1 1 1 TRP O O 3.107 -1.961 -0.500 1.00 . A A . 1 TRP O 1 1
10 1897 1 1 2 LYS C C 5.914 -1.630 -0.389 1.00 . A A . 2 LYS C 1 1
10 1898 1 1 2 LYS CA C 5.461 -1.307 -1.809 1.00 . A A . 2 LYS CA 1 1
10 1899 1 1 2 LYS CB C 6.571 -0.561 -2.552 1.00 . A A . 2 LYS CB 1 1
10 1900 1 1 2 LYS CD C 7.690 1.069 -1.003 1.00 . A A . 2 LYS CD 1 1
10 1901 1 1 2 LYS CE C 9.019 1.485 -0.392 1.00 . A A . 2 LYS CE 1 1
10 1902 1 1 2 LYS CG C 7.793 -0.279 -1.696 1.00 . A A . 2 LYS CG 1 1
10 1903 1 1 2 LYS H H 4.215 0.337 -2.286 1.00 . A A . 2 LYS H 1 1
10 1904 1 1 2 LYS HA H 5.250 -2.231 -2.326 1.00 . A A . 2 LYS HA 1 1
10 1905 1 1 2 LYS HB2 H 6.880 -1.154 -3.401 1.00 . A A . 2 LYS HB2 1 1
10 1906 1 1 2 LYS HB3 H 6.180 0.382 -2.906 1.00 . A A . 2 LYS HB3 1 1
10 1907 1 1 2 LYS HD2 H 7.390 1.814 -1.726 1.00 . A A . 2 LYS HD2 1 1
10 1908 1 1 2 LYS HD3 H 6.947 1.005 -0.220 1.00 . A A . 2 LYS HD3 1 1
10 1909 1 1 2 LYS HE2 H 8.832 2.216 0.380 1.00 . A A . 2 LYS HE2 1 1
10 1910 1 1 2 LYS HE3 H 9.489 0.615 0.042 1.00 . A A . 2 LYS HE3 1 1
10 1911 1 1 2 LYS HG2 H 7.883 -1.051 -0.946 1.00 . A A . 2 LYS HG2 1 1
10 1912 1 1 2 LYS HG3 H 8.672 -0.283 -2.326 1.00 . A A . 2 LYS HG3 1 1
10 1913 1 1 2 LYS HZ1 H 10.909 2.090 -1.044 1.00 . A A . 2 LYS HZ1 1 1
10 1914 1 1 2 LYS HZ2 H 9.644 3.050 -1.626 1.00 . A A . 2 LYS HZ2 1 1
10 1915 1 1 2 LYS HZ3 H 9.910 1.514 -2.281 1.00 . A A . 2 LYS HZ3 1 1
10 1916 1 1 2 LYS N N 4.238 -0.512 -1.796 1.00 . A A . 2 LYS N 1 1
10 1917 1 1 2 LYS NZ N 9.935 2.076 -1.407 1.00 . A A . 2 LYS NZ 1 1
10 1918 1 1 2 LYS O O 6.444 -2.711 -0.126 1.00 . A A . 2 LYS O 1 1
10 1919 1 1 3 LEU C C 5.142 -1.847 2.620 1.00 . A A . 3 LEU C 1 1
10 1920 1 1 3 LEU CA C 6.086 -0.874 1.919 1.00 . A A . 3 LEU CA 1 1
10 1921 1 1 3 LEU CB C 6.088 0.469 2.651 1.00 . A A . 3 LEU CB 1 1
10 1922 1 1 3 LEU CD1 C 5.293 0.064 4.993 1.00 . A A . 3 LEU CD1 1 1
10 1923 1 1 3 LEU CD2 C 7.627 -0.556 4.343 1.00 . A A . 3 LEU CD2 1 1
10 1924 1 1 3 LEU CG C 6.488 0.429 4.126 1.00 . A A . 3 LEU CG 1 1
10 1925 1 1 3 LEU H H 5.274 0.151 0.255 1.00 . A A . 3 LEU H 1 1
10 1926 1 1 3 LEU HA H 7.084 -1.285 1.935 1.00 . A A . 3 LEU HA 1 1
