NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
|
|
611665 |
2nbc   |
25971 | cing | 4-filtered-FRED | STAR | entry | full | 217 |
data_FRED_restraints_with_modified_coordinates_PDB_code_2nbc
# This FRED archive file contains, for PDB entry <2nbc>:
#
# - 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_2nbc
_Assembly.Sf_category assembly
_Assembly.Entry_ID 1
_Assembly.ID 1
_Assembly.Name 2nbc
_Assembly.Number_of_components 1
_Assembly.Organic_ligands .
_Assembly.Metal_ions .
_Assembly.Paramagnetic .
_Assembly.Thiol_state "all disulfide bound"
_Assembly.Molecular_mass 1737.05
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 $poneritoxin A . 1 1
stop_
save_
save_poneritoxin
_Entity.Sf_category entity
_Entity.Entry_ID 1
_Entity.ID 1
_Entity.Name poneritoxin
_Entity.Type polymer
_Entity.Polymer_type polypeptide(L)
_Entity.Polymer_seq_one_letter_code WCASGCRKKRHGGCSCX
_Entity.Number_of_monomers 17
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 CYS . 1 1
3 ALA . 1 1
4 SER . 1 1
5 GLY . 1 1
6 CYS . 1 1
7 ARG . 1 1
8 LYS . 1 1
9 LYS . 1 1
10 ARG . 1 1
11 HIS . 1 1
12 GLY . 1 1
13 GLY . 1 1
14 CYS . 1 1
15 SER . 1 1
16 CYS . 1 1
17 NH2 $NH2 1 1
stop_
loop_
_Entity_poly_seq.Mon_ID
_Entity_poly_seq.Num
_Entity_poly_seq.Comp_index_ID
_Entity_poly_seq.Entry_ID
_Entity_poly_seq.Entity_ID
TRP 1 1 1 1
CYS 2 2 1 1
ALA 3 3 1 1
SER 4 4 1 1
GLY 5 5 1 1
CYS 6 6 1 1
ARG 7 7 1 1
LYS 8 8 1 1
LYS 9 9 1 1
ARG 10 10 1 1
HIS 11 11 1 1
GLY 12 12 1 1
GLY 13 13 1 1
CYS 14 14 1 1
SER 15 15 1 1
CYS 16 16 1 1
NH2 17 17 1 1
stop_
save_
save_NH2
_Chem_comp.Sf_category chem_comp
_Chem_comp.Entry_ID 1
_Chem_comp.ID NH2
_Chem_comp.Type non-polymer
save_
save_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
113 1 . . . 1 1
114 1 . . . 1 1
115 1 . . . 1 1
116 1 . . . 1 1
117 1 . . . 1 1
118 1 . . . 1 1
119 1 . . . 1 1
120 1 . . . 1 1
121 1 . . . 1 1
122 1 . . . 1 1
123 1 . . . 1 1
124 1 . . . 1 1
125 1 . . . 1 1
126 1 . . . 1 1
127 1 . . . 1 1
128 1 . . . 1 1
129 1 . . . 1 1
130 1 . . . 1 1
131 1 . . . 1 1
132 1 . . . 1 1
133 1 . . . 1 1
134 1 . . . 1 1
135 1 . . . 1 1
136 1 . . . 1 1
137 1 . . . 1 1
138 1 . . . 1 1
139 1 . . . 1 1
140 1 . . . 1 1
141 1 . . . 1 1
142 1 . . . 1 1
143 1 . . . 1 1
144 1 . . . 1 1
145 1 . . . 1 1
146 1 . . . 1 1
147 1 . . . 1 1
148 1 . . . 1 1
149 1 . . . 1 1
150 1 . . . 1 1
151 1 . . . 1 1
152 1 . . . 1 1
153 1 . . . 1 1
154 1 . . . 1 1
155 1 . . . 1 1
156 1 . . . 1 1
157 1 . . . 1 1
158 1 . . . 1 1
159 1 . . . 1 1
160 1 . . . 1 1
161 1 . . . 1 1
162 1 . . . 1 1
163 1 . . . 1 1
164 1 . . . 1 1
165 1 . . . 1 1
166 1 . . . 1 1
167 1 . . . 1 1
168 1 . . . 1 1
169 1 . . . 1 1
170 1 . . . 1 1
171 1 . . . 1 1
172 1 . . . 1 1
173 1 . . . 1 1
174 1 . . . 1 1
175 1 . . . 1 1
176 1 . . . 1 1
177 1 . . . 1 1
178 1 . . . 1 1
179 1 . . . 1 1
180 1 . . . 1 1
181 1 . . . 1 1
182 1 . . . 1 1
183 1 . . . 1 1
184 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 7 ARG H . 7 ARG H 1 1
1 1 2 1 1 15 SER H . 15 SER H 1 1
2 1 1 1 1 14 CYS HA . 14 CYSS HA 1 1
2 1 2 1 1 15 SER H . 15 SER H 1 1
3 1 1 1 1 15 SER H . 15 SER H 1 1
3 1 2 1 1 15 SER HB2 . 15 SER HB2 1 1
4 1 1 1 1 15 SER H . 15 SER H 1 1
4 1 2 1 1 15 SER HB3 . 15 SER HB3 1 1
5 1 1 1 1 9 LYS QE . 9 LYS QE 1 1
5 1 2 1 1 15 SER H . 15 SER H 1 1
6 1 1 1 1 14 CYS HB3 . 14 CYSS HB3 1 1
6 1 2 1 1 15 SER H . 15 SER H 1 1
7 1 1 1 1 14 CYS HB2 . 14 CYSS HB2 1 1
7 1 2 1 1 15 SER H . 15 SER H 1 1
8 1 1 1 1 16 CYS H . 16 CYSS H 1 1
8 1 2 1 1 16 CYS HB2 . 16 CYSS HB2 1 1
9 1 1 1 1 15 SER HA . 15 SER HA 1 1
9 1 2 1 1 16 CYS H . 16 CYSS H 1 1
10 1 1 1 1 5 GLY H . 5 GLY H 1 1
10 1 2 1 1 6 CYS H . 6 CYSS H 1 1
11 1 1 1 1 7 ARG H . 7 ARG H 1 1
11 1 2 1 1 7 ARG HG2 . 7 ARG HG2 1 1
12 1 1 1 1 7 ARG H . 7 ARG H 1 1
12 1 2 1 1 7 ARG HG3 . 7 ARG HG3 1 1
13 1 1 1 1 6 CYS HA . 6 CYSS HA 1 1
13 1 2 1 1 7 ARG H . 7 ARG H 1 1
14 1 1 1 1 7 ARG H . 7 ARG H 1 1
14 1 2 1 1 16 CYS HA . 16 CYSS HA 1 1
15 1 1 1 1 4 SER QB . 4 SER QB 1 1
15 1 2 1 1 5 GLY H . 5 GLY H 1 1
16 1 1 1 1 6 CYS HB2 . 6 CYSS HB2 1 1
16 1 2 1 1 7 ARG H . 7 ARG H 1 1
17 1 1 1 1 6 CYS HB3 . 6 CYSS HB3 1 1
17 1 2 1 1 7 ARG H . 7 ARG H 1 1
18 1 1 1 1 7 ARG H . 7 ARG H 1 1
18 1 2 1 1 7 ARG HB3 . 7 ARG HB3 1 1
19 1 1 1 1 7 ARG H . 7 ARG H 1 1
19 1 2 1 1 7 ARG HB2 . 7 ARG HB2 1 1
20 1 1 1 1 3 ALA MB . 3 ALA QB 1 1
20 1 2 1 1 5 GLY H . 5 GLY H 1 1
21 1 1 1 1 9 LYS HA . 9 LYS HA 1 1
21 1 2 1 1 10 ARG H . 10 ARG H 1 1
22 1 1 1 1 13 GLY HA2 . 13 GLY HA2 1 1
22 1 2 1 1 14 CYS H . 14 CYSS H 1 1
23 1 1 1 1 13 GLY HA3 . 13 GLY HA3 1 1
23 1 2 1 1 14 CYS H . 14 CYSS H 1 1
24 1 1 1 1 9 LYS QE . 9 LYS QE 1 1
24 1 2 1 1 14 CYS H . 14 CYSS H 1 1
25 1 1 1 1 14 CYS H . 14 CYSS H 1 1
25 1 2 1 1 14 CYS HB2 . 14 CYSS HB2 1 1
26 1 1 1 1 9 LYS HD3 . 9 LYS HD3 1 1
26 1 2 1 1 14 CYS H . 14 CYSS H 1 1
27 1 1 1 1 9 LYS HB2 . 9 LYS HB2 1 1
27 1 2 1 1 11 HIS H . 11 HIS H 1 1
28 1 1 1 1 10 ARG HB2 . 10 ARG HB2 1 1
28 1 2 1 1 11 HIS H . 11 HIS H 1 1
29 1 1 1 1 10 ARG HB3 . 10 ARG HB3 1 1
29 1 2 1 1 11 HIS H . 11 HIS H 1 1
30 1 1 1 1 9 LYS HB3 . 9 LYS HB3 1 1
30 1 2 1 1 11 HIS H . 11 HIS H 1 1
31 1 1 1 1 7 ARG HA . 7 ARG HA 1 1
31 1 2 1 1 8 LYS H . 8 LYS H 1 1
32 1 1 1 1 7 ARG HG2 . 7 ARG HG2 1 1
32 1 2 1 1 8 LYS H . 8 LYS H 1 1
33 1 1 1 1 7 ARG HG3 . 7 ARG HG3 1 1
33 1 2 1 1 8 LYS H . 8 LYS H 1 1
34 1 1 1 1 8 LYS H . 8 LYS H 1 1
34 1 2 1 1 8 LYS HB3 . 8 LYS HB3 1 1
35 1 1 1 1 8 LYS H . 8 LYS H 1 1
35 1 2 1 1 8 LYS HB2 . 8 LYS HB2 1 1
36 1 1 1 1 2 CYS HA . 2 CYSS HA 1 1
36 1 2 1 1 3 ALA H . 3 ALA H 1 1
37 1 1 1 1 3 ALA HA . 3 ALA HA 1 1
37 1 2 1 1 4 SER H . 4 SER H 1 1
38 1 1 1 1 3 ALA H . 3 ALA H 1 1
38 1 2 1 1 6 CYS HB2 . 6 CYSS HB2 1 1
39 1 1 1 1 3 ALA H . 3 ALA H 1 1
39 1 2 1 1 14 CYS HB2 . 14 CYSS HB2 1 1
40 1 1 1 1 2 CYS HB3 . 2 CYSS HB3 1 1
40 1 2 1 1 3 ALA H . 3 ALA H 1 1
41 1 1 1 1 3 ALA H . 3 ALA H 1 1
41 1 2 1 1 6 CYS HB3 . 6 CYSS HB3 1 1
42 1 1 1 1 2 CYS HB2 . 2 CYSS HB2 1 1
42 1 2 1 1 3 ALA H . 3 ALA H 1 1
43 1 1 1 1 3 ALA H . 3 ALA H 1 1
43 1 2 1 1 3 ALA MB . 3 ALA QB 1 1
44 1 1 1 1 4 SER H . 4 SER H 1 1
44 1 2 1 1 4 SER QB . 4 SER QB 1 1
45 1 1 1 1 9 LYS H . 9 LYS H 1 1
45 1 2 1 1 14 CYS HA . 14 CYSS HA 1 1
46 1 1 1 1 8 LYS HA . 8 LYS HA 1 1
46 1 2 1 1 9 LYS H . 9 LYS H 1 1
47 1 1 1 1 8 LYS HG2 . 8 LYS HG2 1 1
47 1 2 1 1 9 LYS H . 9 LYS H 1 1
48 1 1 1 1 8 LYS HG3 . 8 LYS HG3 1 1
48 1 2 1 1 9 LYS H . 9 LYS H 1 1
49 1 1 1 1 9 LYS H . 9 LYS H 1 1
49 1 2 1 1 9 LYS HG3 . 9 LYS HG3 1 1
50 1 1 1 1 9 LYS H . 9 LYS H 1 1
50 1 2 1 1 9 LYS HB2 . 9 LYS HB2 1 1
51 1 1 1 1 9 LYS H . 9 LYS H 1 1
51 1 2 1 1 9 LYS HB3 . 9 LYS HB3 1 1
52 1 1 1 1 8 LYS HB2 . 8 LYS HB2 1 1
52 1 2 1 1 9 LYS H . 9 LYS H 1 1
53 1 1 1 1 8 LYS QE . 8 LYS QE 1 1
53 1 2 1 1 9 LYS H . 9 LYS H 1 1
54 1 1 1 1 9 LYS H . 9 LYS H 1 1
54 1 2 1 1 9 LYS QE . 9 LYS QE 1 1
55 1 1 1 1 8 LYS HB3 . 8 LYS HB3 1 1
55 1 2 1 1 9 LYS H . 9 LYS H 1 1
56 1 1 1 1 9 LYS H . 9 LYS H 1 1
56 1 2 1 1 9 LYS HG2 . 9 LYS HG2 1 1
57 1 1 1 1 6 CYS H . 6 CYSS H 1 1
57 1 2 1 1 6 CYS HB2 . 6 CYSS HB2 1 1
58 1 1 1 1 4 SER QB . 4 SER QB 1 1
58 1 2 1 1 6 CYS H . 6 CYSS H 1 1
59 1 1 1 1 2 CYS HB3 . 2 CYSS HB3 1 1
59 1 2 1 1 6 CYS H . 6 CYSS H 1 1
60 1 1 1 1 6 CYS H . 6 CYSS H 1 1
60 1 2 1 1 6 CYS HB3 . 6 CYSS HB3 1 1
61 1 1 1 1 3 ALA MB . 3 ALA QB 1 1
61 1 2 1 1 6 CYS H . 6 CYSS H 1 1
62 1 1 1 1 1 TRP HE3 . 1 TRP HE3 1 1
62 1 2 1 1 2 CYS HA . 2 CYSS HA 1 1
63 1 1 1 1 1 TRP HZ2 . 1 TRP HZ2 1 1
63 1 2 1 1 3 ALA HA . 3 ALA HA 1 1
64 1 1 1 1 1 TRP HA . 1 TRP HA 1 1
64 1 2 1 1 1 TRP HE3 . 1 TRP HE3 1 1
65 1 1 1 1 1 TRP QB . 1 TRP QB 1 1
65 1 2 1 1 1 TRP HE3 . 1 TRP HE3 1 1
66 1 1 1 1 1 TRP HE3 . 1 TRP HE3 1 1
66 1 2 1 1 3 ALA MB . 3 ALA QB 1 1
67 1 1 1 1 1 TRP HZ2 . 1 TRP HZ2 1 1
67 1 2 1 1 3 ALA MB . 3 ALA QB 1 1
68 1 1 1 1 1 TRP HA . 1 TRP HA 1 1
68 1 2 1 1 1 TRP HD1 . 1 TRP HD1 1 1
69 1 1 1 1 11 HIS HA . 11 HIS HA 1 1
69 1 2 1 1 11 HIS HD2 . 11 HIS HD2 1 1
70 1 1 1 1 1 TRP HH2 . 1 TRP HH2 1 1
70 1 2 1 1 3 ALA HA . 3 ALA HA 1 1
71 1 1 1 1 1 TRP HZ3 . 1 TRP HZ3 1 1
71 1 2 1 1 3 ALA HA . 3 ALA HA 1 1
72 1 1 1 1 1 TRP QB . 1 TRP QB 1 1
72 1 2 1 1 1 TRP HD1 . 1 TRP HD1 1 1
73 1 1 1 1 10 ARG QD . 10 ARG QD 1 1
73 1 2 1 1 11 HIS HD2 . 11 HIS HD2 1 1
74 1 1 1 1 10 ARG HB2 . 10 ARG HB2 1 1
74 1 2 1 1 11 HIS HD2 . 11 HIS HD2 1 1
75 1 1 1 1 1 TRP HH2 . 1 TRP HH2 1 1
75 1 2 1 1 3 ALA MB . 3 ALA QB 1 1
76 1 1 1 1 1 TRP HZ3 . 1 TRP HZ3 1 1
76 1 2 1 1 3 ALA MB . 3 ALA QB 1 1
77 1 1 1 1 9 LYS QE . 9 LYS QE 1 1
77 1 2 1 1 15 SER HA . 15 SER HA 1 1
78 1 1 1 1 2 CYS HA . 2 CYSS HA 1 1
78 1 2 1 1 3 ALA HA . 3 ALA HA 1 1
79 1 1 1 1 6 CYS HB3 . 6 CYSS HB3 1 1
79 1 2 1 1 16 CYS HA . 16 CYSS HA 1 1
80 1 1 1 1 8 LYS HA . 8 LYS HA 1 1
80 1 2 1 1 14 CYS HA . 14 CYSS HA 1 1
81 1 1 1 1 6 CYS HA . 6 CYSS HA 1 1
81 1 2 1 1 16 CYS HA . 16 CYSS HA 1 1
82 1 1 1 1 3 ALA MB . 3 ALA QB 1 1
82 1 2 1 1 6 CYS HB2 . 6 CYSS HB2 1 1
83 1 1 1 1 9 LYS QE . 9 LYS QE 1 1
83 1 2 1 1 13 GLY HA2 . 13 GLY HA2 1 1
84 1 1 1 1 13 GLY HA2 . 13 GLY HA2 1 1
84 1 2 1 1 14 CYS HB2 . 14 CYSS HB2 1 1
85 1 1 1 1 2 CYS HB3 . 2 CYSS HB3 1 1
85 1 2 1 1 3 ALA HA . 3 ALA HA 1 1
86 1 1 1 1 13 GLY HA3 . 13 GLY HA3 1 1
86 1 2 1 1 14 CYS HB2 . 14 CYSS HB2 1 1
87 1 1 1 1 9 LYS QE . 9 LYS QE 1 1
87 1 2 1 1 13 GLY HA3 . 13 GLY HA3 1 1
88 1 1 1 1 8 LYS HA . 8 LYS HA 1 1
88 1 2 1 1 14 CYS HB2 . 14 CYSS HB2 1 1
89 1 1 1 1 2 CYS HB3 . 2 CYSS HB3 1 1
89 1 2 1 1 8 LYS HA . 8 LYS HA 1 1
90 1 1 1 1 2 CYS HB2 . 2 CYSS HB2 1 1
90 1 2 1 1 8 LYS HA . 8 LYS HA 1 1
91 1 1 1 1 2 CYS HB2 . 2 CYSS HB2 1 1
91 1 2 1 1 7 ARG HA . 7 ARG HA 1 1
92 1 1 1 1 2 CYS HB3 . 2 CYSS HB3 1 1
92 1 2 1 1 7 ARG HA . 7 ARG HA 1 1
93 1 1 1 1 6 CYS HA . 6 CYSS HA 1 1
93 1 2 1 1 16 CYS HB3 . 16 CYSS HB3 1 1
94 1 1 1 1 9 LYS HG2 . 9 LYS HG2 1 1
94 1 2 1 1 15 SER HB2 . 15 SER HB2 1 1
95 1 1 1 1 9 LYS HG2 . 9 LYS HG2 1 1
95 1 2 1 1 15 SER HB3 . 15 SER HB3 1 1
96 1 1 1 1 7 ARG HB3 . 7 ARG HB3 1 1
96 1 2 1 1 15 SER HB3 . 15 SER HB3 1 1
97 1 1 1 1 7 ARG HB2 . 7 ARG HB2 1 1
97 1 2 1 1 15 SER HB2 . 15 SER HB2 1 1
98 1 1 1 1 7 ARG HB2 . 7 ARG HB2 1 1
98 1 2 1 1 15 SER HB3 . 15 SER HB3 1 1
99 1 1 1 1 9 LYS HD3 . 9 LYS HD3 1 1
99 1 2 1 1 15 SER HB3 . 15 SER HB3 1 1
100 1 1 1 1 9 LYS HD3 . 9 LYS HD3 1 1
100 1 2 1 1 15 SER HB2 . 15 SER HB2 1 1
101 1 1 1 1 10 ARG HB2 . 10 ARG HB2 1 1
101 1 2 1 1 10 ARG QD . 10 ARG QD 1 1
102 1 1 1 1 7 ARG HB3 . 7 ARG HB3 1 1
102 1 2 1 1 15 SER HB2 . 15 SER HB2 1 1
103 1 1 1 1 9 LYS HB3 . 9 LYS HB3 1 1
103 1 2 1 1 15 SER HB2 . 15 SER HB2 1 1
104 1 1 1 1 9 LYS HD2 . 9 LYS HD2 1 1
104 1 2 1 1 13 GLY HA3 . 13 GLY HA3 1 1
105 1 1 1 1 9 LYS HD3 . 9 LYS HD3 1 1
105 1 2 1 1 13 GLY HA3 . 13 GLY HA3 1 1
106 1 1 1 1 9 LYS HB2 . 9 LYS HB2 1 1
106 1 2 1 1 13 GLY HA3 . 13 GLY HA3 1 1
107 1 1 1 1 3 ALA MB . 3 ALA QB 1 1
107 1 2 1 1 4 SER HA . 4 SER HA 1 1
108 1 1 1 1 9 LYS HA . 9 LYS HA 1 1
108 1 2 1 1 9 LYS HG2 . 9 LYS HG2 1 1
109 1 1 1 1 9 LYS HA . 9 LYS HA 1 1
109 1 2 1 1 9 LYS HG3 . 9 LYS HG3 1 1
110 1 1 1 1 8 LYS HA . 8 LYS HA 1 1
110 1 2 1 1 8 LYS HG2 . 8 LYS HG2 1 1
111 1 1 1 1 8 LYS HA . 8 LYS HA 1 1
111 1 2 1 1 8 LYS HG3 . 8 LYS HG3 1 1
112 1 1 1 1 7 ARG HA . 7 ARG HA 1 1
112 1 2 1 1 7 ARG HG2 . 7 ARG HG2 1 1
113 1 1 1 1 7 ARG HA . 7 ARG HA 1 1
113 1 2 1 1 7 ARG HG3 . 7 ARG HG3 1 1
114 1 1 1 1 2 CYS HA . 2 CYSS HA 1 1
114 1 2 1 1 3 ALA MB . 3 ALA QB 1 1
115 1 1 1 1 9 LYS HG3 . 9 LYS HG3 1 1
115 1 2 1 1 14 CYS HA . 14 CYSS HA 1 1
116 1 1 1 1 3 ALA MB . 3 ALA QB 1 1
116 1 2 1 1 4 SER QB . 4 SER QB 1 1
117 1 1 1 1 2 CYS HB3 . 2 CYSS HB3 1 1
117 1 2 1 1 6 CYS HB2 . 6 CYSS HB2 1 1
118 1 1 1 1 2 CYS HB2 . 2 CYSS HB2 1 1
118 1 2 1 1 6 CYS HB2 . 6 CYSS HB2 1 1
119 1 1 1 1 10 ARG HB3 . 10 ARG HB3 1 1
119 1 2 1 1 10 ARG QD . 10 ARG QD 1 1
120 1 1 1 1 9 LYS HB3 . 9 LYS HB3 1 1
120 1 2 1 1 9 LYS QE . 9 LYS QE 1 1
121 1 1 1 1 6 CYS HB3 . 6 CYSS HB3 1 1
121 1 2 1 1 14 CYS HB2 . 14 CYSS HB2 1 1
122 1 1 1 1 6 CYS HB3 . 6 CYSS HB3 1 1
122 1 2 1 1 14 CYS HB3 . 14 CYSS HB3 1 1
123 1 1 1 1 6 CYS HB3 . 6 CYSS HB3 1 1
123 1 2 1 1 15 SER H . 15 SER H 1 1
124 1 1 1 1 6 CYS HB2 . 6 CYSS HB2 1 1
124 1 2 1 1 14 CYS HB3 . 14 CYSS HB3 1 1
125 1 1 1 1 6 CYS HB2 . 6 CYSS HB2 1 1
125 1 2 1 1 14 CYS HB2 . 14 CYSS HB2 1 1
126 1 1 1 1 10 ARG HA . 10 ARG HA 1 1
126 1 2 1 1 10 ARG QD . 10 ARG QD 1 1
127 1 1 1 1 3 ALA MB . 3 ALA QB 1 1
127 1 2 1 1 6 CYS HB3 . 6 CYSS HB3 1 1
128 1 1 1 1 2 CYS HB3 . 2 CYSS HB3 1 1
128 1 2 1 1 3 ALA MB . 3 ALA QB 1 1
129 1 1 1 1 6 CYS HA . 6 CYSS HA 1 1
129 1 2 1 1 7 ARG HG2 . 7 ARG HG2 1 1
130 1 1 1 1 6 CYS HA . 6 CYSS HA 1 1
130 1 2 1 1 7 ARG HG3 . 7 ARG HG3 1 1
131 1 1 1 1 6 CYS HB3 . 6 CYSS HB3 1 1
131 1 2 1 1 14 CYS HA . 14 CYSS HA 1 1
132 1 1 1 1 2 CYS HB2 . 2 CYSS HB2 1 1
132 1 2 1 1 14 CYS HA . 14 CYSS HA 1 1
133 1 1 1 1 2 CYS HB3 . 2 CYSS HB3 1 1
133 1 2 1 1 14 CYS HA . 14 CYSS HA 1 1
134 1 1 1 1 14 CYS HA . 14 CYSS HA 1 1
134 1 2 1 1 15 SER HB2 . 15 SER HB2 1 1
135 1 1 1 1 14 CYS HA . 14 CYSS HA 1 1
135 1 2 1 1 15 SER HB3 . 15 SER HB3 1 1
136 1 1 1 1 9 LYS HD3 . 9 LYS HD3 1 1
136 1 2 1 1 15 SER HA . 15 SER HA 1 1
137 1 1 1 1 9 LYS HB3 . 9 LYS HB3 1 1
137 1 2 1 1 12 GLY H . 12 GLY H 1 1
138 1 1 1 1 9 LYS HB2 . 9 LYS HB2 1 1
138 1 2 1 1 12 GLY H . 12 GLY H 1 1
139 1 1 1 1 9 LYS HD3 . 9 LYS HD3 1 1
139 1 2 1 1 15 SER H . 15 SER H 1 1
140 1 1 1 1 9 LYS HG3 . 9 LYS HG3 1 1
140 1 2 1 1 15 SER H . 15 SER H 1 1
141 1 1 1 1 11 HIS HB3 . 11 HIS HB3 1 1
141 1 2 1 1 12 GLY H . 12 GLY H 1 1
142 1 1 1 1 11 HIS HB2 . 11 HIS HB2 1 1
142 1 2 1 1 12 GLY H . 12 GLY H 1 1
143 1 1 1 1 7 ARG H . 7 ARG H 1 1
143 1 2 1 1 14 CYS HB2 . 14 CYSS HB2 1 1
144 1 1 1 1 2 CYS HB3 . 2 CYSS HB3 1 1
144 1 2 1 1 5 GLY H . 5 GLY H 1 1
145 1 1 1 1 2 CYS HB3 . 2 CYSS HB3 1 1
145 1 2 1 1 7 ARG H . 7 ARG H 1 1
146 1 1 1 1 8 LYS HA . 8 LYS HA 1 1
146 1 2 1 1 15 SER H . 15 SER H 1 1
147 1 1 1 1 1 TRP HZ3 . 1 TRP HZ3 1 1
147 1 2 1 1 2 CYS HA . 2 CYSS HA 1 1
148 1 1 1 1 9 LYS H . 9 LYS H 1 1
148 1 2 1 1 15 SER H . 15 SER H 1 1
149 1 1 1 1 10 ARG HB3 . 10 ARG HB3 1 1
149 1 2 1 1 11 HIS HD2 . 11 HIS HD2 1 1
150 1 1 1 1 7 ARG H . 7 ARG H 1 1
150 1 2 1 1 7 ARG HD2 . 7 ARG HD2 1 1
151 1 1 1 1 7 ARG H . 7 ARG H 1 1
151 1 2 1 1 7 ARG HD3 . 7 ARG HD3 1 1
152 1 1 1 1 2 CYS HB2 . 2 CYSS HB2 1 1
152 1 2 1 1 6 CYS H . 6 CYSS H 1 1
153 1 1 1 1 15 SER HB3 . 15 SER HB3 1 1
153 1 2 1 1 16 CYS H . 16 CYSS H 1 1
154 1 1 1 1 15 SER HB2 . 15 SER HB2 1 1
154 1 2 1 1 16 CYS H . 16 CYSS H 1 1
155 1 1 1 1 6 CYS HB3 . 6 CYSS HB3 1 1
155 1 2 1 1 16 CYS H . 16 CYSS H 1 1
156 1 1 1 1 6 CYS HB2 . 6 CYSS HB2 1 1
156 1 2 1 1 16 CYS HA . 16 CYSS HA 1 1
157 1 1 1 1 2 CYS HA . 2 CYSS HA 1 1
157 1 2 1 1 14 CYS HB2 . 14 CYSS HB2 1 1
158 1 1 1 1 14 CYS HB2 . 14 CYSS HB2 1 1
158 1 2 1 1 15 SER HA . 15 SER HA 1 1
159 1 1 1 1 2 CYS HA . 2 CYSS HA 1 1
159 1 2 1 1 14 CYS HB3 . 14 CYSS HB3 1 1
160 1 1 1 1 7 ARG HA . 7 ARG HA 1 1
160 1 2 1 1 7 ARG HD2 . 7 ARG HD2 1 1
161 1 1 1 1 7 ARG HA . 7 ARG HA 1 1
161 1 2 1 1 7 ARG HD3 . 7 ARG HD3 1 1
162 1 1 1 1 8 LYS HA . 8 LYS HA 1 1
162 1 2 1 1 9 LYS HB2 . 9 LYS HB2 1 1
163 1 1 1 1 5 GLY QA . 5 GLY QA 1 1
163 1 2 1 1 6 CYS H . 6 CYSS H 1 1
164 1 1 1 1 7 ARG H . 7 ARG H 1 1
164 1 2 1 1 7 ARG QB . 7 ARG QB 1 1
165 1 1 1 1 7 ARG H . 7 ARG H 1 1
165 1 2 1 1 7 ARG QG . 7 ARG QG 1 1
166 1 1 1 1 7 ARG HA . 7 ARG HA 1 1
166 1 2 1 1 7 ARG QG . 7 ARG QG 1 1
167 1 1 1 1 7 ARG HA . 7 ARG HA 1 1
167 1 2 1 1 7 ARG QD . 7 ARG QD 1 1
168 1 1 1 1 7 ARG QB . 7 ARG QB 1 1
168 1 2 1 1 7 ARG QD . 7 ARG QD 1 1
169 1 1 1 1 7 ARG QB . 7 ARG QB 1 1
169 1 2 1 1 8 LYS H . 8 LYS H 1 1
170 1 1 1 1 7 ARG QB . 7 ARG QB 1 1
170 1 2 1 1 15 SER HB2 . 15 SER HB2 1 1
171 1 1 1 1 7 ARG QB . 7 ARG QB 1 1
171 1 2 1 1 15 SER HB3 . 15 SER HB3 1 1
172 1 1 1 1 7 ARG QG . 7 ARG QG 1 1
172 1 2 1 1 8 LYS H . 8 LYS H 1 1
173 1 1 1 1 8 LYS H . 8 LYS H 1 1
173 1 2 1 1 8 LYS QB . 8 LYS QB 1 1
174 1 1 1 1 8 LYS H . 8 LYS H 1 1
174 1 2 1 1 8 LYS QG . 8 LYS QG 1 1
175 1 1 1 1 8 LYS HA . 8 LYS HA 1 1
175 1 2 1 1 8 LYS QG . 8 LYS QG 1 1
176 1 1 1 1 8 LYS QB . 8 LYS QB 1 1
176 1 2 1 1 9 LYS H . 9 LYS H 1 1
177 1 1 1 1 8 LYS QG . 8 LYS QG 1 1
177 1 2 1 1 9 LYS H . 9 LYS H 1 1
178 1 1 1 1 10 ARG H . 10 ARG H 1 1
178 1 2 1 1 10 ARG QG . 10 ARG QG 1 1
179 1 1 1 1 10 ARG HA . 10 ARG HA 1 1
179 1 2 1 1 10 ARG QG . 10 ARG QG 1 1
180 1 1 1 1 10 ARG QB . 10 ARG QB 1 1
180 1 2 1 1 10 ARG QD . 10 ARG QD 1 1
181 1 1 1 1 10 ARG QB . 10 ARG QB 1 1
181 1 2 1 1 11 HIS H . 11 HIS H 1 1
182 1 1 1 1 10 ARG QB . 10 ARG QB 1 1
182 1 2 1 1 11 HIS HD2 . 11 HIS HD2 1 1
183 1 1 1 1 10 ARG QG . 10 ARG QG 1 1
183 1 2 1 1 11 HIS HD2 . 11 HIS HD2 1 1
184 1 1 1 1 12 GLY QA . 12 GLY QA 1 1
184 1 2 1 1 13 GLY H . 13 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 . . . . . . . 4.12 1 1
2 1 . . . . . . . 3.45 1 1
3 1 . . . . . . . 3.69 1 1
4 1 . . . . . . . 3.81 1 1
5 1 . . . . . . . 4.76 1 1
6 1 . . . . . . . 5.01 1 1
7 1 . . . . . . . 4.45 1 1
8 1 . . . . . . . 3.94 1 1
9 1 . . . . . . . 3.54 1 1
10 1 . . . . . . . 3.33 1 1
11 1 . . . . . . . 4.89 1 1
12 1 . . . . . . . 4.89 1 1
13 1 . . . . . . . 3.04 1 1
14 1 . . . . . . . 4.39 1 1
15 1 . . . . . . . 3.84 1 1
16 1 . . . . . . . 4.04 1 1
17 1 . . . . . . . 3.48 1 1
18 1 . . . . . . . 3.7 1 1
19 1 . . . . . . . 3.7 1 1
20 1 . . . . . . . 4.97 1 1
21 1 . . . . . . . 3.27 1 1
22 1 . . . . . . . 3.15 1 1
23 1 . . . . . . . 2.99 1 1
24 1 . . . . . . . 3.2 1 1
25 1 . . . . . . . 3.74 1 1
26 1 . . . . . . . 4.85 1 1
27 1 . . . . . . . 4.44 1 1
28 1 . . . . . . . 5.0 1 1
29 1 . . . . . . . 5.0 1 1
30 1 . . . . . . . 4.69 1 1
31 1 . . . . . . . 2.75 1 1
32 1 . . . . . . . 5.5 1 1
33 1 . . . . . . . 5.5 1 1
34 1 . . . . . . . 3.47 1 1
35 1 . . . . . . . 3.47 1 1
36 1 . . . . . . . 2.68 1 1
37 1 . . . . . . . 2.64 1 1
38 1 . . . . . . . 3.95 1 1
39 1 . . . . . . . 4.79 1 1
40 1 . . . . . . . 3.3 1 1
41 1 . . . . . . . 4.98 1 1
42 1 . . . . . . . 3.93 1 1
43 1 . . . . . . . 2.53 1 1
44 1 . . . . . . . 2.92 1 1
45 1 . . . . . . . 3.82 1 1
46 1 . . . . . . . 2.51 1 1
47 1 . . . . . . . 4.47 1 1
48 1 . . . . . . . 4.47 1 1
49 1 . . . . . . . 3.17 1 1
50 1 . . . . . . . 2.92 1 1
51 1 . . . . . . . 4.06 1 1
52 1 . . . . . . . 4.19 1 1
53 1 . . . . . . . 5.35 1 1
54 1 . . . . . . . 5.5 1 1
55 1 . . . . . . . 4.19 1 1
56 1 . . . . . . . 3.91 1 1
57 1 . . . . . . . 3.06 1 1
58 1 . . . . . . . 4.57 1 1
59 1 . . . . . . . 4.71 1 1
60 1 . . . . . . . 3.68 1 1
61 1 . . . . . . . 4.37 1 1
62 1 . . . . . . . 4.3 1 1
63 1 . . . . . . . 4.01 1 1
64 1 . . . . . . . 4.25 1 1
65 1 . . . . . . . 3.19 1 1
66 1 . . . . . . . 5.5 1 1
67 1 . . . . . . . 5.5 1 1
68 1 . . . . . . . 4.0 1 1
69 1 . . . . . . . 4.48 1 1
70 1 . . . . . . . 4.24 1 1
71 1 . . . . . . . 4.49 1 1
72 1 . . . . . . . 3.2 1 1
73 1 . . . . . . . 4.73 1 1
74 1 . . . . . . . 4.91 1 1
75 1 . . . . . . . 4.01 1 1
76 1 . . . . . . . 4.09 1 1
77 1 . . . . . . . 4.27 1 1
78 1 . . . . . . . 4.41 1 1
79 1 . . . . . . . 4.37 1 1
80 1 . . . . . . . 3.95 1 1
81 1 . . . . . . . 4.39 1 1
82 1 . . . . . . . 4.12 1 1
83 1 . . . . . . . 4.51 1 1
84 1 . . . . . . . 5.2 1 1
85 1 . . . . . . . 5.34 1 1
86 1 . . . . . . . 5.44 1 1
87 1 . . . . . . . 4.71 1 1
88 1 . . . . . . . 5.5 1 1
89 1 . . . . . . . 4.98 1 1
90 1 . . . . . . . 5.5 1 1
91 1 . . . . . . . 5.05 1 1
92 1 . . . . . . . 5.19 1 1
93 1 . . . . . . . 5.45 1 1
94 1 . . . . . . . 4.0 1 1
95 1 . . . . . . . 3.74 1 1
96 1 . . . . . . . 4.23 1 1
97 1 . . . . . . . 4.92 1 1
98 1 . . . . . . . 4.23 1 1
99 1 . . . . . . . 3.8 1 1
100 1 . . . . . . . 3.8 1 1
101 1 . . . . . . . 3.68 1 1
102 1 . . . . . . . 4.92 1 1
103 1 . . . . . . . 5.24 1 1
104 1 . . . . . . . 5.5 1 1
105 1 . . . . . . . 5.5 1 1
106 1 . . . . . . . 4.55 1 1
107 1 . . . . . . . 4.68 1 1
108 1 . . . . . . . 3.47 1 1
109 1 . . . . . . . 3.55 1 1
110 1 . . . . . . . 4.1 1 1
111 1 . . . . . . . 4.1 1 1
112 1 . . . . . . . 4.15 1 1
113 1 . . . . . . . 4.15 1 1
114 1 . . . . . . . 4.25 1 1
115 1 . . . . . . . 4.4 1 1
116 1 . . . . . . . 4.04 1 1
117 1 . . . . . . . 3.31 1 1
118 1 . . . . . . . 3.43 1 1
119 1 . . . . . . . 3.68 1 1
120 1 . . . . . . . 4.59 1 1
121 1 . . . . . . . 3.88 1 1
122 1 . . . . . . . 3.78 1 1
123 1 . . . . . . . 4.86 1 1
124 1 . . . . . . . 4.59 1 1
125 1 . . . . . . . 4.75 1 1
126 1 . . . . . . . 4.01 1 1
127 1 . . . . . . . 4.99 1 1
128 1 . . . . . . . 4.5 1 1
129 1 . . . . . . . 5.5 1 1
130 1 . . . . . . . 5.5 1 1
131 1 . . . . . . . 4.96 1 1
132 1 . . . . . . . 4.98 1 1
133 1 . . . . . . . 4.6 1 1
134 1 . . . . . . . 5.31 1 1
135 1 . . . . . . . 5.02 1 1
136 1 . . . . . . . 4.97 1 1
137 1 . . . . . . . 5.29 1 1
138 1 . . . . . . . 4.78 1 1
139 1 . . . . . . . 5.5 1 1
140 1 . . . . . . . 4.63 1 1
141 1 . . . . . . . 5.27 1 1
142 1 . . . . . . . 5.27 1 1
143 1 . . . . . . . 5.5 1 1
144 1 . . . . . . . 5.5 1 1
145 1 . . . . . . . 5.5 1 1
146 1 . . . . . . . 5.28 1 1
147 1 . . . . . . . 5.06 1 1
148 1 . . . . . . . 5.34 1 1
149 1 . . . . . . . 4.91 1 1
150 1 . . . . . . . 5.5 1 1
151 1 . . . . . . . 5.5 1 1
152 1 . . . . . . . 4.91 1 1
153 1 . . . . . . . 5.46 1 1
154 1 . . . . . . . 5.5 1 1
155 1 . . . . . . . 5.5 1 1
156 1 . . . . . . . 5.18 1 1
157 1 . . . . . . . 5.5 1 1
158 1 . . . . . . . 5.5 1 1
159 1 . . . . . . . 5.11 1 1
160 1 . . . . . . . 5.18 1 1
161 1 . . . . . . . 5.18 1 1
162 1 . . . . . . . 4.86 1 1
163 1 . . . . . . . 3.09 1 1
164 1 . . . . . . . 3.09 1 1
165 1 . . . . . . . 4.23 1 1
166 1 . . . . . . . 3.51 1 1
167 1 . . . . . . . 4.42 1 1
168 1 . . . . . . . 3.26 1 1
169 1 . . . . . . . 3.59 1 1
170 1 . . . . . . . 4.25 1 1
171 1 . . . . . . . 3.72 1 1
172 1 . . . . . . . 4.71 1 1
173 1 . . . . . . . 2.85 1 1
174 1 . . . . . . . 3.38 1 1
175 1 . . . . . . . 3.57 1 1
176 1 . . . . . . . 3.4 1 1
177 1 . . . . . . . 3.78 1 1
178 1 . . . . . . . 4.1 1 1
179 1 . . . . . . . 3.54 1 1
180 1 . . . . . . . 3.19 1 1
181 1 . . . . . . . 4.24 1 1
182 1 . . . . . . . 4.16 1 1
183 1 . . . . . . . 4.16 1 1
184 1 . . . . . . . 2.99 1 1
stop_
save_
save_DYANA/DIANA_distance_constraints_3_1
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID 1
_Distance_constraint_list.ID 2
_Distance_constraint_list.Constraint_type "general distance"
_Distance_constraint_list.Constraint_file_ID .