10 1927 1 1 3 LEU HB2 H 6.777 1.123 2.139 1.00 . A A . 3 LEU HB2 1 1
10 1928 1 1 3 LEU HB3 H 5.090 0.880 2.588 1.00 . A A . 3 LEU HB3 1 1
10 1929 1 1 3 LEU HD11 H 5.210 0.769 5.807 1.00 . A A . 3 LEU HD11 1 1
10 1930 1 1 3 LEU HD12 H 5.428 -0.931 5.391 1.00 . A A . 3 LEU HD12 1 1
10 1931 1 1 3 LEU HD13 H 4.393 0.094 4.397 1.00 . A A . 3 LEU HD13 1 1
10 1932 1 1 3 LEU HD21 H 7.371 -1.506 3.900 1.00 . A A . 3 LEU HD21 1 1
10 1933 1 1 3 LEU HD22 H 7.794 -0.685 5.402 1.00 . A A . 3 LEU HD22 1 1
10 1934 1 1 3 LEU HD23 H 8.527 -0.173 3.882 1.00 . A A . 3 LEU HD23 1 1
10 1935 1 1 3 LEU HG H 6.830 1.410 4.426 1.00 . A A . 3 LEU HG 1 1
10 1936 1 1 3 LEU N N 5.701 -0.689 0.524 1.00 . A A . 3 LEU N 1 1
10 1937 1 1 3 LEU O O 5.466 -2.389 3.677 1.00 . A A . 3 LEU O 1 1
10 1938 1 1 4 LEU C C 3.109 -4.365 1.973 1.00 . A A . 4 LEU C 1 1
10 1939 1 1 4 LEU CA C 2.985 -2.974 2.589 1.00 . A A . 4 LEU CA 1 1
10 1940 1 1 4 LEU CB C 1.575 -2.428 2.363 1.00 . A A . 4 LEU CB 1 1
10 1941 1 1 4 LEU CD1 C 1.103 -2.095 4.803 1.00 . A A . 4 LEU CD1 1 1
10 1942 1 1 4 LEU CD2 C 1.857 -0.164 3.403 1.00 . A A . 4 LEU CD2 1 1
10 1943 1 1 4 LEU CG C 1.054 -1.457 3.424 1.00 . A A . 4 LEU CG 1 1
10 1944 1 1 4 LEU H H 3.775 -1.604 1.182 1.00 . A A . 4 LEU H 1 1
10 1945 1 1 4 LEU HA H 3.170 -3.046 3.650 1.00 . A A . 4 LEU HA 1 1
10 1946 1 1 4 LEU HB2 H 1.566 -1.915 1.414 1.00 . A A . 4 LEU HB2 1 1
10 1947 1 1 4 LEU HB3 H 0.897 -3.269 2.323 1.00 . A A . 4 LEU HB3 1 1
10 1948 1 1 4 LEU HD11 H 1.718 -1.495 5.456 1.00 . A A . 4 LEU HD11 1 1
10 1949 1 1 4 LEU HD12 H 1.523 -3.088 4.725 1.00 . A A . 4 LEU HD12 1 1
10 1950 1 1 4 LEU HD13 H 0.103 -2.158 5.206 1.00 . A A . 4 LEU HD13 1 1
10 1951 1 1 4 LEU HD21 H 2.408 -0.068 4.327 1.00 . A A . 4 LEU HD21 1 1
10 1952 1 1 4 LEU HD22 H 1.185 0.675 3.296 1.00 . A A . 4 LEU HD22 1 1
10 1953 1 1 4 LEU HD23 H 2.546 -0.182 2.572 1.00 . A A . 4 LEU HD23 1 1
10 1954 1 1 4 LEU HG H 0.023 -1.214 3.206 1.00 . A A . 4 LEU HG 1 1
10 1955 1 1 4 LEU N N 3.976 -2.065 2.023 1.00 . A A . 4 LEU N 1 1
10 1956 1 1 4 LEU O O 2.896 -5.373 2.646 1.00 . A A . 4 LEU O 1 1
10 1957 1 1 5 SER C C 4.969 -6.299 0.268 1.00 . A A . 5 SER C 1 1
10 1958 1 1 5 SER CA C 3.606 -5.676 -0.016 1.00 . A A . 5 SER CA 1 1