_Distance_constraint_list.Block_ID .
loop_
_Dist_constraint_tree.Constraint_ID
_Dist_constraint_tree.Node_ID
_Dist_constraint_tree.Down_node_ID
_Dist_constraint_tree.Right_node_ID
_Dist_constraint_tree.Logic_operation
_Dist_constraint_tree.Entry_ID
_Dist_constraint_tree.Distance_constraint_list_ID
1 1 . . . 1 2
2 1 . . . 1 2
3 1 . . . 1 2
4 1 . . . 1 2
5 1 . . . 1 2
6 1 . . . 1 2
stop_
loop_
_Dist_constraint.Tree_node_member_constraint_ID
_Dist_constraint.Tree_node_member_node_ID
_Dist_constraint.Constraint_tree_node_member_ID
_Dist_constraint.Entity_assembly_ID
_Dist_constraint.Entity_ID
_Dist_constraint.Comp_index_ID
_Dist_constraint.Comp_ID
_Dist_constraint.Atom_ID
_Dist_constraint.Auth_asym_ID
_Dist_constraint.Auth_seq_ID
_Dist_constraint.Auth_comp_ID
_Dist_constraint.Auth_atom_ID
_Dist_constraint.Entry_ID
_Dist_constraint.Distance_constraint_list_ID
1 1 1 1 1 2 CYS SG . 2 CYSS SG 1 2
1 1 2 1 1 14 CYS SG . 14 CYSS SG 1 2
2 1 1 1 1 2 CYS SG . 2 CYSS SG 1 2
2 1 2 1 1 14 CYS CB . 14 CYSS CB 1 2
3 1 1 1 1 2 CYS CB . 2 CYSS CB 1 2
3 1 2 1 1 14 CYS SG . 14 CYSS SG 1 2
4 1 1 1 1 6 CYS SG . 6 CYSS SG 1 2
4 1 2 1 1 16 CYS SG . 16 CYSS SG 1 2
5 1 1 1 1 6 CYS SG . 6 CYSS SG 1 2
5 1 2 1 1 16 CYS CB . 16 CYSS CB 1 2
6 1 1 1 1 6 CYS CB . 6 CYSS CB 1 2
6 1 2 1 1 16 CYS SG . 16 CYSS SG 1 2
stop_
loop_
_Dist_constraint_value.Constraint_ID
_Dist_constraint_value.Tree_node_ID
_Dist_constraint_value.Source_experiment_ID
_Dist_constraint_value.Spectral_peak_ID
_Dist_constraint_value.Intensity_val
_Dist_constraint_value.Intensity_lower_val_err
_Dist_constraint_value.Intensity_upper_val_err
_Dist_constraint_value.Distance_val
_Dist_constraint_value.Distance_lower_bound_val
_Dist_constraint_value.Distance_upper_bound_val
_Dist_constraint_value.Entry_ID
_Dist_constraint_value.Distance_constraint_list_ID
1 1 . . . . . . . 1.98 1 2
2 1 . . . . . . . 2.9 1 2
3 1 . . . . . . . 2.9 1 2
4 1 . . . . . . . 1.98 1 2
5 1 . . . . . . . 2.9 1 2
6 1 . . . . . . . 2.9 1 2
stop_
save_
save_DYANA/DIANA_dihedral_5
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID 1
_Torsion_angle_constraint_list.ID 1
_Torsion_angle_constraint_list.Constraint_file_ID .
_Torsion_angle_constraint_list.Block_ID .
loop_
_Torsion_angle_constraint.ID
_Torsion_angle_constraint.Torsion_angle_name
_Torsion_angle_constraint.Entity_assembly_ID_1
_Torsion_angle_constraint.Entity_ID_1
_Torsion_angle_constraint.Comp_index_ID_1
_Torsion_angle_constraint.Comp_ID_1
_Torsion_angle_constraint.Atom_ID_1
_Torsion_angle_constraint.Entity_assembly_ID_2
_Torsion_angle_constraint.Entity_ID_2
_Torsion_angle_constraint.Comp_index_ID_2
_Torsion_angle_constraint.Comp_ID_2
_Torsion_angle_constraint.Atom_ID_2
_Torsion_angle_constraint.Entity_assembly_ID_3
_Torsion_angle_constraint.Entity_ID_3
_Torsion_angle_constraint.Comp_index_ID_3
_Torsion_angle_constraint.Comp_ID_3
_Torsion_angle_constraint.Atom_ID_3
_Torsion_angle_constraint.Entity_assembly_ID_4
_Torsion_angle_constraint.Entity_ID_4
_Torsion_angle_constraint.Comp_index_ID_4
_Torsion_angle_constraint.Comp_ID_4
_Torsion_angle_constraint.Atom_ID_4
_Torsion_angle_constraint.Angle_lower_bound_val
_Torsion_angle_constraint.Angle_upper_bound_val
_Torsion_angle_constraint.Auth_asym_ID_1
_Torsion_angle_constraint.Auth_seq_ID_1
_Torsion_angle_constraint.Auth_comp_ID_1
_Torsion_angle_constraint.Auth_atom_ID_1
_Torsion_angle_constraint.Auth_asym_ID_2
_Torsion_angle_constraint.Auth_seq_ID_2
_Torsion_angle_constraint.Auth_comp_ID_2
_Torsion_angle_constraint.Auth_atom_ID_2
_Torsion_angle_constraint.Auth_asym_ID_3
_Torsion_angle_constraint.Auth_seq_ID_3
_Torsion_angle_constraint.Auth_comp_ID_3
_Torsion_angle_constraint.Auth_atom_ID_3
_Torsion_angle_constraint.Auth_asym_ID_4
_Torsion_angle_constraint.Auth_seq_ID_4
_Torsion_angle_constraint.Auth_comp_ID_4
_Torsion_angle_constraint.Auth_atom_ID_4
_Torsion_angle_constraint.Entry_ID
_Torsion_angle_constraint.Torsion_angle_constraint_list_ID
1 PHI 1 1 1 TRP C 1 1 2 CYS N 1 1 2 CYS CA 1 1 2 CYS C -158.0 -46.0 . 2 CYSS . . 2 CYSS . . 2 CYSS . . 2 CYSS . 1 1
2 PSI 1 1 2 CYS N 1 1 2 CYS CA 1 1 2 CYS C 1 1 3 ALA N 71.0 199.0 . 2 CYSS . . 2 CYSS . . 2 CYSS . . 2 CYSS . 1 1
3 PHI 1 1 2 CYS C 1 1 3 ALA N 1 1 3 ALA CA 1 1 3 ALA C -146.0 -42.0 . 3 ALA . . 3 ALA . . 3 ALA . . 3 ALA . 1 1
4 PSI 1 1 3 ALA N 1 1 3 ALA CA 1 1 3 ALA C 1 1 4 SER N 104.0 200.0 . 3 ALA . . 3 ALA . . 3 ALA . . 3 ALA . 1 1
5 PSI 1 1 4 SER N 1 1 4 SER CA 1 1 4 SER C 1 1 5 GLY N -59.0 33.0 . 4 SER . . 4 SER . . 4 SER . . 4 SER . 1 1
6 PHI 1 1 4 SER C 1 1 5 GLY N 1 1 5 GLY CA 1 1 5 GLY C 47.0 107.0 . 5 GLY . . 5 GLY . . 5 GLY . . 5 GLY . 1 1
7 PSI 1 1 5 GLY N 1 1 5 GLY CA 1 1 5 GLY C 1 1 6 CYS N -20.0 56.0 . 5 GLY . . 5 GLY . . 5 GLY . . 5 GLY . 1 1
8 PHI 1 1 5 GLY C 1 1 6 CYS N 1 1 6 CYS CA 1 1 6 CYS C -177.0 -53.0 . 6 CYSS . . 6 CYSS . . 6 CYSS . . 6 CYSS . 1 1
9 PSI 1 1 6 CYS N 1 1 6 CYS CA 1 1 6 CYS C 1 1 7 ARG N 125.0 177.0 . 6 CYSS . . 6 CYSS . . 6 CYSS . . 6 CYSS . 1 1
10 PHI 1 1 6 CYS C 1 1 7 ARG N 1 1 7 ARG CA 1 1 7 ARG C -174.99998 -91.0 . 7 ARG . . 7 ARG . . 7 ARG . . 7 ARG . 1 1
11 PSI 1 1 7 ARG N 1 1 7 ARG CA 1 1 7 ARG C 1 1 8 LYS N 88.0 191.99998 . 7 ARG . . 7 ARG . . 7 ARG . . 7 ARG . 1 1
12 PHI 1 1 7 ARG C 1 1 8 LYS N 1 1 8 LYS CA 1 1 8 LYS C -156.0 -40.0 . 8 LYS . . 8 LYS . . 8 LYS . . 8 LYS . 1 1
13 PSI 1 1 8 LYS N 1 1 8 LYS CA 1 1 8 LYS C 1 1 9 LYS N 82.0 182.0 . 8 LYS . . 8 LYS . . 8 LYS . . 8 LYS . 1 1
14 PHI 1 1 8 LYS C 1 1 9 LYS N 1 1 9 LYS CA 1 1 9 LYS C -137.0 -41.0 . 9 LYS . . 9 LYS . . 9 LYS . . 9 LYS . 1 1
15 PSI 1 1 9 LYS N 1 1 9 LYS CA 1 1 9 LYS C 1 1 10 ARG N 98.0 178.0 . 9 LYS . . 9 LYS . . 9 LYS . . 9 LYS . 1 1
16 PHI 1 1 9 LYS C 1 1 10 ARG N 1 1 10 ARG CA 1 1 10 ARG C -68.0 -56.0 . 10 ARG . . 10 ARG . . 10 ARG . . 10 ARG . 1 1
17 PSI 1 1 10 ARG N 1 1 10 ARG CA 1 1 10 ARG C 1 1 11 HIS N -46.0 -10.0 . 10 ARG . . 10 ARG . . 10 ARG . . 10 ARG . 1 1
18 PHI 1 1 10 ARG C 1 1 11 HIS N 1 1 11 HIS CA 1 1 11 HIS C -110.0 -61.999996 . 11 HIS . . 11 HIS . . 11 HIS . . 11 HIS . 1 1
19 PSI 1 1 11 HIS N 1 1 11 HIS CA 1 1 11 HIS C 1 1 12 GLY N -22.0 22.0 . 11 HIS . . 11 HIS . . 11 HIS . . 11 HIS . 1 1
20 PHI 1 1 11 HIS C 1 1 12 GLY N 1 1 12 GLY CA 1 1 12 GLY C 77.0 105.0 . 12 GLY . . 12 GLY . . 12 GLY . . 12 GLY . 1 1
21 PSI 1 1 12 GLY N 1 1 12 GLY CA 1 1 12 GLY C 1 1 13 GLY N -21.0 7.0 . 12 GLY . . 12 GLY . . 12 GLY . . 12 GLY . 1 1
22 PHI 1 1 12 GLY C 1 1 13 GLY N 1 1 13 GLY CA 1 1 13 GLY C -154.0 -50.0 . 13 GLY . . 13 GLY . . 13 GLY . . 13 GLY . 1 1
23 PSI 1 1 13 GLY N 1 1 13 GLY CA 1 1 13 GLY C 1 1 14 CYS N 44.0 191.99998 . 13 GLY . . 13 GLY . . 13 GLY . . 13 GLY . 1 1
24 PHI 1 1 13 GLY C 1 1 14 CYS N 1 1 14 CYS CA 1 1 14 CYS C -181.0 -44.999996 . 14 CYSS . . 14 CYSS . . 14 CYSS . . 14 CYSS . 1 1
25 PSI 1 1 14 CYS N 1 1 14 CYS CA 1 1 14 CYS C 1 1 15 SER N 74.0 182.0 . 14 CYSS . . 14 CYSS . . 14 CYSS . . 14 CYSS . 1 1
26 PHI 1 1 14 CYS C 1 1 15 SER N 1 1 15 SER CA 1 1 15 SER C -154.0 -38.0 . 15 SER . . 15 SER . . 15 SER . . 15 SER . 1 1
27 PSI 1 1 15 SER N 1 1 15 SER CA 1 1 15 SER C 1 1 16 CYS N 82.0 178.0 . 15 SER . . 15 SER . . 15 SER . . 15 SER . 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 1.688 -1.172 -2.130 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 3.591 -0.064 -0.943 1.00 . A A . 1 TRP CB 1 1
1 4 1 1 1 TRP CD1 C 5.111 1.154 -2.609 1.00 . A A . 1 TRP CD1 1 1
1 5 1 1 1 TRP CD2 C 4.727 -0.994 -3.113 1.00 . A A . 1 TRP CD2 1 1
1 6 1 1 1 TRP CE2 C 5.570 -0.444 -4.100 1.00 . A A . 1 TRP CE2 1 1
1 7 1 1 1 TRP CE3 C 4.351 -2.336 -3.221 1.00 . A A . 1 TRP CE3 1 1
1 8 1 1 1 TRP CG C 4.446 0.045 -2.169 1.00 . A A . 1 TRP CG 1 1
1 9 1 1 1 TRP CH2 C 5.655 -2.501 -5.257 1.00 . A A . 1 TRP CH2 1 1
1 10 1 1 1 TRP CZ2 C 6.039 -1.190 -5.177 1.00 . A A . 1 TRP CZ2 1 1
1 11 1 1 1 TRP CZ3 C 4.818 -3.075 -4.291 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 1.877 0.922 -1.763 1.00 . A A . 1 TRP HA 1 1
1 14 1 1 1 TRP HB2 H 3.854 0.746 -0.280 1.00 . A A . 1 TRP HB2 1 1
1 15 1 1 1 TRP HB3 H 3.814 -1.006 -0.463 1.00 . A A . 1 TRP HB3 1 1
1 16 1 1 1 TRP HD1 H 5.095 2.110 -2.109 1.00 . A A . 1 TRP HD1 1 1
1 17 1 1 1 TRP HE1 H 6.339 1.499 -4.277 1.00 . A A . 1 TRP HE1 1 1
1 18 1 1 1 TRP HE3 H 3.707 -2.796 -2.486 1.00 . A A . 1 TRP HE3 1 1
1 19 1 1 1 TRP HH2 H 5.995 -3.116 -6.077 1.00 . A A . 1 TRP HH2 1 1
1 20 1 1 1 TRP HZ2 H 6.685 -0.763 -5.930 1.00 . A A . 1 TRP HZ2 1 1
1 21 1 1 1 TRP HZ3 H 4.537 -4.113 -4.391 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 5.788 0.867 -3.770 1.00 . A A . 1 TRP NE1 1 1
1 24 1 1 1 TRP O O 1.604 -2.311 -1.672 1.00 . A A . 1 TRP O 1 1
1 25 1 1 2 CYS C C 1.930 -1.880 -5.596 1.00 . A A . 2 CYS C 1 1
1 26 1 1 2 CYS CA C 1.041 -1.915 -4.356 1.00 . A A . 2 CYS CA 1 1
1 27 1 1 2 CYS CB C -0.423 -1.729 -4.760 1.00 . A A . 2 CYS CB 1 1
1 28 1 1 2 CYS H H 1.521 0.043 -3.710 1.00 . A A . 2 CYS H 1 1
1 29 1 1 2 CYS HA H 1.153 -2.874 -3.874 1.00 . A A . 2 CYS HA 1 1
1 30 1 1 2 CYS HB2 H -0.676 -0.681 -4.695 1.00 . A A . 2 CYS HB2 1 1
1 31 1 1 2 CYS HB3 H -0.552 -2.063 -5.779 1.00 . A A . 2 CYS HB3 1 1
1 32 1 1 2 CYS N N 1.437 -0.885 -3.403 1.00 . A A . 2 CYS N 1 1
1 33 1 1 2 CYS O O 2.672 -0.922 -5.814 1.00 . A A . 2 CYS O 1 1
1 34 1 1 2 CYS SG S -1.604 -2.648 -3.720 1.00 . A A . 2 CYS SG 1 1
1 35 1 1 3 ALA C C 2.355 -1.850 -8.555 1.00 . A A . 3 ALA C 1 1
1 36 1 1 3 ALA CA C 2.646 -3.022 -7.622 1.00 . A A . 3 ALA CA 1 1
1 37 1 1 3 ALA CB C 2.379 -4.341 -8.331 1.00 . A A . 3 ALA CB 1 1
1 38 1 1 3 ALA H H 1.241 -3.665 -6.176 1.00 . A A . 3 ALA H 1 1
1 39 1 1 3 ALA HA H 3.689 -2.996 -7.342 1.00 . A A . 3 ALA HA 1 1
1 40 1 1 3 ALA HB1 H 3.087 -4.465 -9.137 1.00 . A A . 3 ALA HB1 1 1
1 41 1 1 3 ALA HB2 H 2.486 -5.155 -7.629 1.00 . A A . 3 ALA HB2 1 1
1 42 1 1 3 ALA HB3 H 1.376 -4.339 -8.730 1.00 . A A . 3 ALA HB3 1 1
1 43 1 1 3 ALA N N 1.850 -2.932 -6.404 1.00 . A A . 3 ALA N 1 1
1 44 1 1 3 ALA O O 1.201 -1.463 -8.740 1.00 . A A . 3 ALA O 1 1
1 45 1 1 4 SER C C 2.478 0.970 -9.394 1.00 . A A . 4 SER C 1 1
1 46 1 1 4 SER CA C 3.267 -0.159 -10.049 1.00 . A A . 4 SER CA 1 1
1 47 1 1 4 SER CB C 2.573 -0.600 -11.339 1.00 . A A . 4 SER CB 1 1
1 48 1 1 4 SER H H 4.304 -1.644 -8.951 1.00 . A A . 4 SER H 1 1
1 49 1 1 4 SER HA H 4.257 0.201 -10.287 1.00 . A A . 4 SER HA 1 1
1 50 1 1 4 SER HB2 H 2.807 -1.635 -11.535 1.00 . A A . 4 SER HB2 1 1
1 51 1 1 4 SER HB3 H 1.505 -0.487 -11.227 1.00 . A A . 4 SER HB3 1 1
1 52 1 1 4 SER HG H 2.303 0.220 -13.098 1.00 . A A . 4 SER HG 1 1
1 53 1 1 4 SER N N 3.409 -1.290 -9.139 1.00 . A A . 4 SER N 1 1
1 54 1 1 4 SER O O 1.752 1.705 -10.062 1.00 . A A . 4 SER O 1 1
1 55 1 1 4 SER OG O 3.002 0.181 -12.441 1.00 . A A . 4 SER OG 1 1
1 56 1 1 5 GLY C C 0.414 2.005 -7.460 1.00 . A A . 5 GLY C 1 1
1 57 1 1 5 GLY CA C 1.920 2.142 -7.353 1.00 . A A . 5 GLY CA 1 1
1 58 1 1 5 GLY H H 3.217 0.486 -7.597 1.00 . A A . 5 GLY H 1 1
1 59 1 1 5 GLY HA2 H 2.203 2.095 -6.312 1.00 . A A . 5 GLY HA2 1 1
1 60 1 1 5 GLY HA3 H 2.212 3.103 -7.752 1.00 . A A . 5 GLY HA3 1 1
1 61 1 1 5 GLY N N 2.625 1.101 -8.079 1.00 . A A . 5 GLY N 1 1
1 62 1 1 5 GLY O O -0.319 2.978 -7.283 1.00 . A A . 5 GLY O 1 1
1 63 1 1 6 CYS C C -2.225 0.942 -6.618 1.00 . A A . 6 CYS C 1 1
1 64 1 1 6 CYS CA C -1.477 0.533 -7.884 1.00 . A A . 6 CYS CA 1 1
1 65 1 1 6 CYS CB C -1.720 -0.949 -8.177 1.00 . A A . 6 CYS CB 1 1
1 66 1 1 6 CYS H H 0.586 0.058 -7.881 1.00 . A A . 6 CYS H 1 1
1 67 1 1 6 CYS HA H -1.846 1.120 -8.711 1.00 . A A . 6 CYS HA 1 1
1 68 1 1 6 CYS HB2 H -0.970 -1.536 -7.669 1.00 . A A . 6 CYS HB2 1 1
1 69 1 1 6 CYS HB3 H -2.697 -1.225 -7.808 1.00 . A A . 6 CYS HB3 1 1
1 70 1 1 6 CYS N N -0.049 0.794 -7.752 1.00 . A A . 6 CYS N 1 1
1 71 1 1 6 CYS O O -1.617 1.370 -5.637 1.00 . A A . 6 CYS O 1 1
1 72 1 1 6 CYS SG S -1.653 -1.378 -9.946 1.00 . A A . 6 CYS SG 1 1
1 73 1 1 7 ARG C C -4.694 -0.068 -4.659 1.00 . A A . 7 ARG C 1 1
1 74 1 1 7 ARG CA C -4.377 1.162 -5.505 1.00 . A A . 7 ARG CA 1 1
1 75 1 1 7 ARG CB C -5.676 1.819 -5.976 1.00 . A A . 7 ARG CB 1 1
1 76 1 1 7 ARG CD C -5.840 4.037 -4.805 1.00 . A A . 7 ARG CD 1 1