10 1959 1 1 5 SER CB C 3.431 -5.468 -1.522 1.00 . A A . 5 SER CB 1 1
10 1960 1 1 5 SER H H 3.611 -3.571 0.208 1.00 . A A . 5 SER H 1 1
10 1961 1 1 5 SER HA H 2.837 -6.347 0.338 1.00 . A A . 5 SER HA 1 1
10 1962 1 1 5 SER HB2 H 4.262 -4.893 -1.902 1.00 . A A . 5 SER HB2 1 1
10 1963 1 1 5 SER HB3 H 3.403 -6.429 -2.014 1.00 . A A . 5 SER HB3 1 1
10 1964 1 1 5 SER HG H 2.398 -4.093 -2.459 1.00 . A A . 5 SER HG 1 1
10 1965 1 1 5 SER N N 3.455 -4.410 0.691 1.00 . A A . 5 SER N 1 1
10 1966 1 1 5 SER O O 5.103 -7.520 0.352 1.00 . A A . 5 SER O 1 1
10 1967 1 1 5 SER OG O 2.229 -4.774 -1.804 1.00 . A A . 5 SER OG 1 1
10 1968 1 1 6 LYS C C 7.416 -6.573 2.064 1.00 . A A . 6 LYS C 1 1
10 1969 1 1 6 LYS CA C 7.336 -5.913 0.691 1.00 . A A . 6 LYS CA 1 1
10 1970 1 1 6 LYS CB C 8.321 -4.745 0.617 1.00 . A A . 6 LYS CB 1 1
10 1971 1 1 6 LYS CD C 9.761 -4.285 2.623 1.00 . A A . 6 LYS CD 1 1
10 1972 1 1 6 LYS CE C 10.346 -5.173 3.711 1.00 . A A . 6 LYS CE 1 1
10 1973 1 1 6 LYS CG C 9.649 -5.025 1.301 1.00 . A A . 6 LYS CG 1 1
10 1974 1 1 6 LYS H H 5.812 -4.487 0.337 1.00 . A A . 6 LYS H 1 1
10 1975 1 1 6 LYS HA H 7.597 -6.642 -0.061 1.00 . A A . 6 LYS HA 1 1
10 1976 1 1 6 LYS HB2 H 8.516 -4.519 -0.421 1.00 . A A . 6 LYS HB2 1 1
10 1977 1 1 6 LYS HB3 H 7.873 -3.881 1.086 1.00 . A A . 6 LYS HB3 1 1
10 1978 1 1 6 LYS HD2 H 10.402 -3.426 2.492 1.00 . A A . 6 LYS HD2 1 1
10 1979 1 1 6 LYS HD3 H 8.777 -3.958 2.928 1.00 . A A . 6 LYS HD3 1 1
10 1980 1 1 6 LYS HE2 H 10.035 -4.795 4.672 1.00 . A A . 6 LYS HE2 1 1
10 1981 1 1 6 LYS HE3 H 9.968 -6.177 3.579 1.00 . A A . 6 LYS HE3 1 1
10 1982 1 1 6 LYS HG2 H 9.732 -6.085 1.486 1.00 . A A . 6 LYS HG2 1 1
10 1983 1 1 6 LYS HG3 H 10.452 -4.707 0.651 1.00 . A A . 6 LYS HG3 1 1
10 1984 1 1 6 LYS HZ1 H 12.152 -5.832 2.895 1.00 . A A . 6 LYS HZ1 1 1
10 1985 1 1 6 LYS HZ2 H 12.214 -5.556 4.563 1.00 . A A . 6 LYS HZ2 1 1
10 1986 1 1 6 LYS HZ3 H 12.206 -4.249 3.489 1.00 . A A . 6 LYS HZ3 1 1
10 1987 1 1 6 LYS N N 5.981 -5.450 0.415 1.00 . A A . 6 LYS N 1 1
10 1988 1 1 6 LYS NZ N 11.834 -5.205 3.660 1.00 . A A . 6 LYS NZ 1 1
10 1989 1 1 6 LYS O O 8.066 -7.605 2.230 1.00 . A A . 6 LYS O 1 1
10 1990 1 1 7 ALA C C 5.740 -7.643 4.540 1.00 . A A . 7 ALA C 1 1
10 1991 1 1 7 ALA CA C 6.743 -6.503 4.402 1.00 . A A . 7 ALA CA 1 1
10 1992 1 1 7 ALA CB C 6.430 -5.398 5.400 1.00 . A A . 7 ALA CB 1 1
10 1993 1 1 7 ALA H H 6.250 -5.152 2.850 1.00 . A A . 7 ALA H 1 1
10 1994 1 1 7 ALA HA H 7.733 -6.879 4.618 1.00 . A A . 7 ALA HA 1 1
10 1995 1 1 7 ALA HB1 H 7.224 -4.667 5.387 1.00 . A A . 7 ALA HB1 1 1
10 1996 1 1 7 ALA HB2 H 5.498 -4.923 5.130 1.00 . A A . 7 ALA HB2 1 1
10 1997 1 1 7 ALA HB3 H 6.346 -5.821 6.390 1.00 . A A . 7 ALA HB3 1 1
10 1998 1 1 7 ALA N N 6.750 -5.972 3.044 1.00 . A A . 7 ALA N 1 1
10 1999 1 1 7 ALA O O 5.993 -8.622 5.242 1.00 . A A . 7 ALA O 1 1
10 2000 1 1 8 GLN C C 3.963 -9.757 3.108 1.00 . A A . 8 GLN C 1 1
10 2001 1 1 8 GLN CA C 3.560 -8.528 3.916 1.00 . A A . 8 GLN CA 1 1
10 2002 1 1 8 GLN CB C 2.240 -7.965 3.387 1.00 . A A . 8 GLN CB 1 1
10 2003 1 1 8 GLN CD C -0.231 -8.424 3.646 1.00 . A A . 8 GLN CD 1 1
10 2004 1 1 8 GLN CG C 1.129 -8.999 3.301 1.00 . A A . 8 GLN CG 1 1
10 2005 1 1 8 GLN H H 4.459 -6.706 3.324 1.00 . A A . 8 GLN H 1 1
10 2006 1 1 8 GLN HA H 3.430 -8.818 4.948 1.00 . A A . 8 GLN HA 1 1
10 2007 1 1 8 GLN HB2 H 1.914 -7.170 4.041 1.00 . A A . 8 GLN HB2 1 1
10 2008 1 1 8 GLN HB3 H 2.405 -7.563 2.399 1.00 . A A . 8 GLN HB3 1 1
10 2009 1 1 8 GLN HE21 H -0.927 -8.931 1.854 1.00 . A A . 8 GLN HE21 1 1
10 2010 1 1 8 GLN HE22 H -2.053 -8.144 2.902 1.00 . A A . 8 GLN HE22 1 1
10 2011 1 1 8 GLN HG2 H 1.093 -9.387 2.294 1.00 . A A . 8 GLN HG2 1 1
10 2012 1 1 8 GLN HG3 H 1.349 -9.802 3.988 1.00 . A A . 8 GLN HG3 1 1
10 2013 1 1 8 GLN N N 4.602 -7.509 3.866 1.00 . A A . 8 GLN N 1 1
10 2014 1 1 8 GLN NE2 N -1.165 -8.507 2.706 1.00 . A A . 8 GLN NE2 1 1
10 2015 1 1 8 GLN O O 3.551 -10.875 3.415 1.00 . A A . 8 GLN O 1 1
10 2016 1 1 8 GLN OE1 O -0.440 -7.909 4.745 1.00 . A A . 8 GLN OE1 1 1
10 2017 1 1 9 GLU C C 5.869 -11.740 2.051 1.00 . A A . 9 GLU C 1 1
10 2018 1 1 9 GLU CA C 5.226 -10.632 1.220 1.00 . A A . 9 GLU CA 1 1
10 2019 1 1 9 GLU CB C 6.223 -10.115 0.181 1.00 . A A . 9 GLU CB 1 1
10 2020 1 1 9 GLU CD C 6.029 -12.174 -1.268 1.00 . A A . 9 GLU CD 1 1