1 77 1 1 7 ARG CG C -5.576 3.328 -6.125 1.00 . A A . 7 ARG CG 1 1
1 78 1 1 7 ARG CZ C -5.350 6.393 -5.311 1.00 . A A . 7 ARG CZ 1 1
1 79 1 1 7 ARG H H -3.973 0.459 -7.460 1.00 . A A . 7 ARG H 1 1
1 80 1 1 7 ARG HA H -3.826 1.867 -4.901 1.00 . A A . 7 ARG HA 1 1
1 81 1 1 7 ARG HB2 H -5.950 1.402 -6.934 1.00 . A A . 7 ARG HB2 1 1
1 82 1 1 7 ARG HB3 H -6.455 1.601 -5.261 1.00 . A A . 7 ARG HB3 1 1
1 83 1 1 7 ARG HD2 H -6.641 3.527 -4.292 1.00 . A A . 7 ARG HD2 1 1
1 84 1 1 7 ARG HD3 H -4.944 3.996 -4.205 1.00 . A A . 7 ARG HD3 1 1
1 85 1 1 7 ARG HE H -7.162 5.669 -4.894 1.00 . A A . 7 ARG HE 1 1
1 86 1 1 7 ARG HG2 H -4.583 3.582 -6.464 1.00 . A A . 7 ARG HG2 1 1
1 87 1 1 7 ARG HG3 H -6.303 3.658 -6.852 1.00 . A A . 7 ARG HG3 1 1
1 88 1 1 7 ARG HH11 H -3.746 5.165 -5.341 1.00 . A A . 7 ARG HH11 1 1
1 89 1 1 7 ARG HH12 H -3.415 6.828 -5.696 1.00 . A A . 7 ARG HH12 1 1
1 90 1 1 7 ARG HH21 H -6.738 7.861 -5.360 1.00 . A A . 7 ARG HH21 1 1
1 91 1 1 7 ARG HH22 H -5.117 8.361 -5.706 1.00 . A A . 7 ARG HH22 1 1
1 92 1 1 7 ARG N N -3.546 0.806 -6.649 1.00 . A A . 7 ARG N 1 1
1 93 1 1 7 ARG NE N -6.217 5.435 -5.001 1.00 . A A . 7 ARG NE 1 1
1 94 1 1 7 ARG NH1 N -4.065 6.105 -5.461 1.00 . A A . 7 ARG NH1 1 1
1 95 1 1 7 ARG NH2 N -5.770 7.641 -5.473 1.00 . A A . 7 ARG NH2 1 1
1 96 1 1 7 ARG O O -4.912 -1.159 -5.187 1.00 . A A . 7 ARG O 1 1
1 97 1 1 8 LYS C C -6.512 -1.207 -2.308 1.00 . A A . 8 LYS C 1 1
1 98 1 1 8 LYS CA C -5.009 -0.978 -2.423 1.00 . A A . 8 LYS CA 1 1
1 99 1 1 8 LYS CB C -4.420 -0.680 -1.043 1.00 . A A . 8 LYS CB 1 1
1 100 1 1 8 LYS CD C -2.428 -0.802 0.483 1.00 . A A . 8 LYS CD 1 1
1 101 1 1 8 LYS CE C -2.207 0.703 0.505 1.00 . A A . 8 LYS CE 1 1
1 102 1 1 8 LYS CG C -3.030 -1.257 -0.836 1.00 . A A . 8 LYS CG 1 1
1 103 1 1 8 LYS H H -4.536 1.009 -2.982 1.00 . A A . 8 LYS H 1 1
1 104 1 1 8 LYS HA H -4.549 -1.873 -2.816 1.00 . A A . 8 LYS HA 1 1
1 105 1 1 8 LYS HB2 H -4.366 0.391 -0.911 1.00 . A A . 8 LYS HB2 1 1
1 106 1 1 8 LYS HB3 H -5.075 -1.094 -0.289 1.00 . A A . 8 LYS HB3 1 1
1 107 1 1 8 LYS HD2 H -3.099 -1.067 1.286 1.00 . A A . 8 LYS HD2 1 1
1 108 1 1 8 LYS HD3 H -1.479 -1.298 0.625 1.00 . A A . 8 LYS HD3 1 1
1 109 1 1 8 LYS HE2 H -1.683 0.990 -0.394 1.00 . A A . 8 LYS HE2 1 1
1 110 1 1 8 LYS HE3 H -3.169 1.194 0.533 1.00 . A A . 8 LYS HE3 1 1
1 111 1 1 8 LYS HG2 H -3.094 -2.335 -0.837 1.00 . A A . 8 LYS HG2 1 1
1 112 1 1 8 LYS HG3 H -2.392 -0.931 -1.645 1.00 . A A . 8 LYS HG3 1 1
1 113 1 1 8 LYS HZ1 H -1.319 2.166 1.703 1.00 . A A . 8 LYS HZ1 1 1
1 114 1 1 8 LYS HZ2 H -0.460 0.710 1.649 1.00 . A A . 8 LYS HZ2 1 1
1 115 1 1 8 LYS HZ3 H -1.878 0.821 2.564 1.00 . A A . 8 LYS HZ3 1 1
1 116 1 1 8 LYS N N -4.718 0.115 -3.343 1.00 . A A . 8 LYS N 1 1
1 117 1 1 8 LYS NZ N -1.410 1.129 1.688 1.00 . A A . 8 LYS NZ 1 1
1 118 1 1 8 LYS O O -7.308 -0.289 -2.509 1.00 . A A . 8 LYS O 1 1
1 119 1 1 9 LYS C C -8.556 -3.489 -0.508 1.00 . A A . 9 LYS C 1 1
1 120 1 1 9 LYS CA C -8.304 -2.787 -1.838 1.00 . A A . 9 LYS CA 1 1
1 121 1 1 9 LYS CB C -8.749 -3.685 -2.994 1.00 . A A . 9 LYS CB 1 1
1 122 1 1 9 LYS CD C -8.658 -4.182 -5.455 1.00 . A A . 9 LYS CD 1 1
1 123 1 1 9 LYS CE C -8.001 -5.539 -5.255 1.00 . A A . 9 LYS CE 1 1
1 124 1 1 9 LYS CG C -8.270 -3.208 -4.354 1.00 . A A . 9 LYS CG 1 1
1 125 1 1 9 LYS H H -6.214 -3.126 -1.835 1.00 . A A . 9 LYS H 1 1
1 126 1 1 9 LYS HA H -8.877 -1.872 -1.862 1.00 . A A . 9 LYS HA 1 1
1 127 1 1 9 LYS HB2 H -8.364 -4.681 -2.829 1.00 . A A . 9 LYS HB2 1 1
1 128 1 1 9 LYS HB3 H -9.829 -3.723 -3.009 1.00 . A A . 9 LYS HB3 1 1
1 129 1 1 9 LYS HD2 H -9.730 -4.309 -5.449 1.00 . A A . 9 LYS HD2 1 1
1 130 1 1 9 LYS HD3 H -8.346 -3.777 -6.407 1.00 . A A . 9 LYS HD3 1 1
1 131 1 1 9 LYS HE2 H -7.772 -5.959 -6.223 1.00 . A A . 9 LYS HE2 1 1
1 132 1 1 9 LYS HE3 H -7.086 -5.403 -4.697 1.00 . A A . 9 LYS HE3 1 1
1 133 1 1 9 LYS HG2 H -8.714 -2.247 -4.566 1.00 . A A . 9 LYS HG2 1 1
1 134 1 1 9 LYS HG3 H -7.194 -3.113 -4.333 1.00 . A A . 9 LYS HG3 1 1
1 135 1 1 9 LYS HZ1 H -9.193 -7.250 -5.143 1.00 . A A . 9 LYS HZ1 1 1
1 136 1 1 9 LYS HZ2 H -9.726 -5.979 -4.163 1.00 . A A . 9 LYS HZ2 1 1
1 137 1 1 9 LYS HZ3 H -8.376 -6.889 -3.706 1.00 . A A . 9 LYS HZ3 1 1
1 138 1 1 9 LYS N N -6.896 -2.437 -1.983 1.00 . A A . 9 LYS N 1 1
1 139 1 1 9 LYS NZ N -8.886 -6.480 -4.515 1.00 . A A . 9 LYS NZ 1 1
1 140 1 1 9 LYS O O -7.622 -3.959 0.143 1.00 . A A . 9 LYS O 1 1
1 141 1 1 10 ARG C C -9.691 -5.643 1.183 1.00 . A A . 10 ARG C 1 1
1 142 1 1 10 ARG CA C -10.196 -4.204 1.142 1.00 . A A . 10 ARG CA 1 1
1 143 1 1 10 ARG CB C -11.715 -4.180 1.319 1.00 . A A . 10 ARG CB 1 1
1 144 1 1 10 ARG CD C -13.507 -3.444 2.920 1.00 . A A . 10 ARG CD 1 1
1 145 1 1 10 ARG CG C -12.158 -4.130 2.772 1.00 . A A . 10 ARG CG 1 1
1 146 1 1 10 ARG CZ C -12.917 -1.436 4.210 1.00 . A A . 10 ARG CZ 1 1
1 147 1 1 10 ARG H H -10.522 -3.165 -0.673 1.00 . A A . 10 ARG H 1 1
1 148 1 1 10 ARG HA H -9.739 -3.652 1.949 1.00 . A A . 10 ARG HA 1 1
1 149 1 1 10 ARG HB2 H -12.111 -3.311 0.815 1.00 . A A . 10 ARG HB2 1 1
1 150 1 1 10 ARG HB3 H -12.132 -5.068 0.869 1.00 . A A . 10 ARG HB3 1 1
1 151 1 1 10 ARG HD2 H -14.092 -3.634 2.033 1.00 . A A . 10 ARG HD2 1 1
1 152 1 1 10 ARG HD3 H -14.013 -3.856 3.780 1.00 . A A . 10 ARG HD3 1 1
1 153 1 1 10 ARG HE H -13.631 -1.425 2.348 1.00 . A A . 10 ARG HE 1 1
1 154 1 1 10 ARG HG2 H -12.237 -5.138 3.150 1.00 . A A . 10 ARG HG2 1 1
1 155 1 1 10 ARG HG3 H -11.422 -3.585 3.344 1.00 . A A . 10 ARG HG3 1 1
1 156 1 1 10 ARG HH11 H -12.627 -3.185 5.179 1.00 . A A . 10 ARG HH11 1 1
1 157 1 1 10 ARG HH12 H -12.214 -1.762 6.077 1.00 . A A . 10 ARG HH12 1 1
1 158 1 1 10 ARG HH21 H -13.091 0.456 3.520 1.00 . A A . 10 ARG HH21 1 1
1 159 1 1 10 ARG HH22 H -12.480 0.309 5.133 1.00 . A A . 10 ARG HH22 1 1
1 160 1 1 10 ARG N N -9.822 -3.558 -0.111 1.00 . A A . 10 ARG N 1 1
1 161 1 1 10 ARG NE N -13.371 -2.000 3.097 1.00 . A A . 10 ARG NE 1 1
1 162 1 1 10 ARG NH1 N -12.557 -2.189 5.240 1.00 . A A . 10 ARG NH1 1 1
1 163 1 1 10 ARG NH2 N -12.821 -0.115 4.295 1.00 . A A . 10 ARG NH2 1 1
1 164 1 1 10 ARG O O -9.206 -6.113 2.213 1.00 . A A . 10 ARG O 1 1
1 165 1 1 11 HIS C C -7.862 -7.831 0.210 1.00 . A A . 11 HIS C 1 1
1 166 1 1 11 HIS CA C -9.364 -7.725 -0.036 1.00 . A A . 11 HIS CA 1 1
1 167 1 1 11 HIS CB C -9.709 -8.303 -1.409 1.00 . A A . 11 HIS CB 1 1
1 168 1 1 11 HIS CD2 C -12.214 -8.437 -0.749 1.00 . A A . 11 HIS CD2 1 1
1 169 1 1 11 HIS CE1 C -12.947 -9.542 -2.496 1.00 . A A . 11 HIS CE1 1 1
1 170 1 1 11 HIS CG C -11.154 -8.670 -1.557 1.00 . A A . 11 HIS CG 1 1
1 171 1 1 11 HIS H H -10.202 -5.910 -0.731 1.00 . A A . 11 HIS H 1 1
1 172 1 1 11 HIS HA H -9.881 -8.291 0.724 1.00 . A A . 11 HIS HA 1 1
1 173 1 1 11 HIS HB2 H -9.473 -7.573 -2.169 1.00 . A A . 11 HIS HB2 1 1
1 174 1 1 11 HIS HB3 H -9.121 -9.194 -1.576 1.00 . A A . 11 HIS HB3 1 1
1 175 1 1 11 HIS HD1 H -11.120 -9.680 -3.406 1.00 . A A . 11 HIS HD1 1 1
1 176 1 1 11 HIS HD2 H -12.198 -7.913 0.197 1.00 . A A . 11 HIS HD2 1 1
1 177 1 1 11 HIS HE1 H -13.598 -10.052 -3.190 1.00 . A A . 11 HIS HE1 1 1
1 178 1 1 11 HIS N N -9.808 -6.339 0.056 1.00 . A A . 11 HIS N 1 1
1 179 1 1 11 HIS ND1 N -11.646 -9.365 -2.642 1.00 . A A . 11 HIS ND1 1 1
1 180 1 1 11 HIS NE2 N -13.317 -8.988 -1.355 1.00 . A A . 11 HIS NE2 1 1
1 181 1 1 11 HIS O O -7.352 -8.899 0.547 1.00 . A A . 11 HIS O 1 1
1 182 1 1 12 GLY C C -4.948 -6.668 -1.059 1.00 . A A . 12 GLY C 1 1
1 183 1 1 12 GLY CA C -5.722 -6.706 0.245 1.00 . A A . 12 GLY CA 1 1
1 184 1 1 12 GLY H H -7.618 -5.894 -0.232 1.00 . A A . 12 GLY H 1 1
1 185 1 1 12 GLY HA2 H -5.460 -5.839 0.833 1.00 . A A . 12 GLY HA2 1 1
1 186 1 1 12 GLY HA3 H -5.442 -7.596 0.789 1.00 . A A . 12 GLY HA3 1 1
1 187 1 1 12 GLY N N -7.158 -6.716 0.038 1.00 . A A . 12 GLY N 1 1
1 188 1 1 12 GLY O O -3.766 -6.329 -1.077 1.00 . A A . 12 GLY O 1 1
1 189 1 1 13 GLY C C -4.705 -5.616 -3.966 1.00 . A A . 13 GLY C 1 1
1 190 1 1 13 GLY CA C -4.970 -7.017 -3.451 1.00 . A A . 13 GLY CA 1 1
1 191 1 1 13 GLY H H -6.560 -7.279 -2.078 1.00 . A A . 13 GLY H 1 1
1 192 1 1 13 GLY HA2 H -4.030 -7.544 -3.373 1.00 . A A . 13 GLY HA2 1 1
1 193 1 1 13 GLY HA3 H -5.603 -7.534 -4.157 1.00 . A A . 13 GLY HA3 1 1
1 194 1 1 13 GLY N N -5.618 -7.018 -2.153 1.00 . A A . 13 GLY N 1 1
1 195 1 1 13 GLY O O -4.823 -4.641 -3.223 1.00 . A A . 13 GLY O 1 1
1 196 1 1 14 CYS C C -4.834 -4.059 -7.160 1.00 . A A . 14 CYS C 1 1
1 197 1 1 14 CYS CA C -4.061 -4.223 -5.855 1.00 . A A . 14 CYS CA 1 1
1 198 1 1 14 CYS CB C -2.560 -4.079 -6.117 1.00 . A A . 14 CYS CB 1 1
1 199 1 1 14 CYS H H -4.268 -6.328 -5.783 1.00 . A A . 14 CYS H 1 1
1 200 1 1 14 CYS HA H -4.372 -3.452 -5.167 1.00 . A A . 14 CYS HA 1 1
1 201 1 1 14 CYS HB2 H -2.277 -4.744 -6.920 1.00 . A A . 14 CYS HB2 1 1
1 202 1 1 14 CYS HB3 H -2.350 -3.061 -6.410 1.00 . A A . 14 CYS HB3 1 1
1 203 1 1 14 CYS N N -4.345 -5.514 -5.241 1.00 . A A . 14 CYS N 1 1
1 204 1 1 14 CYS O O -4.928 -4.990 -7.960 1.00 . A A . 14 CYS O 1 1
1 205 1 1 14 CYS SG S -1.513 -4.471 -4.679 1.00 . A A . 14 CYS SG 1 1
1 206 1 1 15 SER C C -5.283 -1.903 -9.626 1.00 . A A . 15 SER C 1 1
1 207 1 1 15 SER CA C -6.155 -2.582 -8.574 1.00 . A A . 15 SER CA 1 1
1 208 1 1 15 SER CB C -7.356 -1.695 -8.241 1.00 . A A . 15 SER CB 1 1
1 209 1 1 15 SER H H -5.277 -2.166 -6.694 1.00 . A A . 15 SER H 1 1
1 210 1 1 15 SER HA H -6.512 -3.521 -8.971 1.00 . A A . 15 SER HA 1 1
1 211 1 1 15 SER HB2 H -8.101 -2.280 -7.724 1.00 . A A . 15 SER HB2 1 1
1 212 1 1 15 SER HB3 H -7.034 -0.881 -7.608 1.00 . A A . 15 SER HB3 1 1
1 213 1 1 15 SER HG H -8.686 -0.607 -9.182 1.00 . A A . 15 SER HG 1 1
1 214 1 1 15 SER N N -5.387 -2.868 -7.369 1.00 . A A . 15 SER N 1 1
1 215 1 1 15 SER O O -4.709 -0.841 -9.383 1.00 . A A . 15 SER O 1 1
1 216 1 1 15 SER OG O -7.934 -1.156 -9.417 1.00 . A A . 15 SER OG 1 1
1 217 1 1 16 CYS C C -5.210 -1.878 -13.168 1.00 . A A . 16 CYS C 1 1
1 218 1 1 16 CYS CA C -4.387 -1.983 -11.888 1.00 . A A . 16 CYS CA 1 1
1 219 1 1 16 CYS CB C -3.157 -2.861 -12.130 1.00 . A A . 16 CYS CB 1 1
1 220 1 1 16 CYS H H -5.669 -3.369 -10.931 1.00 . A A . 16 CYS H 1 1
1 221 1 1 16 CYS HA H -4.061 -0.994 -11.602 1.00 . A A . 16 CYS HA 1 1
1 222 1 1 16 CYS HB2 H -3.473 -3.796 -12.571 1.00 . A A . 16 CYS HB2 1 1
1 223 1 1 16 CYS HB3 H -2.491 -2.355 -12.813 1.00 . A A . 16 CYS HB3 1 1
1 224 1 1 16 CYS N N -5.188 -2.525 -10.797 1.00 . A A . 16 CYS N 1 1
1 225 1 1 16 CYS O O -6.347 -2.346 -13.227 1.00 . A A . 16 CYS O 1 1
1 226 1 1 16 CYS SG S -2.214 -3.253 -10.621 1.00 . A A . 16 CYS SG 1 1
1 227 1 1 17 NH2 HN1 H -5.094 -1.146 -15.068 1.00 . A A . 17 NH2 HN1 1 1
1 228 1 1 17 NH2 HN2 H -3.720 -0.907 -14.083 1.00 . A A . 17 NH2 HN2 1 1
1 229 1 1 17 NH2 N N -4.628 -1.260 -14.191 1.00 . A A . 17 NH2 N 1 1
2 230 1 1 1 TRP C C 1.520 -0.863 -1.904 1.00 . A A . 1 TRP C 1 1
2 231 1 1 1 TRP CA C 2.026 0.307 -1.069 1.00 . A A . 1 TRP CA 1 1
2 232 1 1 1 TRP CB C 3.517 0.135 -0.776 1.00 . A A . 1 TRP CB 1 1
2 233 1 1 1 TRP CD1 C 5.087 1.213 -2.491 1.00 . A A . 1 TRP CD1 1 1
2 234 1 1 1 TRP CD2 C 4.596 -0.931 -2.913 1.00 . A A . 1 TRP CD2 1 1
2 235 1 1 1 TRP CE2 C 5.459 -0.460 -3.922 1.00 . A A . 1 TRP CE2 1 1
2 236 1 1 1 TRP CE3 C 4.154 -2.256 -2.969 1.00 . A A . 1 TRP CE3 1 1
2 237 1 1 1 TRP CG C 4.371 0.155 -2.008 1.00 . A A . 1 TRP CG 1 1
2 238 1 1 1 TRP CH2 C 5.437 -2.561 -5.002 1.00 . A A . 1 TRP CH2 1 1
2 239 1 1 1 TRP CZ2 C 5.886 -1.268 -4.973 1.00 . A A . 1 TRP CZ2 1 1
2 240 1 1 1 TRP CZ3 C 4.578 -3.056 -4.012 1.00 . A A . 1 TRP CZ3 1 1
2 241 1 1 1 TRP H1 H 1.639 0.013 0.992 1.00 . A A . 1 TRP H1 1 1
2 242 1 1 1 TRP HA H 1.882 1.222 -1.626 1.00 . A A . 1 TRP HA 1 1
2 243 1 1 1 TRP HB2 H 3.847 0.933 -0.129 1.00 . A A . 1 TRP HB2 1 1
2 244 1 1 1 TRP HB3 H 3.672 -0.813 -0.279 1.00 . A A . 1 TRP HB3 1 1
2 245 1 1 1 TRP HD1 H 5.120 2.187 -2.027 1.00 . A A . 1 TRP HD1 1 1
2 246 1 1 1 TRP HE1 H 6.322 1.435 -4.176 1.00 . A A . 1 TRP HE1 1 1
2 247 1 1 1 TRP HE3 H 3.492 -2.656 -2.215 1.00 . A A . 1 TRP HE3 1 1
2 248 1 1 1 TRP HH2 H 5.743 -3.221 -5.799 1.00 . A A . 1 TRP HH2 1 1
2 249 1 1 1 TRP HZ2 H 6.548 -0.901 -5.744 1.00 . A A . 1 TRP HZ2 1 1