10 2021 1 1 9 GLU CG C 6.964 -11.218 -0.553 1.00 . A A . 9 GLU CG 1 1
10 2022 1 1 9 GLU H H 5.064 -8.627 1.879 1.00 . A A . 9 GLU H 1 1
10 2023 1 1 9 GLU HA H 4.365 -11.036 0.710 1.00 . A A . 9 GLU HA 1 1
10 2024 1 1 9 GLU HB2 H 5.690 -9.520 -0.546 1.00 . A A . 9 GLU HB2 1 1
10 2025 1 1 9 GLU HB3 H 6.950 -9.490 0.679 1.00 . A A . 9 GLU HB3 1 1
10 2026 1 1 9 GLU HG2 H 7.621 -10.769 -1.283 1.00 . A A . 9 GLU HG2 1 1
10 2027 1 1 9 GLU HG3 H 7.550 -11.778 0.161 1.00 . A A . 9 GLU HG3 1 1
10 2028 1 1 9 GLU N N 4.769 -9.541 2.073 1.00 . A A . 9 GLU N 1 1
10 2029 1 1 9 GLU O O 5.708 -12.925 1.758 1.00 . A A . 9 GLU O 1 1
10 2030 1 1 9 GLU OE1 O 5.220 -11.706 -2.096 1.00 . A A . 9 GLU OE1 1 1
10 2031 1 1 9 GLU OE2 O 6.107 -13.391 -1.000 1.00 . A A . 9 GLU OE2 1 1
10 2032 1 1 10 LYS C C 6.350 -12.727 5.105 1.00 . A A . 10 LYS C 1 1
10 2033 1 1 10 LYS CA C 7.267 -12.301 3.963 1.00 . A A . 10 LYS CA 1 1
10 2034 1 1 10 LYS CB C 8.554 -11.695 4.527 1.00 . A A . 10 LYS CB 1 1
10 2035 1 1 10 LYS CD C 8.763 -9.224 4.926 1.00 . A A . 10 LYS CD 1 1
10 2036 1 1 10 LYS CE C 10.266 -9.194 4.696 1.00 . A A . 10 LYS CE 1 1
10 2037 1 1 10 LYS CG C 8.314 -10.556 5.502 1.00 . A A . 10 LYS CG 1 1
10 2038 1 1 10 LYS H H 6.690 -10.385 3.271 1.00 . A A . 10 LYS H 1 1
10 2039 1 1 10 LYS HA H 7.516 -13.171 3.374 1.00 . A A . 10 LYS HA 1 1
10 2040 1 1 10 LYS HB2 H 9.108 -12.469 5.038 1.00 . A A . 10 LYS HB2 1 1
10 2041 1 1 10 LYS HB3 H 9.150 -11.320 3.707 1.00 . A A . 10 LYS HB3 1 1
10 2042 1 1 10 LYS HD2 H 8.263 -9.063 3.982 1.00 . A A . 10 LYS HD2 1 1
10 2043 1 1 10 LYS HD3 H 8.497 -8.435 5.615 1.00 . A A . 10 LYS HD3 1 1
10 2044 1 1 10 LYS HE2 H 10.661 -10.185 4.858 1.00 . A A . 10 LYS HE2 1 1
10 2045 1 1 10 LYS HE3 H 10.455 -8.893 3.676 1.00 . A A . 10 LYS HE3 1 1
10 2046 1 1 10 LYS HG2 H 7.258 -10.502 5.725 1.00 . A A . 10 LYS HG2 1 1
10 2047 1 1 10 LYS HG3 H 8.866 -10.749 6.411 1.00 . A A . 10 LYS HG3 1 1
10 2048 1 1 10 LYS HZ1 H 10.731 -8.484 6.605 1.00 . A A . 10 LYS HZ1 1 1
10 2049 1 1 10 LYS HZ2 H 10.630 -7.272 5.428 1.00 . A A . 10 LYS HZ2 1 1
10 2050 1 1 10 LYS HZ3 H 11.979 -8.291 5.479 1.00 . A A . 10 LYS HZ3 1 1
10 2051 1 1 10 LYS N N 6.599 -11.345 3.088 1.00 . A A . 10 LYS N 1 1
10 2052 1 1 10 LYS NZ N 10.949 -8.244 5.617 1.00 . A A . 10 LYS NZ 1 1
10 2053 1 1 10 LYS O O 6.793 -13.348 6.071 1.00 . A A . 10 LYS O 1 1
10 2054 1 1 11 PHE C C 2.984 -13.611 5.428 1.00 . A A . 11 PHE C 1 1
10 2055 1 1 11 PHE CA C 4.090 -12.737 6.010 1.00 . A A . 11 PHE CA 1 1
10 2056 1 1 11 PHE CB C 3.487 -11.470 6.620 1.00 . A A . 11 PHE CB 1 1
10 2057 1 1 11 PHE CD1 C 5.579 -11.208 7.982 1.00 . A A . 11 PHE CD1 1 1
10 2058 1 1 11 PHE CD2 C 4.332 -9.251 7.432 1.00 . A A . 11 PHE CD2 1 1
10 2059 1 1 11 PHE CE1 C 6.500 -10.435 8.662 1.00 . A A . 11 PHE CE1 1 1
10 2060 1 1 11 PHE CE2 C 5.251 -8.473 8.110 1.00 . A A . 11 PHE CE2 1 1
10 2061 1 1 11 PHE CG C 4.486 -10.626 7.359 1.00 . A A . 11 PHE CG 1 1
10 2062 1 1 11 PHE CZ C 6.335 -9.065 8.727 1.00 . A A . 11 PHE CZ 1 1
10 2063 1 1 11 PHE H H 4.777 -11.893 4.193 1.00 . A A . 11 PHE H 1 1
10 2064 1 1 11 PHE HA H 4.601 -13.290 6.782 1.00 . A A . 11 PHE HA 1 1
10 2065 1 1 11 PHE HB2 H 3.062 -10.866 5.832 1.00 . A A . 11 PHE HB2 1 1
10 2066 1 1 11 PHE HB3 H 2.709 -11.749 7.314 1.00 . A A . 11 PHE HB3 1 1
10 2067 1 1 11 PHE HD1 H 5.708 -12.280 7.931 1.00 . A A . 11 PHE HD1 1 1
10 2068 1 1 11 PHE HD2 H 3.484 -8.786 6.951 1.00 . A A . 11 PHE HD2 1 1
10 2069 1 1 11 PHE HE1 H 7.347 -10.902 9.143 1.00 . A A . 11 PHE HE1 1 1
10 2070 1 1 11 PHE HE2 H 5.119 -7.402 8.160 1.00 . A A . 11 PHE HE2 1 1
10 2071 1 1 11 PHE HZ H 7.054 -8.459 9.258 1.00 . A A . 11 PHE HZ 1 1
10 2072 1 1 11 PHE N N 5.070 -12.389 4.987 1.00 . A A . 11 PHE N 1 1
10 2073 1 1 11 PHE O O 2.435 -14.474 6.112 1.00 . A A . 11 PHE O 1 1
10 2074 1 1 12 GLY C C 2.113 -15.509 3.037 1.00 . A A . 12 GLY C 1 1
10 2075 1 1 12 GLY CA C 1.621 -14.154 3.506 1.00 . A A . 12 GLY CA 1 1
10 2076 1 1 12 GLY H H 3.132 -12.679 3.662 1.00 . A A . 12 GLY H 1 1
10 2077 1 1 12 GLY HA2 H 0.805 -14.298 4.199 1.00 . A A . 12 GLY HA2 1 1
10 2078 1 1 12 GLY HA3 H 1.260 -13.600 2.651 1.00 . A A . 12 GLY HA3 1 1
10 2079 1 1 12 GLY N N 2.661 -13.380 4.159 1.00 . A A . 12 GLY N 1 1
10 2080 1 1 12 GLY O O 1.447 -16.181 2.251 1.00 . A A . 12 GLY O 1 1
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