2 250 1 1 1 TRP HZ3 H 4.247 -4.083 -4.072 1.00 . A A . 1 TRP HZ3 1 1
2 251 1 1 1 TRP N N 1.277 0.421 0.177 1.00 . A A . 1 TRP N 1 1
2 252 1 1 1 TRP NE1 N 5.742 0.850 -3.643 1.00 . A A . 1 TRP NE1 1 1
2 253 1 1 1 TRP O O 1.211 -1.930 -1.373 1.00 . A A . 1 TRP O 1 1
2 254 1 1 2 CYS C C 1.915 -1.846 -5.312 1.00 . A A . 2 CYS C 1 1
2 255 1 1 2 CYS CA C 0.969 -1.696 -4.124 1.00 . A A . 2 CYS CA 1 1
2 256 1 1 2 CYS CB C -0.442 -1.371 -4.618 1.00 . A A . 2 CYS CB 1 1
2 257 1 1 2 CYS H H 1.699 0.215 -3.579 1.00 . A A . 2 CYS H 1 1
2 258 1 1 2 CYS HA H 0.944 -2.628 -3.579 1.00 . A A . 2 CYS HA 1 1
2 259 1 1 2 CYS HB2 H -0.591 -0.302 -4.578 1.00 . A A . 2 CYS HB2 1 1
2 260 1 1 2 CYS HB3 H -0.542 -1.705 -5.641 1.00 . A A . 2 CYS HB3 1 1
2 261 1 1 2 CYS N N 1.438 -0.658 -3.214 1.00 . A A . 2 CYS N 1 1
2 262 1 1 2 CYS O O 2.871 -1.085 -5.457 1.00 . A A . 2 CYS O 1 1
2 263 1 1 2 CYS SG S -1.769 -2.153 -3.647 1.00 . A A . 2 CYS SG 1 1
2 264 1 1 3 ALA C C 2.272 -1.987 -8.381 1.00 . A A . 3 ALA C 1 1
2 265 1 1 3 ALA CA C 2.463 -3.081 -7.336 1.00 . A A . 3 ALA CA 1 1
2 266 1 1 3 ALA CB C 2.139 -4.444 -7.929 1.00 . A A . 3 ALA CB 1 1
2 267 1 1 3 ALA H H 0.863 -3.405 -5.990 1.00 . A A . 3 ALA H 1 1
2 268 1 1 3 ALA HA H 3.498 -3.088 -7.024 1.00 . A A . 3 ALA HA 1 1
2 269 1 1 3 ALA HB1 H 2.518 -5.218 -7.278 1.00 . A A . 3 ALA HB1 1 1
2 270 1 1 3 ALA HB2 H 1.068 -4.547 -8.029 1.00 . A A . 3 ALA HB2 1 1
2 271 1 1 3 ALA HB3 H 2.602 -4.532 -8.901 1.00 . A A . 3 ALA HB3 1 1
2 272 1 1 3 ALA N N 1.640 -2.832 -6.160 1.00 . A A . 3 ALA N 1 1
2 273 1 1 3 ALA O O 1.145 -1.611 -8.700 1.00 . A A . 3 ALA O 1 1
2 274 1 1 4 SER C C 2.544 0.775 -9.410 1.00 . A A . 4 SER C 1 1
2 275 1 1 4 SER CA C 3.335 -0.427 -9.918 1.00 . A A . 4 SER CA 1 1
2 276 1 1 4 SER CB C 2.709 -0.954 -11.211 1.00 . A A . 4 SER CB 1 1
2 277 1 1 4 SER H H 4.251 -1.824 -8.617 1.00 . A A . 4 SER H 1 1
2 278 1 1 4 SER HA H 4.349 -0.116 -10.120 1.00 . A A . 4 SER HA 1 1
2 279 1 1 4 SER HB2 H 3.190 -1.880 -11.490 1.00 . A A . 4 SER HB2 1 1
2 280 1 1 4 SER HB3 H 1.654 -1.129 -11.051 1.00 . A A . 4 SER HB3 1 1
2 281 1 1 4 SER HG H 3.473 -0.377 -12.920 1.00 . A A . 4 SER HG 1 1
2 282 1 1 4 SER N N 3.381 -1.481 -8.912 1.00 . A A . 4 SER N 1 1
2 283 1 1 4 SER O O 1.960 1.523 -10.192 1.00 . A A . 4 SER O 1 1
2 284 1 1 4 SER OG O 2.863 -0.024 -12.268 1.00 . A A . 4 SER OG 1 1
2 285 1 1 5 GLY C C 0.311 1.951 -7.692 1.00 . A A . 5 GLY C 1 1
2 286 1 1 5 GLY CA C 1.810 2.065 -7.502 1.00 . A A . 5 GLY CA 1 1
2 287 1 1 5 GLY H H 3.017 0.325 -7.517 1.00 . A A . 5 GLY H 1 1
2 288 1 1 5 GLY HA2 H 2.027 2.100 -6.444 1.00 . A A . 5 GLY HA2 1 1
2 289 1 1 5 GLY HA3 H 2.150 2.983 -7.958 1.00 . A A . 5 GLY HA3 1 1
2 290 1 1 5 GLY N N 2.531 0.953 -8.093 1.00 . A A . 5 GLY N 1 1
2 291 1 1 5 GLY O O -0.384 2.958 -7.824 1.00 . A A . 5 GLY O 1 1
2 292 1 1 6 CYS C C -2.404 0.937 -6.667 1.00 . A A . 6 CYS C 1 1
2 293 1 1 6 CYS CA C -1.616 0.476 -7.889 1.00 . A A . 6 CYS CA 1 1
2 294 1 1 6 CYS CB C -1.872 -1.010 -8.144 1.00 . A A . 6 CYS CB 1 1
2 295 1 1 6 CYS H H 0.415 -0.044 -7.600 1.00 . A A . 6 CYS H 1 1
2 296 1 1 6 CYS HA H -1.944 1.042 -8.748 1.00 . A A . 6 CYS HA 1 1
2 297 1 1 6 CYS HB2 H -1.161 -1.593 -7.576 1.00 . A A . 6 CYS HB2 1 1
2 298 1 1 6 CYS HB3 H -2.873 -1.256 -7.819 1.00 . A A . 6 CYS HB3 1 1
2 299 1 1 6 CYS N N -0.189 0.720 -7.710 1.00 . A A . 6 CYS N 1 1
2 300 1 1 6 CYS O O -1.826 1.384 -5.675 1.00 . A A . 6 CYS O 1 1
2 301 1 1 6 CYS SG S -1.719 -1.502 -9.891 1.00 . A A . 6 CYS SG 1 1
2 302 1 1 7 ARG C C -4.862 0.060 -4.704 1.00 . A A . 7 ARG C 1 1
2 303 1 1 7 ARG CA C -4.593 1.231 -5.645 1.00 . A A . 7 ARG CA 1 1
2 304 1 1 7 ARG CB C -5.916 1.777 -6.186 1.00 . A A . 7 ARG CB 1 1
2 305 1 1 7 ARG CD C -7.275 3.869 -6.492 1.00 . A A . 7 ARG CD 1 1
2 306 1 1 7 ARG CG C -5.879 3.266 -6.492 1.00 . A A . 7 ARG CG 1 1
2 307 1 1 7 ARG CZ C -9.337 3.738 -7.824 1.00 . A A . 7 ARG CZ 1 1
2 308 1 1 7 ARG H H -4.128 0.461 -7.561 1.00 . A A . 7 ARG H 1 1
2 309 1 1 7 ARG HA H -4.089 2.011 -5.095 1.00 . A A . 7 ARG HA 1 1
2 310 1 1 7 ARG HB2 H -6.164 1.251 -7.096 1.00 . A A . 7 ARG HB2 1 1
2 311 1 1 7 ARG HB3 H -6.690 1.602 -5.455 1.00 . A A . 7 ARG HB3 1 1
2 312 1 1 7 ARG HD2 H -7.727 3.694 -5.528 1.00 . A A . 7 ARG HD2 1 1
2 313 1 1 7 ARG HD3 H -7.193 4.933 -6.662 1.00 . A A . 7 ARG HD3 1 1
2 314 1 1 7 ARG HE H -7.771 2.520 -8.026 1.00 . A A . 7 ARG HE 1 1
2 315 1 1 7 ARG HG2 H -5.284 3.764 -5.741 1.00 . A A . 7 ARG HG2 1 1
2 316 1 1 7 ARG HG3 H -5.432 3.413 -7.464 1.00 . A A . 7 ARG HG3 1 1
2 317 1 1 7 ARG HH11 H -9.307 5.215 -6.446 1.00 . A A . 7 ARG HH11 1 1
2 318 1 1 7 ARG HH12 H -10.755 5.112 -7.391 1.00 . A A . 7 ARG HH12 1 1
2 319 1 1 7 ARG HH21 H -9.671 2.374 -9.278 1.00 . A A . 7 ARG HH21 1 1
2 320 1 1 7 ARG HH22 H -10.962 3.494 -9.002 1.00 . A A . 7 ARG HH22 1 1
2 321 1 1 7 ARG N N -3.726 0.825 -6.745 1.00 . A A . 7 ARG N 1 1
2 322 1 1 7 ARG NE N -8.124 3.286 -7.528 1.00 . A A . 7 ARG NE 1 1
2 323 1 1 7 ARG NH1 N -9.842 4.773 -7.166 1.00 . A A . 7 ARG NH1 1 1
2 324 1 1 7 ARG NH2 N -10.049 3.154 -8.779 1.00 . A A . 7 ARG NH2 1 1
2 325 1 1 7 ARG O O -5.145 -1.054 -5.146 1.00 . A A . 7 ARG O 1 1
2 326 1 1 8 LYS C C -6.489 -1.045 -2.297 1.00 . A A . 8 LYS C 1 1
2 327 1 1 8 LYS CA C -5.004 -0.711 -2.399 1.00 . A A . 8 LYS CA 1 1
2 328 1 1 8 LYS CB C -4.480 -0.252 -1.037 1.00 . A A . 8 LYS CB 1 1
2 329 1 1 8 LYS CD C -2.521 -0.069 0.526 1.00 . A A . 8 LYS CD 1 1
2 330 1 1 8 LYS CE C -2.943 -0.871 1.748 1.00 . A A . 8 LYS CE 1 1
2 331 1 1 8 LYS CG C -3.052 -0.687 -0.756 1.00 . A A . 8 LYS CG 1 1
2 332 1 1 8 LYS H H -4.541 1.228 -3.113 1.00 . A A . 8 LYS H 1 1
2 333 1 1 8 LYS HA H -4.468 -1.597 -2.702 1.00 . A A . 8 LYS HA 1 1
2 334 1 1 8 LYS HB2 H -4.520 0.826 -0.993 1.00 . A A . 8 LYS HB2 1 1
2 335 1 1 8 LYS HB3 H -5.116 -0.659 -0.264 1.00 . A A . 8 LYS HB3 1 1
2 336 1 1 8 LYS HD2 H -1.443 -0.041 0.483 1.00 . A A . 8 LYS HD2 1 1
2 337 1 1 8 LYS HD3 H -2.907 0.937 0.616 1.00 . A A . 8 LYS HD3 1 1
2 338 1 1 8 LYS HE2 H -2.672 -0.321 2.635 1.00 . A A . 8 LYS HE2 1 1
2 339 1 1 8 LYS HE3 H -4.015 -1.005 1.721 1.00 . A A . 8 LYS HE3 1 1
2 340 1 1 8 LYS HG2 H -3.024 -1.763 -0.663 1.00 . A A . 8 LYS HG2 1 1
2 341 1 1 8 LYS HG3 H -2.423 -0.380 -1.581 1.00 . A A . 8 LYS HG3 1 1
2 342 1 1 8 LYS HZ1 H -1.258 -2.102 1.711 1.00 . A A . 8 LYS HZ1 1 1
2 343 1 1 8 LYS HZ2 H -2.625 -2.794 0.995 1.00 . A A . 8 LYS HZ2 1 1
2 344 1 1 8 LYS HZ3 H -2.513 -2.689 2.680 1.00 . A A . 8 LYS HZ3 1 1
2 345 1 1 8 LYS N N -4.770 0.320 -3.404 1.00 . A A . 8 LYS N 1 1
2 346 1 1 8 LYS NZ N -2.289 -2.208 1.786 1.00 . A A . 8 LYS NZ 1 1
2 347 1 1 8 LYS O O -7.346 -0.203 -2.568 1.00 . A A . 8 LYS O 1 1
2 348 1 1 9 LYS C C -8.362 -3.495 -0.464 1.00 . A A . 9 LYS C 1 1
2 349 1 1 9 LYS CA C -8.168 -2.725 -1.766 1.00 . A A . 9 LYS CA 1 1
2 350 1 1 9 LYS CB C -8.566 -3.604 -2.954 1.00 . A A . 9 LYS CB 1 1
2 351 1 1 9 LYS CD C -8.565 -3.941 -5.443 1.00 . A A . 9 LYS CD 1 1
2 352 1 1 9 LYS CE C -7.951 -5.328 -5.329 1.00 . A A . 9 LYS CE 1 1
2 353 1 1 9 LYS CG C -8.131 -3.044 -4.297 1.00 . A A . 9 LYS CG 1 1
2 354 1 1 9 LYS H H -6.060 -2.906 -1.705 1.00 . A A . 9 LYS H 1 1
2 355 1 1 9 LYS HA H -8.799 -1.850 -1.750 1.00 . A A . 9 LYS HA 1 1
2 356 1 1 9 LYS HB2 H -8.116 -4.578 -2.832 1.00 . A A . 9 LYS HB2 1 1
2 357 1 1 9 LYS HB3 H -9.641 -3.711 -2.963 1.00 . A A . 9 LYS HB3 1 1
2 358 1 1 9 LYS HD2 H -9.641 -4.035 -5.429 1.00 . A A . 9 LYS HD2 1 1
2 359 1 1 9 LYS HD3 H -8.253 -3.496 -6.377 1.00 . A A . 9 LYS HD3 1 1
2 360 1 1 9 LYS HE2 H -7.800 -5.724 -6.321 1.00 . A A . 9 LYS HE2 1 1
2 361 1 1 9 LYS HE3 H -6.999 -5.246 -4.826 1.00 . A A . 9 LYS HE3 1 1
2 362 1 1 9 LYS HG2 H -8.574 -2.068 -4.431 1.00 . A A . 9 LYS HG2 1 1
2 363 1 1 9 LYS HG3 H -7.053 -2.957 -4.308 1.00 . A A . 9 LYS HG3 1 1
2 364 1 1 9 LYS HZ1 H -9.234 -6.972 -5.201 1.00 . A A . 9 LYS HZ1 1 1
2 365 1 1 9 LYS HZ2 H -9.596 -5.734 -4.108 1.00 . A A . 9 LYS HZ2 1 1
2 366 1 1 9 LYS HZ3 H -8.271 -6.746 -3.828 1.00 . A A . 9 LYS HZ3 1 1
2 367 1 1 9 LYS N N -6.787 -2.280 -1.906 1.00 . A A . 9 LYS N 1 1
2 368 1 1 9 LYS NZ N -8.824 -6.261 -4.562 1.00 . A A . 9 LYS NZ 1 1
2 369 1 1 9 LYS O O -7.424 -4.099 0.057 1.00 . A A . 9 LYS O 1 1
2 370 1 1 10 ARG C C -9.544 -5.648 1.198 1.00 . A A . 10 ARG C 1 1
2 371 1 1 10 ARG CA C -9.901 -4.168 1.298 1.00 . A A . 10 ARG CA 1 1
2 372 1 1 10 ARG CB C -11.386 -4.012 1.632 1.00 . A A . 10 ARG CB 1 1
2 373 1 1 10 ARG CD C -12.677 -6.110 1.134 1.00 . A A . 10 ARG CD 1 1
2 374 1 1 10 ARG CG C -12.307 -4.715 0.649 1.00 . A A . 10 ARG CG 1 1
2 375 1 1 10 ARG CZ C -14.548 -7.694 0.951 1.00 . A A . 10 ARG CZ 1 1
2 376 1 1 10 ARG H H -10.292 -2.973 -0.405 1.00 . A A . 10 ARG H 1 1
2 377 1 1 10 ARG HA H -9.315 -3.722 2.087 1.00 . A A . 10 ARG HA 1 1
2 378 1 1 10 ARG HB2 H -11.567 -4.418 2.616 1.00 . A A . 10 ARG HB2 1 1
2 379 1 1 10 ARG HB3 H -11.633 -2.961 1.634 1.00 . A A . 10 ARG HB3 1 1
2 380 1 1 10 ARG HD2 H -11.950 -6.812 0.755 1.00 . A A . 10 ARG HD2 1 1
2 381 1 1 10 ARG HD3 H -12.657 -6.118 2.213 1.00 . A A . 10 ARG HD3 1 1
2 382 1 1 10 ARG HE H -14.518 -5.869 0.148 1.00 . A A . 10 ARG HE 1 1
2 383 1 1 10 ARG HG2 H -13.211 -4.134 0.538 1.00 . A A . 10 ARG HG2 1 1
2 384 1 1 10 ARG HG3 H -11.809 -4.795 -0.305 1.00 . A A . 10 ARG HG3 1 1
2 385 1 1 10 ARG HH11 H -12.964 -8.367 2.009 1.00 . A A . 10 ARG HH11 1 1
2 386 1 1 10 ARG HH12 H -14.289 -9.474 1.873 1.00 . A A . 10 ARG HH12 1 1
2 387 1 1 10 ARG HH21 H -16.269 -7.317 -0.039 1.00 . A A . 10 ARG HH21 1 1
2 388 1 1 10 ARG HH22 H -16.169 -8.876 0.707 1.00 . A A . 10 ARG HH22 1 1
2 389 1 1 10 ARG N N -9.585 -3.472 0.056 1.00 . A A . 10 ARG N 1 1
2 390 1 1 10 ARG NE N -14.005 -6.512 0.680 1.00 . A A . 10 ARG NE 1 1
2 391 1 1 10 ARG NH1 N -13.879 -8.586 1.669 1.00 . A A . 10 ARG NH1 1 1
2 392 1 1 10 ARG NH2 N -15.762 -7.987 0.503 1.00 . A A . 10 ARG NH2 1 1
2 393 1 1 10 ARG O O -9.149 -6.271 2.183 1.00 . A A . 10 ARG O 1 1
2 394 1 1 11 HIS C C -7.895 -7.888 -0.008 1.00 . A A . 11 HIS C 1 1
2 395 1 1 11 HIS CA C -9.378 -7.612 -0.231 1.00 . A A . 11 HIS CA 1 1
2 396 1 1 11 HIS CB C -9.776 -8.017 -1.651 1.00 . A A . 11 HIS CB 1 1
2 397 1 1 11 HIS CD2 C -12.263 -7.297 -1.808 1.00 . A A . 11 HIS CD2 1 1
2 398 1 1 11 HIS CE1 C -13.145 -9.270 -2.180 1.00 . A A . 11 HIS CE1 1 1
2 399 1 1 11 HIS CG C -11.252 -8.197 -1.831 1.00 . A A . 11 HIS CG 1 1
2 400 1 1 11 HIS H H -10.004 -5.657 -0.749 1.00 . A A . 11 HIS H 1 1
2 401 1 1 11 HIS HA H -9.950 -8.196 0.474 1.00 . A A . 11 HIS HA 1 1
2 402 1 1 11 HIS HB2 H -9.448 -7.255 -2.341 1.00 . A A . 11 HIS HB2 1 1
2 403 1 1 11 HIS HB3 H -9.295 -8.953 -1.900 1.00 . A A . 11 HIS HB3 1 1
2 404 1 1 11 HIS HD1 H -11.366 -10.279 -2.137 1.00 . A A . 11 HIS HD1 1 1
2 405 1 1 11 HIS HD2 H -12.170 -6.232 -1.648 1.00 . A A . 11 HIS HD2 1 1
2 406 1 1 11 HIS HE1 H -13.861 -10.057 -2.367 1.00 . A A . 11 HIS HE1 1 1
2 407 1 1 11 HIS N N -9.686 -6.205 -0.001 1.00 . A A . 11 HIS N 1 1
2 408 1 1 11 HIS ND1 N -11.838 -9.424 -2.065 1.00 . A A . 11 HIS ND1 1 1
2 409 1 1 11 HIS NE2 N -13.429 -7.988 -2.028 1.00 . A A . 11 HIS NE2 1 1
2 410 1 1 11 HIS O O -7.491 -9.029 0.211 1.00 . A A . 11 HIS O 1 1
2 411 1 1 12 GLY C C -4.879 -6.883 -1.167 1.00 . A A . 12 GLY C 1 1
2 412 1 1 12 GLY CA C -5.657 -6.983 0.131 1.00 . A A . 12 GLY CA 1 1
2 413 1 1 12 GLY H H -7.464 -5.947 -0.245 1.00 . A A . 12 GLY H 1 1
2 414 1 1 12 GLY HA2 H -5.314 -6.213 0.805 1.00 . A A . 12 GLY HA2 1 1
2 415 1 1 12 GLY HA3 H -5.465 -7.949 0.577 1.00 . A A . 12 GLY HA3 1 1
2 416 1 1 12 GLY N N -7.086 -6.834 -0.066 1.00 . A A . 12 GLY N 1 1
2 417 1 1 12 GLY O O -3.668 -6.664 -1.157 1.00 . A A . 12 GLY O 1 1
2 418 1 1 13 GLY C C -4.653 -5.538 -4.011 1.00 . A A . 13 GLY C 1 1
2 419 1 1 13 GLY CA C -4.926 -6.966 -3.583 1.00 . A A . 13 GLY CA 1 1
2 420 1 1 13 GLY H H -6.540 -7.215 -2.233 1.00 . A A . 13 GLY H 1 1
2 421 1 1 13 GLY HA2 H -3.990 -7.503 -3.535 1.00 . A A . 13 GLY HA2 1 1
2 422 1 1 13 GLY HA3 H -5.561 -7.436 -4.319 1.00 . A A . 13 GLY HA3 1 1
2 423 1 1 13 GLY N N -5.576 -7.043 -2.287 1.00 . A A . 13 GLY N 1 1
2 424 1 1 13 GLY O O -4.766 -4.609 -3.210 1.00 . A A . 13 GLY O 1 1
2 425 1 1 14 CYS C C -4.699 -3.824 -7.151 1.00 . A A . 14 CYS C 1 1
2 426 1 1 14 CYS CA C -4.000 -4.036 -5.811 1.00 . A A . 14 CYS CA 1 1
2 427 1 1 14 CYS CB C -2.490 -3.852 -5.977 1.00 . A A . 14 CYS CB 1 1
2 428 1 1 14 CYS H H -4.219 -6.141 -5.868 1.00 . A A . 14 CYS H 1 1
2 429 1 1 14 CYS HA H -4.368 -3.306 -5.107 1.00 . A A . 14 CYS HA 1 1
2 430 1 1 14 CYS HB2 H -2.121 -4.582 -6.682 1.00 . A A . 14 CYS HB2 1 1
2 431 1 1 14 CYS HB3 H -2.296 -2.860 -6.359 1.00 . A A . 14 CYS HB3 1 1
2 432 1 1 14 CYS N N -4.292 -5.361 -5.277 1.00 . A A . 14 CYS N 1 1
2 433 1 1 14 CYS O O -4.431 -4.532 -8.122 1.00 . A A . 14 CYS O 1 1
2 434 1 1 14 CYS SG S -1.544 -4.046 -4.432 1.00 . A A . 14 CYS SG 1 1
2 435 1 1 15 SER C C -5.404 -2.003 -9.497 1.00 . A A . 15 SER C 1 1
2 436 1 1 15 SER CA C -6.337 -2.540 -8.414 1.00 . A A . 15 SER CA 1 1
2 437 1 1 15 SER CB C -7.441 -1.522 -8.125 1.00 . A A . 15 SER CB 1 1
2 438 1 1 15 SER H H -5.765 -2.315 -6.388 1.00 . A A . 15 SER H 1 1
2 439 1 1 15 SER HA H -6.787 -3.457 -8.766 1.00 . A A . 15 SER HA 1 1
2 440 1 1 15 SER HB2 H -8.312 -2.037 -7.748 1.00 . A A . 15 SER HB2 1 1
2 441 1 1 15 SER HB3 H -7.091 -0.816 -7.385 1.00 . A A . 15 SER HB3 1 1
2 442 1 1 15 SER HG H -8.737 -0.937 -9.472 1.00 . A A . 15 SER HG 1 1
2 443 1 1 15 SER N N -5.596 -2.844 -7.195 1.00 . A A . 15 SER N 1 1
2 444 1 1 15 SER O O -4.747 -0.979 -9.312 1.00 . A A . 15 SER O 1 1
2 445 1 1 15 SER OG O -7.802 -0.814 -9.298 1.00 . A A . 15 SER OG 1 1
2 446 1 1 16 CYS C C -5.264 -2.372 -13.060 1.00 . A A . 16 CYS C 1 1
2 447 1 1 16 CYS CA C -4.504 -2.297 -11.738 1.00 . A A . 16 CYS CA 1 1
2 448 1 1 16 CYS CB C -3.258 -3.182 -11.803 1.00 . A A . 16 CYS CB 1 1
2 449 1 1 16 CYS H H -5.902 -3.510 -10.713 1.00 . A A . 16 CYS H 1 1
2 450 1 1 16 CYS HA H -4.200 -1.276 -11.570 1.00 . A A . 16 CYS HA 1 1
2 451 1 1 16 CYS HB2 H -3.543 -4.169 -12.141 1.00 . A A . 16 CYS HB2 1 1
2 452 1 1 16 CYS HB3 H -2.558 -2.756 -12.507 1.00 . A A . 16 CYS HB3 1 1
2 453 1 1 16 CYS N N -5.354 -2.701 -10.626 1.00 . A A . 16 CYS N 1 1
2 454 1 1 16 CYS O O -6.230 -3.122 -13.189 1.00 . A A . 16 CYS O 1 1
2 455 1 1 16 CYS SG S -2.396 -3.372 -10.210 1.00 . A A . 16 CYS SG 1 1
2 456 1 1 17 NH2 HN1 H -5.257 -1.573 -14.936 1.00 . A A . 17 NH2 HN1 1 1
2 457 1 1 17 NH2 HN2 H -4.044 -1.011 -13.873 1.00 . A A . 17 NH2 HN2 1 1
2 458 1 1 17 NH2 N N -4.820 -1.588 -14.037 1.00 . A A . 17 NH2 N 1 1
3 459 1 1 1 TRP C C 1.649 -0.600 -2.062 1.00 . A A . 1 TRP C 1 1
3 460 1 1 1 TRP CA C 1.951 0.695 -1.318 1.00 . A A . 1 TRP CA 1 1
3 461 1 1 1 TRP CB C 3.449 0.792 -1.024 1.00 . A A . 1 TRP CB 1 1
3 462 1 1 1 TRP CD1 C 4.836 2.000 -2.809 1.00 . A A . 1 TRP CD1 1 1
3 463 1 1 1 TRP CD2 C 4.685 -0.216 -3.104 1.00 . A A . 1 TRP CD2 1 1
3 464 1 1 1 TRP CE2 C 5.468 0.324 -4.144 1.00 . A A . 1 TRP CE2 1 1
3 465 1 1 1 TRP CE3 C 4.454 -1.594 -3.080 1.00 . A A . 1 TRP CE3 1 1
3 466 1 1 1 TRP CG C 4.293 0.873 -2.262 1.00 . A A . 1 TRP CG 1 1
3 467 1 1 1 TRP CH2 C 5.775 -1.813 -5.100 1.00 . A A . 1 TRP CH2 1 1
3 468 1 1 1 TRP CZ2 C 6.017 -0.467 -5.149 1.00 . A A . 1 TRP CZ2 1 1
3 469 1 1 1 TRP CZ3 C 5.001 -2.378 -4.078 1.00 . A A . 1 TRP CZ3 1 1
3 470 1 1 1 TRP H1 H 1.665 0.788 0.778 1.00 . A A . 1 TRP H1 1 1
3 471 1 1 1 TRP HA H 1.661 1.530 -1.939 1.00 . A A . 1 TRP HA 1 1
3 472 1 1 1 TRP HB2 H 3.637 1.675 -0.434 1.00 . A A . 1 TRP HB2 1 1
3 473 1 1 1 TRP HB3 H 3.756 -0.082 -0.468 1.00 . A A . 1 TRP HB3 1 1
3 474 1 1 1 TRP HD1 H 4.717 2.993 -2.402 1.00 . A A . 1 TRP HD1 1 1
3 475 1 1 1 TRP HE1 H 6.027 2.312 -4.512 1.00 . A A . 1 TRP HE1 1 1
3 476 1 1 1 TRP HE3 H 3.860 -2.047 -2.301 1.00 . A A . 1 TRP HE3 1 1
3 477 1 1 1 TRP HH2 H 6.182 -2.463 -5.860 1.00 . A A . 1 TRP HH2 1 1
3 478 1 1 1 TRP HZ2 H 6.617 -0.048 -5.943 1.00 . A A . 1 TRP HZ2 1 1
3 479 1 1 1 TRP HZ3 H 4.833 -3.445 -4.076 1.00 . A A . 1 TRP HZ3 1 1
3 480 1 1 1 TRP N N 1.187 0.773 -0.079 1.00 . A A . 1 TRP N 1 1
3 481 1 1 1 TRP NE1 N 5.545 1.676 -3.942 1.00 . A A . 1 TRP NE1 1 1
3 482 1 1 1 TRP O O 1.476 -1.655 -1.450 1.00 . A A . 1 TRP O 1 1
3 483 1 1 2 CYS C C 2.166 -1.675 -5.475 1.00 . A A . 2 CYS C 1 1
3 484 1 1 2 CYS CA C 1.304 -1.682 -4.216 1.00 . A A . 2 CYS CA 1 1
3 485 1 1 2 CYS CB C -0.177 -1.715 -4.599 1.00 . A A . 2 CYS CB 1 1
3 486 1 1 2 CYS H H 1.732 0.353 -3.819 1.00 . A A . 2 CYS H 1 1
3 487 1 1 2 CYS HA H 1.538 -2.563 -3.639 1.00 . A A . 2 CYS HA 1 1
3 488 1 1 2 CYS HB2 H -0.569 -0.708 -4.578 1.00 . A A . 2 CYS HB2 1 1
3 489 1 1 2 CYS HB3 H -0.274 -2.113 -5.598 1.00 . A A . 2 CYS HB3 1 1
3 490 1 1 2 CYS N N 1.586 -0.516 -3.387 1.00 . A A . 2 CYS N 1 1
3 491 1 1 2 CYS O O 2.879 -0.709 -5.746 1.00 . A A . 2 CYS O 1 1
3 492 1 1 2 CYS SG S -1.207 -2.733 -3.495 1.00 . A A . 2 CYS SG 1 1
3 493 1 1 3 ALA C C 2.422 -1.846 -8.500 1.00 . A A . 3 ALA C 1 1
3 494 1 1 3 ALA CA C 2.868 -2.879 -7.470 1.00 . A A . 3 ALA CA 1 1
3 495 1 1 3 ALA CB C 2.739 -4.284 -8.040 1.00 . A A . 3 ALA CB 1 1
3 496 1 1 3 ALA H H 1.509 -3.497 -5.970 1.00 . A A . 3 ALA H 1 1
3 497 1 1 3 ALA HA H 3.907 -2.707 -7.230 1.00 . A A . 3 ALA HA 1 1
3 498 1 1 3 ALA HB1 H 3.118 -4.997 -7.323 1.00 . A A . 3 ALA HB1 1 1
3 499 1 1 3 ALA HB2 H 1.701 -4.495 -8.246 1.00 . A A . 3 ALA HB2 1 1
3 500 1 1 3 ALA HB3 H 3.309 -4.354 -8.954 1.00 . A A . 3 ALA HB3 1 1
3 501 1 1 3 ALA N N 2.096 -2.760 -6.240 1.00 . A A . 3 ALA N 1 1
3 502 1 1 3 ALA O O 1.234 -1.547 -8.619 1.00 . A A . 3 ALA O 1 1
3 503 1 1 4 SER C C 2.271 0.846 -9.670 1.00 . A A . 4 SER C 1 1
3 504 1 1 4 SER CA C 3.088 -0.300 -10.258 1.00 . A A . 4 SER CA 1 1
3 505 1 1 4 SER CB C 2.331 -0.934 -11.427 1.00 . A A . 4 SER CB 1 1
3 506 1 1 4 SER H H 4.310 -1.583 -9.099 1.00 . A A . 4 SER H 1 1
3 507 1 1 4 SER HA H 4.028 0.092 -10.619 1.00 . A A . 4 SER HA 1 1
3 508 1 1 4 SER HB2 H 2.761 -1.899 -11.649 1.00 . A A . 4 SER HB2 1 1
3 509 1 1 4 SER HB3 H 1.293 -1.056 -11.156 1.00 . A A . 4 SER HB3 1 1
3 510 1 1 4 SER HG H 2.503 -0.678 -13.361 1.00 . A A . 4 SER HG 1 1
3 511 1 1 4 SER N N 3.382 -1.303 -9.242 1.00 . A A . 4 SER N 1 1
3 512 1 1 4 SER O O 1.437 1.441 -10.350 1.00 . A A . 4 SER O 1 1
3 513 1 1 4 SER OG O 2.409 -0.122 -12.585 1.00 . A A . 4 SER OG 1 1
3 514 1 1 5 GLY C C 0.299 1.990 -7.720 1.00 . A A . 5 GLY C 1 1
3 515 1 1 5 GLY CA C 1.797 2.223 -7.739 1.00 . A A . 5 GLY CA 1 1
3 516 1 1 5 GLY H H 3.195 0.640 -7.905 1.00 . A A . 5 GLY H 1 1
3 517 1 1 5 GLY HA2 H 2.151 2.307 -6.723 1.00 . A A . 5 GLY HA2 1 1
3 518 1 1 5 GLY HA3 H 1.998 3.148 -8.259 1.00 . A A . 5 GLY HA3 1 1
3 519 1 1 5 GLY N N 2.517 1.149 -8.399 1.00 . A A . 5 GLY N 1 1
3 520 1 1 5 GLY O O -0.482 2.934 -7.606 1.00 . A A . 5 GLY O 1 1
3 521 1 1 6 CYS C C -2.206 0.893 -6.573 1.00 . A A . 6 CYS C 1 1
3 522 1 1 6 CYS CA C -1.516 0.373 -7.831 1.00 . A A . 6 CYS CA 1 1
3 523 1 1 6 CYS CB C -1.683 -1.146 -7.927 1.00 . A A . 6 CYS CB 1 1
3 524 1 1 6 CYS H H 0.568 0.018 -7.921 1.00 . A A . 6 CYS H 1 1
3 525 1 1 6 CYS HA H -1.976 0.831 -8.693 1.00 . A A . 6 CYS HA 1 1
3 526 1 1 6 CYS HB2 H -0.836 -1.623 -7.454 1.00 . A A . 6 CYS HB2 1 1
3 527 1 1 6 CYS HB3 H -2.587 -1.435 -7.410 1.00 . A A . 6 CYS HB3 1 1
3 528 1 1 6 CYS N N -0.103 0.728 -7.833 1.00 . A A . 6 CYS N 1 1
3 529 1 1 6 CYS O O -1.565 1.473 -5.696 1.00 . A A . 6 CYS O 1 1
3 530 1 1 6 CYS SG S -1.791 -1.776 -9.632 1.00 . A A . 6 CYS SG 1 1
3 531 1 1 7 ARG C C -4.788 -0.063 -4.524 1.00 . A A . 7 ARG C 1 1
3 532 1 1 7 ARG CA C -4.292 1.127 -5.341 1.00 . A A . 7 ARG CA 1 1
3 533 1 1 7 ARG CB C -5.480 1.974 -5.800 1.00 . A A . 7 ARG CB 1 1
3 534 1 1 7 ARG CD C -6.246 4.113 -6.875 1.00 . A A . 7 ARG CD 1 1
3 535 1 1 7 ARG CG C -5.106 3.401 -6.164 1.00 . A A . 7 ARG CG 1 1
3 536 1 1 7 ARG CZ C -6.768 6.348 -7.755 1.00 . A A . 7 ARG CZ 1 1
3 537 1 1 7 ARG H H -3.970 0.211 -7.222 1.00 . A A . 7 ARG H 1 1
3 538 1 1 7 ARG HA H -3.649 1.732 -4.721 1.00 . A A . 7 ARG HA 1 1
3 539 1 1 7 ARG HB2 H -5.925 1.510 -6.668 1.00 . A A . 7 ARG HB2 1 1
3 540 1 1 7 ARG HB3 H -6.210 2.008 -5.006 1.00 . A A . 7 ARG HB3 1 1
3 541 1 1 7 ARG HD2 H -6.454 3.595 -7.800 1.00 . A A . 7 ARG HD2 1 1
3 542 1 1 7 ARG HD3 H -7.121 4.084 -6.242 1.00 . A A . 7 ARG HD3 1 1
3 543 1 1 7 ARG HE H -5.029 5.826 -6.929 1.00 . A A . 7 ARG HE 1 1
3 544 1 1 7 ARG HG2 H -4.868 3.942 -5.260 1.00 . A A . 7 ARG HG2 1 1
3 545 1 1 7 ARG HG3 H -4.243 3.383 -6.813 1.00 . A A . 7 ARG HG3 1 1
3 546 1 1 7 ARG HH11 H -8.263 5.001 -7.918 1.00 . A A . 7 ARG HH11 1 1
3 547 1 1 7 ARG HH12 H -8.618 6.580 -8.534 1.00 . A A . 7 ARG HH12 1 1
3 548 1 1 7 ARG HH21 H -5.484 7.909 -7.736 1.00 . A A . 7 ARG HH21 1 1
3 549 1 1 7 ARG HH22 H -7.036 8.234 -8.431 1.00 . A A . 7 ARG HH22 1 1
3 550 1 1 7 ARG N N -3.515 0.680 -6.491 1.00 . A A . 7 ARG N 1 1
3 551 1 1 7 ARG NE N -5.922 5.505 -7.173 1.00 . A A . 7 ARG NE 1 1
3 552 1 1 7 ARG NH1 N -7.982 5.943 -8.098 1.00 . A A . 7 ARG NH1 1 1
3 553 1 1 7 ARG NH2 N -6.399 7.601 -7.994 1.00 . A A . 7 ARG NH2 1 1
3 554 1 1 7 ARG O O -5.546 -0.896 -5.018 1.00 . A A . 7 ARG O 1 1
3 555 1 1 8 LYS C C -6.270 -1.340 -2.317 1.00 . A A . 8 LYS C 1 1
3 556 1 1 8 LYS CA C -4.752 -1.220 -2.382 1.00 . A A . 8 LYS CA 1 1
3 557 1 1 8 LYS CB C -4.187 -0.992 -0.979 1.00 . A A . 8 LYS CB 1 1
3 558 1 1 8 LYS CD C -3.235 -2.291 0.950 1.00 . A A . 8 LYS CD 1 1
3 559 1 1 8 LYS CE C -2.441 -3.527 1.342 1.00 . A A . 8 LYS CE 1 1
3 560 1 1 8 LYS CG C -3.181 -2.046 -0.548 1.00 . A A . 8 LYS CG 1 1
3 561 1 1 8 LYS H H -3.748 0.561 -2.933 1.00 . A A . 8 LYS H 1 1
3 562 1 1 8 LYS HA H -4.346 -2.139 -2.779 1.00 . A A . 8 LYS HA 1 1
3 563 1 1 8 LYS HB2 H -3.701 -0.028 -0.951 1.00 . A A . 8 LYS HB2 1 1
3 564 1 1 8 LYS HB3 H -5.003 -0.995 -0.271 1.00 . A A . 8 LYS HB3 1 1
3 565 1 1 8 LYS HD2 H -2.822 -1.434 1.462 1.00 . A A . 8 LYS HD2 1 1
3 566 1 1 8 LYS HD3 H -4.265 -2.426 1.246 1.00 . A A . 8 LYS HD3 1 1
3 567 1 1 8 LYS HE2 H -2.759 -4.353 0.725 1.00 . A A . 8 LYS HE2 1 1
3 568 1 1 8 LYS HE3 H -1.392 -3.333 1.172 1.00 . A A . 8 LYS HE3 1 1
3 569 1 1 8 LYS HG2 H -3.399 -2.970 -1.063 1.00 . A A . 8 LYS HG2 1 1
3 570 1 1 8 LYS HG3 H -2.188 -1.710 -0.814 1.00 . A A . 8 LYS HG3 1 1
3 571 1 1 8 LYS HZ1 H -2.134 -4.766 2.996 1.00 . A A . 8 LYS HZ1 1 1
3 572 1 1 8 LYS HZ2 H -3.654 -4.023 2.968 1.00 . A A . 8 LYS HZ2 1 1
3 573 1 1 8 LYS HZ3 H -2.282 -3.126 3.385 1.00 . A A . 8 LYS HZ3 1 1
3 574 1 1 8 LYS N N -4.352 -0.134 -3.270 1.00 . A A . 8 LYS N 1 1
3 575 1 1 8 LYS NZ N -2.642 -3.885 2.773 1.00 . A A . 8 LYS NZ 1 1
3 576 1 1 8 LYS O O -6.991 -0.369 -2.550 1.00 . A A . 8 LYS O 1 1
3 577 1 1 9 LYS C C -8.528 -3.488 -0.591 1.00 . A A . 9 LYS C 1 1
3 578 1 1 9 LYS CA C -8.185 -2.784 -1.901 1.00 . A A . 9 LYS CA 1 1
3 579 1 1 9 LYS CB C -8.660 -3.629 -3.085 1.00 . A A . 9 LYS CB 1 1
3 580 1 1 9 LYS CD C -8.501 -4.111 -5.546 1.00 . A A . 9 LYS CD 1 1
3 581 1 1 9 LYS CE C -7.873 -5.483 -5.359 1.00 . A A . 9 LYS CE 1 1
3 582 1 1 9 LYS CG C -8.114 -3.163 -4.424 1.00 . A A . 9 LYS CG 1 1
3 583 1 1 9 LYS H H -6.127 -3.272 -1.825 1.00 . A A . 9 LYS H 1 1
3 584 1 1 9 LYS HA H -8.689 -1.829 -1.925 1.00 . A A . 9 LYS HA 1 1
3 585 1 1 9 LYS HB2 H -8.351 -4.652 -2.930 1.00 . A A . 9 LYS HB2 1 1
3 586 1 1 9 LYS HB3 H -9.739 -3.591 -3.129 1.00 . A A . 9 LYS HB3 1 1
3 587 1 1 9 LYS HD2 H -9.576 -4.218 -5.558 1.00 . A A . 9 LYS HD2 1 1
3 588 1 1 9 LYS HD3 H -8.168 -3.696 -6.486 1.00 . A A . 9 LYS HD3 1 1
3 589 1 1 9 LYS HE2 H -7.639 -5.893 -6.329 1.00 . A A . 9 LYS HE2 1 1
3 590 1 1 9 LYS HE3 H -6.963 -5.373 -4.785 1.00 . A A . 9 LYS HE3 1 1
3 591 1 1 9 LYS HG2 H -8.509 -2.182 -4.642 1.00 . A A . 9 LYS HG2 1 1
3 592 1 1 9 LYS HG3 H -7.035 -3.113 -4.363 1.00 . A A . 9 LYS HG3 1 1
3 593 1 1 9 LYS HZ1 H -9.003 -7.235 -5.250 1.00 . A A . 9 LYS HZ1 1 1
3 594 1 1 9 LYS HZ2 H -9.673 -5.936 -4.401 1.00 . A A . 9 LYS HZ2 1 1
3 595 1 1 9 LYS HZ3 H -8.336 -6.758 -3.770 1.00 . A A . 9 LYS HZ3 1 1
3 596 1 1 9 LYS N N -6.752 -2.536 -2.000 1.00 . A A . 9 LYS N 1 1
3 597 1 1 9 LYS NZ N -8.785 -6.419 -4.645 1.00 . A A . 9 LYS NZ 1 1
3 598 1 1 9 LYS O O -7.650 -4.029 0.081 1.00 . A A . 9 LYS O 1 1
3 599 1 1 10 ARG C C -9.859 -5.585 1.026 1.00 . A A . 10 ARG C 1 1
3 600 1 1 10 ARG CA C -10.266 -4.114 0.993 1.00 . A A . 10 ARG CA 1 1
3 601 1 1 10 ARG CB C -11.785 -3.991 1.121 1.00 . A A . 10 ARG CB 1 1
3 602 1 1 10 ARG CD C -13.709 -2.408 1.446 1.00 . A A . 10 ARG CD 1 1
3 603 1 1 10 ARG CG C -12.303 -2.580 0.893 1.00 . A A . 10 ARG CG 1 1
3 604 1 1 10 ARG CZ C -14.187 -0.048 0.945 1.00 . A A . 10 ARG CZ 1 1
3 605 1 1 10 ARG H H -10.461 -3.029 -0.814 1.00 . A A . 10 ARG H 1 1
3 606 1 1 10 ARG HA H -9.801 -3.605 1.823 1.00 . A A . 10 ARG HA 1 1
3 607 1 1 10 ARG HB2 H -12.251 -4.643 0.396 1.00 . A A . 10 ARG HB2 1 1
3 608 1 1 10 ARG HB3 H -12.077 -4.303 2.112 1.00 . A A . 10 ARG HB3 1 1
3 609 1 1 10 ARG HD2 H -14.248 -3.335 1.319 1.00 . A A . 10 ARG HD2 1 1
3 610 1 1 10 ARG HD3 H -13.642 -2.170 2.497 1.00 . A A . 10 ARG HD3 1 1
3 611 1 1 10 ARG HE H -15.149 -1.601 0.144 1.00 . A A . 10 ARG HE 1 1
3 612 1 1 10 ARG HG2 H -11.646 -1.881 1.389 1.00 . A A . 10 ARG HG2 1 1
3 613 1 1 10 ARG HG3 H -12.315 -2.378 -0.167 1.00 . A A . 10 ARG HG3 1 1
3 614 1 1 10 ARG HH11 H -12.696 -0.350 2.274 1.00 . A A . 10 ARG HH11 1 1
3 615 1 1 10 ARG HH12 H -13.042 1.308 1.911 1.00 . A A . 10 ARG HH12 1 1
3 616 1 1 10 ARG HH21 H -15.614 0.578 -0.343 1.00 . A A . 10 ARG HH21 1 1
3 617 1 1 10 ARG HH22 H -14.703 1.835 0.423 1.00 . A A . 10 ARG HH22 1 1
3 618 1 1 10 ARG N N -9.808 -3.477 -0.237 1.00 . A A . 10 ARG N 1 1
3 619 1 1 10 ARG NE N -14.438 -1.341 0.765 1.00 . A A . 10 ARG NE 1 1
3 620 1 1 10 ARG NH1 N -13.231 0.334 1.779 1.00 . A A . 10 ARG NH1 1 1
3 621 1 1 10 ARG NH2 N -14.893 0.863 0.288 1.00 . A A . 10 ARG NH2 1 1
3 622 1 1 10 ARG O O -9.512 -6.120 2.079 1.00 . A A . 10 ARG O 1 1
3 623 1 1 11 HIS C C -8.059 -7.843 0.059 1.00 . A A . 11 HIS C 1 1
3 624 1 1 11 HIS CA C -9.541 -7.642 -0.236 1.00 . A A . 11 HIS CA 1 1
3 625 1 1 11 HIS CB C -9.873 -8.175 -1.631 1.00 . A A . 11 HIS CB 1 1
3 626 1 1 11 HIS CD2 C -12.338 -7.407 -1.876 1.00 . A A . 11 HIS CD2 1 1
3 627 1 1 11 HIS CE1 C -13.234 -9.353 -2.350 1.00 . A A . 11 HIS CE1 1 1
3 628 1 1 11 HIS CG C -11.342 -8.323 -1.882 1.00 . A A . 11 HIS CG 1 1
3 629 1 1 11 HIS H H -10.190 -5.752 -0.939 1.00 . A A . 11 HIS H 1 1
3 630 1 1 11 HIS HA H -10.119 -8.188 0.494 1.00 . A A . 11 HIS HA 1 1
3 631 1 1 11 HIS HB2 H -9.477 -7.496 -2.372 1.00 . A A . 11 HIS HB2 1 1
3 632 1 1 11 HIS HB3 H -9.414 -9.144 -1.757 1.00 . A A . 11 HIS HB3 1 1
3 633 1 1 11 HIS HD1 H -11.474 -10.392 -2.259 1.00 . A A . 11 HIS HD1 1 1
3 634 1 1 11 HIS HD2 H -12.236 -6.350 -1.677 1.00 . A A . 11 HIS HD2 1 1
3 635 1 1 11 HIS HE1 H -13.951 -10.121 -2.592 1.00 . A A . 11 HIS HE1 1 1
3 636 1 1 11 HIS N N -9.906 -6.233 -0.133 1.00 . A A . 11 HIS N 1 1
3 637 1 1 11 HIS ND1 N -11.935 -9.531 -2.181 1.00 . A A . 11 HIS ND1 1 1
3 638 1 1 11 HIS NE2 N -13.503 -8.072 -2.169 1.00 . A A . 11 HIS NE2 1 1
3 639 1 1 11 HIS O O -7.623 -8.950 0.372 1.00 . A A . 11 HIS O 1 1
3 640 1 1 12 GLY C C -5.039 -6.802 -1.057 1.00 . A A . 12 GLY C 1 1
3 641 1 1 12 GLY CA C -5.862 -6.845 0.214 1.00 . A A . 12 GLY CA 1 1
3 642 1 1 12 GLY H H -7.690 -5.908 -0.298 1.00 . A A . 12 GLY H 1 1
3 643 1 1 12 GLY HA2 H -5.574 -6.016 0.845 1.00 . A A . 12 GLY HA2 1 1
3 644 1 1 12 GLY HA3 H -5.653 -7.768 0.734 1.00 . A A . 12 GLY HA3 1 1
3 645 1 1 12 GLY N N -7.288 -6.764 -0.044 1.00 . A A . 12 GLY N 1 1
3 646 1 1 12 GLY O O -3.839 -6.532 -1.021 1.00 . A A . 12 GLY O 1 1
3 647 1 1 13 GLY C C -4.632 -5.659 -3.914 1.00 . A A . 13 GLY C 1 1
3 648 1 1 13 GLY CA C -4.988 -7.061 -3.461 1.00 . A A . 13 GLY CA 1 1
3 649 1 1 13 GLY H H -6.641 -7.282 -2.157 1.00 . A A . 13 GLY H 1 1
3 650 1 1 13 GLY HA2 H -4.081 -7.639 -3.368 1.00 . A A . 13 GLY HA2 1 1
3 651 1 1 13 GLY HA3 H -5.619 -7.518 -4.208 1.00 . A A . 13 GLY HA3 1 1
3 652 1 1 13 GLY N N -5.684 -7.073 -2.188 1.00 . A A . 13 GLY N 1 1
3 653 1 1 13 GLY O O -4.728 -4.705 -3.141 1.00 . A A . 13 GLY O 1 1
3 654 1 1 14 CYS C C -4.650 -3.933 -6.987 1.00 . A A . 14 CYS C 1 1
3 655 1 1 14 CYS CA C -3.845 -4.236 -5.727 1.00 . A A . 14 CYS CA 1 1
3 656 1 1 14 CYS CB C -2.349 -4.207 -6.044 1.00 . A A . 14 CYS CB 1 1
3 657 1 1 14 CYS H H -4.164 -6.329 -5.740 1.00 . A A . 14 CYS H 1 1
3 658 1 1 14 CYS HA H -4.062 -3.482 -4.985 1.00 . A A . 14 CYS HA 1 1
3 659 1 1 14 CYS HB2 H -2.133 -4.955 -6.792 1.00 . A A . 14 CYS HB2 1 1
3 660 1 1 14 CYS HB3 H -2.091 -3.233 -6.432 1.00 . A A . 14 CYS HB3 1 1
3 661 1 1 14 CYS N N -4.219 -5.531 -5.171 1.00 . A A . 14 CYS N 1 1
3 662 1 1 14 CYS O O -4.554 -4.648 -7.984 1.00 . A A . 14 CYS O 1 1
3 663 1 1 14 CYS SG S -1.277 -4.535 -4.607 1.00 . A A . 14 CYS SG 1 1
3 664 1 1 15 SER C C -5.409 -1.870 -9.180 1.00 . A A . 15 SER C 1 1
3 665 1 1 15 SER CA C -6.266 -2.470 -8.069 1.00 . A A . 15 SER CA 1 1
3 666 1 1 15 SER CB C -7.328 -1.461 -7.627 1.00 . A A . 15 SER CB 1 1
3 667 1 1 15 SER H H -5.475 -2.336 -6.110 1.00 . A A . 15 SER H 1 1
3 668 1 1 15 SER HA H -6.758 -3.354 -8.448 1.00 . A A . 15 SER HA 1 1
3 669 1 1 15 SER HB2 H -7.724 -1.755 -6.667 1.00 . A A . 15 SER HB2 1 1
3 670 1 1 15 SER HB3 H -6.879 -0.481 -7.548 1.00 . A A . 15 SER HB3 1 1
3 671 1 1 15 SER HG H -8.729 -0.501 -8.605 1.00 . A A . 15 SER HG 1 1
3 672 1 1 15 SER N N -5.442 -2.867 -6.934 1.00 . A A . 15 SER N 1 1
3 673 1 1 15 SER O O -4.690 -0.893 -8.966 1.00 . A A . 15 SER O 1 1
3 674 1 1 15 SER OG O -8.393 -1.400 -8.561 1.00 . A A . 15 SER OG 1 1
3 675 1 1 16 CYS C C -5.620 -1.814 -12.734 1.00 . A A . 16 CYS C 1 1
3 676 1 1 16 CYS CA C -4.723 -1.989 -11.512 1.00 . A A . 16 CYS CA 1 1
3 677 1 1 16 CYS CB C -3.591 -2.966 -11.833 1.00 . A A . 16 CYS CB 1 1
3 678 1 1 16 CYS H H -6.082 -3.237 -10.475 1.00 . A A . 16 CYS H 1 1
3 679 1 1 16 CYS HA H -4.297 -1.030 -11.253 1.00 . A A . 16 CYS HA 1 1
3 680 1 1 16 CYS HB2 H -4.011 -3.866 -12.259 1.00 . A A . 16 CYS HB2 1 1
3 681 1 1 16 CYS HB3 H -2.925 -2.511 -12.551 1.00 . A A . 16 CYS HB3 1 1
3 682 1 1 16 CYS N N -5.491 -2.462 -10.366 1.00 . A A . 16 CYS N 1 1
3 683 1 1 16 CYS O O -6.729 -2.347 -12.783 1.00 . A A . 16 CYS O 1 1
3 684 1 1 16 CYS SG S -2.597 -3.453 -10.385 1.00 . A A . 16 CYS SG 1 1
3 685 1 1 17 NH2 HN1 H -5.652 -0.898 -14.556 1.00 . A A . 17 NH2 HN1 1 1
3 686 1 1 17 NH2 HN2 H -4.243 -0.666 -13.619 1.00 . A A . 17 NH2 HN2 1 1
3 687 1 1 17 NH2 N N -5.133 -1.064 -13.717 1.00 . A A . 17 NH2 N 1 1
4 688 1 1 1 TRP C C 1.510 -1.540 -2.043 1.00 . A A . 1 TRP C 1 1
4 689 1 1 1 TRP CA C 1.998 -0.495 -1.045 1.00 . A A . 1 TRP CA 1 1
4 690 1 1 1 TRP CB C 3.429 -0.814 -0.612 1.00 . A A . 1 TRP CB 1 1
4 691 1 1 1 TRP CD1 C 5.291 0.272 -1.998 1.00 . A A . 1 TRP CD1 1 1
4 692 1 1 1 TRP CD2 C 4.638 -1.736 -2.745 1.00 . A A . 1 TRP CD2 1 1
4 693 1 1 1 TRP CE2 C 5.658 -1.252 -3.589 1.00 . A A . 1 TRP CE2 1 1
4 694 1 1 1 TRP CE3 C 4.074 -2.984 -3.020 1.00 . A A . 1 TRP CE3 1 1
4 695 1 1 1 TRP CG C 4.419 -0.746 -1.735 1.00 . A A . 1 TRP CG 1 1
4 696 1 1 1 TRP CH2 C 5.550 -3.192 -4.931 1.00 . A A . 1 TRP CH2 1 1
4 697 1 1 1 TRP CZ2 C 6.121 -1.973 -4.686 1.00 . A A . 1 TRP CZ2 1 1
4 698 1 1 1 TRP CZ3 C 4.534 -3.699 -4.109 1.00 . A A . 1 TRP CZ3 1 1
4 699 1 1 1 TRP H1 H 1.424 -0.812 0.967 1.00 . A A . 1 TRP H1 1 1
4 700 1 1 1 TRP HA H 1.984 0.475 -1.523 1.00 . A A . 1 TRP HA 1 1
4 701 1 1 1 TRP HB2 H 3.735 -0.109 0.146 1.00 . A A . 1 TRP HB2 1 1
4 702 1 1 1 TRP HB3 H 3.458 -1.813 -0.201 1.00 . A A . 1 TRP HB3 1 1
4 703 1 1 1 TRP HD1 H 5.369 1.173 -1.410 1.00 . A A . 1 TRP HD1 1 1
4 704 1 1 1 TRP HE1 H 6.732 0.548 -3.501 1.00 . A A . 1 TRP HE1 1 1
4 705 1 1 1 TRP HE3 H 3.290 -3.391 -2.398 1.00 . A A . 1 TRP HE3 1 1
4 706 1 1 1 TRP HH2 H 5.879 -3.785 -5.771 1.00 . A A . 1 TRP HH2 1 1
4 707 1 1 1 TRP HZ2 H 6.904 -1.597 -5.329 1.00 . A A . 1 TRP HZ2 1 1
4 708 1 1 1 TRP HZ3 H 4.109 -4.665 -4.337 1.00 . A A . 1 TRP HZ3 1 1
4 709 1 1 1 TRP N N 1.119 -0.432 0.117 1.00 . A A . 1 TRP N 1 1
4 710 1 1 1 TRP NE1 N 6.038 -0.025 -3.112 1.00 . A A . 1 TRP NE1 1 1
4 711 1 1 1 TRP O O 1.158 -2.658 -1.664 1.00 . A A . 1 TRP O 1 1
4 712 1 1 2 CYS C C 1.964 -1.992 -5.586 1.00 . A A . 2 CYS C 1 1
4 713 1 1 2 CYS CA C 1.045 -2.077 -4.370 1.00 . A A . 2 CYS CA 1 1
4 714 1 1 2 CYS CB C -0.392 -1.749 -4.780 1.00 . A A . 2 CYS CB 1 1
4 715 1 1 2 CYS H H 1.782 -0.265 -3.559 1.00 . A A . 2 CYS H 1 1
4 716 1 1 2 CYS HA H 1.079 -3.081 -3.979 1.00 . A A . 2 CYS HA 1 1
4 717 1 1 2 CYS HB2 H -0.583 -0.703 -4.590 1.00 . A A . 2 CYS HB2 1 1
4 718 1 1 2 CYS HB3 H -0.511 -1.944 -5.835 1.00 . A A . 2 CYS HB3 1 1
4 719 1 1 2 CYS N N 1.491 -1.171 -3.318 1.00 . A A . 2 CYS N 1 1
4 720 1 1 2 CYS O O 2.725 -1.035 -5.737 1.00 . A A . 2 CYS O 1 1
4 721 1 1 2 CYS SG S -1.657 -2.712 -3.890 1.00 . A A . 2 CYS SG 1 1
4 722 1 1 3 ALA C C 2.422 -1.839 -8.553 1.00 . A A . 3 ALA C 1 1
4 723 1 1 3 ALA CA C 2.709 -3.036 -7.654 1.00 . A A . 3 ALA CA 1 1
4 724 1 1 3 ALA CB C 2.476 -4.335 -8.411 1.00 . A A . 3 ALA CB 1 1
4 725 1 1 3 ALA H H 1.262 -3.732 -6.275 1.00 . A A . 3 ALA H 1 1
4 726 1 1 3 ALA HA H 3.746 -3.006 -7.351 1.00 . A A . 3 ALA HA 1 1
4 727 1 1 3 ALA HB1 H 2.399 -5.152 -7.708 1.00 . A A . 3 ALA HB1 1 1
4 728 1 1 3 ALA HB2 H 1.561 -4.262 -8.979 1.00 . A A . 3 ALA HB2 1 1
4 729 1 1 3 ALA HB3 H 3.304 -4.515 -9.081 1.00 . A A . 3 ALA HB3 1 1
4 730 1 1 3 ALA N N 1.887 -2.998 -6.451 1.00 . A A . 3 ALA N 1 1
4 731 1 1 3 ALA O O 1.272 -1.426 -8.705 1.00 . A A . 3 ALA O 1 1
4 732 1 1 4 SER C C 2.563 0.989 -9.339 1.00 . A A . 4 SER C 1 1
4 733 1 1 4 SER CA C 3.335 -0.131 -10.029 1.00 . A A . 4 SER CA 1 1
4 734 1 1 4 SER CB C 2.625 -0.534 -11.323 1.00 . A A . 4 SER CB 1 1
4 735 1 1 4 SER H H 4.366 -1.659 -8.987 1.00 . A A . 4 SER H 1 1
4 736 1 1 4 SER HA H 4.326 0.225 -10.267 1.00 . A A . 4 SER HA 1 1
4 737 1 1 4 SER HB2 H 2.987 -1.500 -11.643 1.00 . A A . 4 SER HB2 1 1
4 738 1 1 4 SER HB3 H 1.561 -0.590 -11.144 1.00 . A A . 4 SER HB3 1 1
4 739 1 1 4 SER HG H 2.960 -0.049 -13.191 1.00 . A A . 4 SER HG 1 1
4 740 1 1 4 SER N N 3.474 -1.285 -9.147 1.00 . A A . 4 SER N 1 1
4 741 1 1 4 SER O O 1.830 1.740 -9.981 1.00 . A A . 4 SER O 1 1
4 742 1 1 4 SER OG O 2.868 0.409 -12.352 1.00 . A A . 4 SER OG 1 1
4 743 1 1 5 GLY C C 0.538 2.032 -7.398 1.00 . A A . 5 GLY C 1 1
4 744 1 1 5 GLY CA C 2.045 2.125 -7.268 1.00 . A A . 5 GLY CA 1 1
4 745 1 1 5 GLY H H 3.329 0.468 -7.564 1.00 . A A . 5 GLY H 1 1
4 746 1 1 5 GLY HA2 H 2.314 2.031 -6.226 1.00 . A A . 5 GLY HA2 1 1
4 747 1 1 5 GLY HA3 H 2.367 3.093 -7.626 1.00 . A A . 5 GLY HA3 1 1
4 748 1 1 5 GLY N N 2.732 1.095 -8.025 1.00 . A A . 5 GLY N 1 1
4 749 1 1 5 GLY O O -0.173 3.012 -7.174 1.00 . A A . 5 GLY O 1 1
4 750 1 1 6 CYS C C -2.136 0.993 -6.645 1.00 . A A . 6 CYS C 1 1
4 751 1 1 6 CYS CA C -1.383 0.633 -7.923 1.00 . A A . 6 CYS CA 1 1
4 752 1 1 6 CYS CB C -1.659 -0.825 -8.298 1.00 . A A . 6 CYS CB 1 1
4 753 1 1 6 CYS H H 0.668 0.107 -7.926 1.00 . A A . 6 CYS H 1 1
4 754 1 1 6 CYS HA H -1.729 1.272 -8.721 1.00 . A A . 6 CYS HA 1 1
4 755 1 1 6 CYS HB2 H -0.911 -1.454 -7.839 1.00 . A A . 6 CYS HB2 1 1
4 756 1 1 6 CYS HB3 H -2.634 -1.105 -7.927 1.00 . A A . 6 CYS HB3 1 1
4 757 1 1 6 CYS N N 0.049 0.851 -7.761 1.00 . A A . 6 CYS N 1 1
4 758 1 1 6 CYS O O -1.529 1.351 -5.636 1.00 . A A . 6 CYS O 1 1
4 759 1 1 6 CYS SG S -1.632 -1.149 -10.090 1.00 . A A . 6 CYS SG 1 1
4 760 1 1 7 ARG C C -4.593 -0.045 -4.729 1.00 . A A . 7 ARG C 1 1
4 761 1 1 7 ARG CA C -4.296 1.210 -5.545 1.00 . A A . 7 ARG CA 1 1
4 762 1 1 7 ARG CB C -5.605 1.858 -6.000 1.00 . A A . 7 ARG CB 1 1
4 763 1 1 7 ARG CD C -6.840 4.000 -6.447 1.00 . A A . 7 ARG CD 1 1
4 764 1 1 7 ARG CG C -5.476 3.343 -6.301 1.00 . A A . 7 ARG CG 1 1
4 765 1 1 7 ARG CZ C -7.744 6.101 -7.348 1.00 . A A . 7 ARG CZ 1 1
4 766 1 1 7 ARG H H -3.886 0.603 -7.531 1.00 . A A . 7 ARG H 1 1
4 767 1 1 7 ARG HA H -3.754 1.908 -4.924 1.00 . A A . 7 ARG HA 1 1
4 768 1 1 7 ARG HB2 H -5.948 1.360 -6.895 1.00 . A A . 7 ARG HB2 1 1
4 769 1 1 7 ARG HB3 H -6.343 1.733 -5.222 1.00 . A A . 7 ARG HB3 1 1
4 770 1 1 7 ARG HD2 H -7.527 3.285 -6.873 1.00 . A A . 7 ARG HD2 1 1
4 771 1 1 7 ARG HD3 H -7.188 4.295 -5.469 1.00 . A A . 7 ARG HD3 1 1
4 772 1 1 7 ARG HE H -6.003 5.288 -7.883 1.00 . A A . 7 ARG HE 1 1
4 773 1 1 7 ARG HG2 H -4.943 3.820 -5.492 1.00 . A A . 7 ARG HG2 1 1
4 774 1 1 7 ARG HG3 H -4.926 3.467 -7.221 1.00 . A A . 7 ARG HG3 1 1
4 775 1 1 7 ARG HH11 H -8.910 5.195 -5.970 1.00 . A A . 7 ARG HH11 1 1
4 776 1 1 7 ARG HH12 H -9.537 6.677 -6.614 1.00 . A A . 7 ARG HH12 1 1
4 777 1 1 7 ARG HH21 H -6.817 7.240 -8.737 1.00 . A A . 7 ARG HH21 1 1
4 778 1 1 7 ARG HH22 H -8.346 7.839 -8.188 1.00 . A A . 7 ARG HH22 1 1
4 779 1 1 7 ARG N N -3.460 0.894 -6.697 1.00 . A A . 7 ARG N 1 1
4 780 1 1 7 ARG NE N -6.788 5.180 -7.308 1.00 . A A . 7 ARG NE 1 1
4 781 1 1 7 ARG NH1 N -8.819 5.981 -6.582 1.00 . A A . 7 ARG NH1 1 1
4 782 1 1 7 ARG NH2 N -7.625 7.146 -8.158 1.00 . A A . 7 ARG NH2 1 1
4 783 1 1 7 ARG O O -4.670 -1.148 -5.272 1.00 . A A . 7 ARG O 1 1
4 784 1 1 8 LYS C C -6.550 -1.266 -2.480 1.00 . A A . 8 LYS C 1 1
4 785 1 1 8 LYS CA C -5.051 -0.986 -2.532 1.00 . A A . 8 LYS CA 1 1
4 786 1 1 8 LYS CB C -4.529 -0.691 -1.124 1.00 . A A . 8 LYS CB 1 1
4 787 1 1 8 LYS CD C -2.433 -0.426 0.234 1.00 . A A . 8 LYS CD 1 1
4 788 1 1 8 LYS CE C -2.797 -0.979 1.604 1.00 . A A . 8 LYS CE 1 1
4 789 1 1 8 LYS CG C -3.118 -1.199 -0.880 1.00 . A A . 8 LYS CG 1 1
4 790 1 1 8 LYS H H -4.689 1.034 -3.049 1.00 . A A . 8 LYS H 1 1
4 791 1 1 8 LYS HA H -4.547 -1.859 -2.918 1.00 . A A . 8 LYS HA 1 1
4 792 1 1 8 LYS HB2 H -4.536 0.378 -0.967 1.00 . A A . 8 LYS HB2 1 1
4 793 1 1 8 LYS HB3 H -5.187 -1.156 -0.404 1.00 . A A . 8 LYS HB3 1 1
4 794 1 1 8 LYS HD2 H -1.362 -0.497 0.103 1.00 . A A . 8 LYS HD2 1 1
4 795 1 1 8 LYS HD3 H -2.736 0.610 0.181 1.00 . A A . 8 LYS HD3 1 1
4 796 1 1 8 LYS HE2 H -2.894 -2.051 1.530 1.00 . A A . 8 LYS HE2 1 1
4 797 1 1 8 LYS HE3 H -2.006 -0.736 2.298 1.00 . A A . 8 LYS HE3 1 1
4 798 1 1 8 LYS HG2 H -3.164 -2.243 -0.604 1.00 . A A . 8 LYS HG2 1 1
4 799 1 1 8 LYS HG3 H -2.544 -1.091 -1.788 1.00 . A A . 8 LYS HG3 1 1
4 800 1 1 8 LYS HZ1 H -4.747 -1.175 2.325 1.00 . A A . 8 LYS HZ1 1 1
4 801 1 1 8 LYS HZ2 H -4.500 0.212 1.390 1.00 . A A . 8 LYS HZ2 1 1
4 802 1 1 8 LYS HZ3 H -3.907 0.143 2.972 1.00 . A A . 8 LYS HZ3 1 1
4 803 1 1 8 LYS N N -4.761 0.131 -3.423 1.00 . A A . 8 LYS N 1 1
4 804 1 1 8 LYS NZ N -4.077 -0.410 2.108 1.00 . A A . 8 LYS NZ 1 1
4 805 1 1 8 LYS O O -7.365 -0.400 -2.797 1.00 . A A . 8 LYS O 1 1
4 806 1 1 9 LYS C C -8.595 -3.540 -0.641 1.00 . A A . 9 LYS C 1 1
4 807 1 1 9 LYS CA C -8.307 -2.877 -1.984 1.00 . A A . 9 LYS CA 1 1
4 808 1 1 9 LYS CB C -8.668 -3.831 -3.125 1.00 . A A . 9 LYS CB 1 1
4 809 1 1 9 LYS CD C -8.537 -4.361 -5.576 1.00 . A A . 9 LYS CD 1 1
4 810 1 1 9 LYS CE C -7.915 -5.731 -5.348 1.00 . A A . 9 LYS CE 1 1
4 811 1 1 9 LYS CG C -8.149 -3.384 -4.480 1.00 . A A . 9 LYS CG 1 1
4 812 1 1 9 LYS H H -6.211 -3.129 -1.840 1.00 . A A . 9 LYS H 1 1
4 813 1 1 9 LYS HA H -8.910 -1.985 -2.068 1.00 . A A . 9 LYS HA 1 1
4 814 1 1 9 LYS HB2 H -8.255 -4.805 -2.907 1.00 . A A . 9 LYS HB2 1 1
4 815 1 1 9 LYS HB3 H -9.744 -3.911 -3.184 1.00 . A A . 9 LYS HB3 1 1
4 816 1 1 9 LYS HD2 H -9.611 -4.466 -5.591 1.00 . A A . 9 LYS HD2 1 1
4 817 1 1 9 LYS HD3 H -8.197 -3.975 -6.527 1.00 . A A . 9 LYS HD3 1 1
4 818 1 1 9 LYS HE2 H -7.733 -6.193 -6.306 1.00 . A A . 9 LYS HE2 1 1
4 819 1 1 9 LYS HE3 H -6.978 -5.603 -4.826 1.00 . A A . 9 LYS HE3 1 1
4 820 1 1 9 LYS HG2 H -8.564 -2.415 -4.713 1.00 . A A . 9 LYS HG2 1 1
4 821 1 1 9 LYS HG3 H -7.071 -3.315 -4.437 1.00 . A A . 9 LYS HG3 1 1
4 822 1 1 9 LYS HZ1 H -9.753 -6.201 -4.475 1.00 . A A . 9 LYS HZ1 1 1
4 823 1 1 9 LYS HZ2 H -8.416 -6.730 -3.583 1.00 . A A . 9 LYS HZ2 1 1
4 824 1 1 9 LYS HZ3 H -8.873 -7.552 -4.989 1.00 . A A . 9 LYS HZ3 1 1
4 825 1 1 9 LYS N N -6.906 -2.482 -2.079 1.00 . A A . 9 LYS N 1 1
4 826 1 1 9 LYS NZ N -8.801 -6.616 -4.543 1.00 . A A . 9 LYS NZ 1 1
4 827 1 1 9 LYS O O -7.676 -3.934 0.077 1.00 . A A . 9 LYS O 1 1
4 828 1 1 10 ARG C C -9.709 -5.685 1.075 1.00 . A A . 10 ARG C 1 1
4 829 1 1 10 ARG CA C -10.284 -4.278 0.948 1.00 . A A . 10 ARG CA 1 1
4 830 1 1 10 ARG CB C -11.811 -4.329 1.043 1.00 . A A . 10 ARG CB 1 1
4 831 1 1 10 ARG CD C -12.484 -6.018 2.778 1.00 . A A . 10 ARG CD 1 1
4 832 1 1 10 ARG CG C -12.325 -4.540 2.458 1.00 . A A . 10 ARG CG 1 1
4 833 1 1 10 ARG CZ C -13.484 -5.898 5.021 1.00 . A A . 10 ARG CZ 1 1
4 834 1 1 10 ARG H H -10.564 -3.328 -0.924 1.00 . A A . 10 ARG H 1 1
4 835 1 1 10 ARG HA H -9.902 -3.670 1.755 1.00 . A A . 10 ARG HA 1 1
4 836 1 1 10 ARG HB2 H -12.214 -3.398 0.672 1.00 . A A . 10 ARG HB2 1 1
4 837 1 1 10 ARG HB3 H -12.170 -5.139 0.427 1.00 . A A . 10 ARG HB3 1 1
4 838 1 1 10 ARG HD2 H -12.712 -6.548 1.864 1.00 . A A . 10 ARG HD2 1 1
4 839 1 1 10 ARG HD3 H -11.554 -6.386 3.185 1.00 . A A . 10 ARG HD3 1 1
4 840 1 1 10 ARG HE H -14.362 -6.709 3.424 1.00 . A A . 10 ARG HE 1 1
4 841 1 1 10 ARG HG2 H -11.625 -4.106 3.155 1.00 . A A . 10 ARG HG2 1 1
4 842 1 1 10 ARG HG3 H -13.284 -4.054 2.557 1.00 . A A . 10 ARG HG3 1 1
4 843 1 1 10 ARG HH11 H -11.637 -5.094 4.869 1.00 . A A . 10 ARG HH11 1 1
4 844 1 1 10 ARG HH12 H -12.353 -5.015 6.445 1.00 . A A . 10 ARG HH12 1 1
4 845 1 1 10 ARG HH21 H -15.315 -6.611 5.493 1.00 . A A . 10 ARG HH21 1 1
4 846 1 1 10 ARG HH22 H -14.445 -5.880 6.799 1.00 . A A . 10 ARG HH22 1 1
4 847 1 1 10 ARG N N -9.876 -3.662 -0.309 1.00 . A A . 10 ARG N 1 1
4 848 1 1 10 ARG NE N -13.552 -6.257 3.743 1.00 . A A . 10 ARG NE 1 1
4 849 1 1 10 ARG NH1 N -12.402 -5.286 5.483 1.00 . A A . 10 ARG NH1 1 1
4 850 1 1 10 ARG NH2 N -14.498 -6.151 5.838 1.00 . A A . 10 ARG NH2 1 1
4 851 1 1 10 ARG O O -9.225 -6.075 2.139 1.00 . A A . 10 ARG O 1 1
4 852 1 1 11 HIS C C -7.750 -7.823 0.256 1.00 . A A . 11 HIS C 1 1
4 853 1 1 11 HIS CA C -9.248 -7.807 -0.025 1.00 . A A . 11 HIS CA 1 1
4 854 1 1 11 HIS CB C -9.533 -8.473 -1.372 1.00 . A A . 11 HIS CB 1 1
4 855 1 1 11 HIS CD2 C -12.086 -8.057 -1.167 1.00 . A A . 11 HIS CD2 1 1
4 856 1 1 11 HIS CE1 C -12.779 -9.667 -2.483 1.00 . A A . 11 HIS CE1 1 1
4 857 1 1 11 HIS CG C -10.990 -8.705 -1.629 1.00 . A A . 11 HIS CG 1 1
4 858 1 1 11 HIS H H -10.162 -6.077 -0.832 1.00 . A A . 11 HIS H 1 1
4 859 1 1 11 HIS HA H -9.754 -8.359 0.753 1.00 . A A . 11 HIS HA 1 1
4 860 1 1 11 HIS HB2 H -9.153 -7.844 -2.164 1.00 . A A . 11 HIS HB2 1 1
4 861 1 1 11 HIS HB3 H -9.033 -9.429 -1.407 1.00 . A A . 11 HIS HB3 1 1
4 862 1 1 11 HIS HD1 H -10.907 -10.354 -2.937 1.00 . A A . 11 HIS HD1 1 1
4 863 1 1 11 HIS HD2 H -12.094 -7.212 -0.493 1.00 . A A . 11 HIS HD2 1 1
4 864 1 1 11 HIS HE1 H -13.419 -10.332 -3.044 1.00 . A A . 11 HIS HE1 1 1
4 865 1 1 11 HIS N N -9.765 -6.443 -0.015 1.00 . A A . 11 HIS N 1 1
4 866 1 1 11 HIS ND1 N -11.459 -9.709 -2.450 1.00 . A A . 11 HIS ND1 1 1
4 867 1 1 11 HIS NE2 N -13.184 -8.674 -1.712 1.00 . A A . 11 HIS NE2 1 1
4 868 1 1 11 HIS O O -7.190 -8.851 0.634 1.00 . A A . 11 HIS O 1 1
4 869 1 1 12 GLY C C -4.876 -6.532 -0.979 1.00 . A A . 12 GLY C 1 1
4 870 1 1 12 GLY CA C -5.676 -6.580 0.307 1.00 . A A . 12 GLY CA 1 1
4 871 1 1 12 GLY H H -7.603 -5.887 -0.233 1.00 . A A . 12 GLY H 1 1
4 872 1 1 12 GLY HA2 H -5.476 -5.685 0.877 1.00 . A A . 12 GLY HA2 1 1
4 873 1 1 12 GLY HA3 H -5.361 -7.438 0.882 1.00 . A A . 12 GLY HA3 1 1
4 874 1 1 12 GLY N N -7.105 -6.676 0.070 1.00 . A A . 12 GLY N 1 1
4 875 1 1 12 GLY O O -3.717 -6.118 -0.982 1.00 . A A . 12 GLY O 1 1
4 876 1 1 13 GLY C C -4.647 -5.558 -3.921 1.00 . A A . 13 GLY C 1 1
4 877 1 1 13 GLY CA C -4.818 -6.955 -3.359 1.00 . A A . 13 GLY CA 1 1
4 878 1 1 13 GLY H H -6.420 -7.277 -2.013 1.00 . A A . 13 GLY H 1 1
4 879 1 1 13 GLY HA2 H -3.843 -7.406 -3.240 1.00 . A A . 13 GLY HA2 1 1
4 880 1 1 13 GLY HA3 H -5.392 -7.544 -4.058 1.00 . A A . 13 GLY HA3 1 1
4 881 1 1 13 GLY N N -5.495 -6.958 -2.076 1.00 . A A . 13 GLY N 1 1
4 882 1 1 13 GLY O O -4.857 -4.568 -3.220 1.00 . A A . 13 GLY O 1 1
4 883 1 1 14 CYS C C -4.987 -4.046 -7.055 1.00 . A A . 14 CYS C 1 1
4 884 1 1 14 CYS CA C -4.064 -4.190 -5.848 1.00 . A A . 14 CYS CA 1 1
4 885 1 1 14 CYS CB C -2.607 -4.040 -6.286 1.00 . A A . 14 CYS CB 1 1
4 886 1 1 14 CYS H H -4.114 -6.301 -5.700 1.00 . A A . 14 CYS H 1 1
4 887 1 1 14 CYS HA H -4.299 -3.413 -5.137 1.00 . A A . 14 CYS HA 1 1
4 888 1 1 14 CYS HB2 H -2.425 -4.685 -7.134 1.00 . A A . 14 CYS HB2 1 1
4 889 1 1 14 CYS HB3 H -2.430 -3.015 -6.578 1.00 . A A . 14 CYS HB3 1 1
4 890 1 1 14 CYS N N -4.265 -5.476 -5.191 1.00 . A A . 14 CYS N 1 1
4 891 1 1 14 CYS O O -5.099 -4.956 -7.877 1.00 . A A . 14 CYS O 1 1
4 892 1 1 14 CYS SG S -1.394 -4.467 -4.995 1.00 . A A . 14 CYS SG 1 1
4 893 1 1 15 SER C C -5.835 -1.960 -9.420 1.00 . A A . 15 SER C 1 1
4 894 1 1 15 SER CA C -6.562 -2.634 -8.261 1.00 . A A . 15 SER CA 1 1
4 895 1 1 15 SER CB C -7.721 -1.754 -7.790 1.00 . A A . 15 SER CB 1 1
4 896 1 1 15 SER H H -5.515 -2.209 -6.469 1.00 . A A . 15 SER H 1 1
4 897 1 1 15 SER HA H -6.954 -3.582 -8.598 1.00 . A A . 15 SER HA 1 1
4 898 1 1 15 SER HB2 H -7.969 -2.004 -6.770 1.00 . A A . 15 SER HB2 1 1
4 899 1 1 15 SER HB3 H -7.427 -0.715 -7.845 1.00 . A A . 15 SER HB3 1 1
4 900 1 1 15 SER HG H -9.654 -1.951 -8.047 1.00 . A A . 15 SER HG 1 1
4 901 1 1 15 SER N N -5.647 -2.897 -7.156 1.00 . A A . 15 SER N 1 1
4 902 1 1 15 SER O O -5.787 -0.733 -9.510 1.00 . A A . 15 SER O 1 1
4 903 1 1 15 SER OG O -8.869 -1.946 -8.599 1.00 . A A . 15 SER OG 1 1
4 904 1 1 16 CYS C C -5.409 -2.316 -12.718 1.00 . A A . 16 CYS C 1 1
4 905 1 1 16 CYS CA C -4.544 -2.258 -11.463 1.00 . A A . 16 CYS CA 1 1
4 906 1 1 16 CYS CB C -3.257 -3.055 -11.679 1.00 . A A . 16 CYS CB 1 1
4 907 1 1 16 CYS H H -5.342 -3.743 -10.182 1.00 . A A . 16 CYS H 1 1
4 908 1 1 16 CYS HA H -4.289 -1.228 -11.262 1.00 . A A . 16 CYS HA 1 1
4 909 1 1 16 CYS HB2 H -3.512 -4.059 -11.988 1.00 . A A . 16 CYS HB2 1 1
4 910 1 1 16 CYS HB3 H -2.675 -2.582 -12.456 1.00 . A A . 16 CYS HB3 1 1
4 911 1 1 16 CYS N N -5.270 -2.773 -10.307 1.00 . A A . 16 CYS N 1 1
4 912 1 1 16 CYS O O -6.462 -2.954 -12.730 1.00 . A A . 16 CYS O 1 1
4 913 1 1 16 CYS SG S -2.204 -3.186 -10.198 1.00 . A A . 16 CYS SG 1 1
4 914 1 1 17 NH2 HN1 H -5.459 -1.630 -14.638 1.00 . A A . 17 NH2 HN1 1 1
4 915 1 1 17 NH2 HN2 H -4.112 -1.155 -13.702 1.00 . A A . 17 NH2 HN2 1 1
4 916 1 1 17 NH2 N N -4.957 -1.645 -13.772 1.00 . A A . 17 NH2 N 1 1
5 917 1 1 1 TRP C C 1.677 -1.338 -2.021 1.00 . A A . 1 TRP C 1 1
5 918 1 1 1 TRP CA C 2.180 -0.250 -1.078 1.00 . A A . 1 TRP CA 1 1
5 919 1 1 1 TRP CB C 3.676 -0.435 -0.819 1.00 . A A . 1 TRP CB 1 1
5 920 1 1 1 TRP CD1 C 5.238 0.704 -2.502 1.00 . A A . 1 TRP CD1 1 1
5 921 1 1 1 TRP CD2 C 4.692 -1.401 -3.032 1.00 . A A . 1 TRP CD2 1 1
5 922 1 1 1 TRP CE2 C 5.547 -0.894 -4.030 1.00 . A A . 1 TRP CE2 1 1
5 923 1 1 1 TRP CE3 C 4.220 -2.712 -3.153 1.00 . A A . 1 TRP CE3 1 1
5 924 1 1 1 TRP CG C 4.508 -0.364 -2.064 1.00 . A A . 1 TRP CG 1 1
5 925 1 1 1 TRP CH2 C 5.460 -2.930 -5.225 1.00 . A A . 1 TRP CH2 1 1
5 926 1 1 1 TRP CZ2 C 5.938 -1.651 -5.132 1.00 . A A . 1 TRP CZ2 1 1
5 927 1 1 1 TRP CZ3 C 4.608 -3.462 -4.247 1.00 . A A . 1 TRP CZ3 1 1
5 928 1 1 1 TRP H1 H 1.933 -0.166 1.023 1.00 . A A . 1 TRP H1 1 1
5 929 1 1 1 TRP HA H 2.020 0.713 -1.540 1.00 . A A . 1 TRP HA 1 1
5 930 1 1 1 TRP HB2 H 4.017 0.338 -0.146 1.00 . A A . 1 TRP HB2 1 1
5 931 1 1 1 TRP HB3 H 3.839 -1.402 -0.364 1.00 . A A . 1 TRP HB3 1 1
5 932 1 1 1 TRP HD1 H 5.303 1.650 -1.985 1.00 . A A . 1 TRP HD1 1 1
5 933 1 1 1 TRP HE1 H 6.448 0.993 -4.194 1.00 . A A . 1 TRP HE1 1 1
5 934 1 1 1 TRP HE3 H 3.563 -3.139 -2.410 1.00 . A A . 1 TRP HE3 1 1
5 935 1 1 1 TRP HH2 H 5.736 -3.552 -6.062 1.00 . A A . 1 TRP HH2 1 1
5 936 1 1 1 TRP HZ2 H 6.594 -1.256 -5.893 1.00 . A A . 1 TRP HZ2 1 1
5 937 1 1 1 TRP HZ3 H 4.252 -4.475 -4.357 1.00 . A A . 1 TRP HZ3 1 1
5 938 1 1 1 TRP N N 1.443 -0.270 0.180 1.00 . A A . 1 TRP N 1 1
5 939 1 1 1 TRP NE1 N 5.866 0.392 -3.684 1.00 . A A . 1 TRP NE1 1 1
5 940 1 1 1 TRP O O 1.402 -2.462 -1.598 1.00 . A A . 1 TRP O 1 1
5 941 1 1 2 CYS C C 1.977 -1.913 -5.541 1.00 . A A . 2 CYS C 1 1
5 942 1 1 2 CYS CA C 1.087 -1.946 -4.302 1.00 . A A . 2 CYS CA 1 1
5 943 1 1 2 CYS CB C -0.359 -1.632 -4.692 1.00 . A A . 2 CYS CB 1 1
5 944 1 1 2 CYS H H 1.792 -0.086 -3.576 1.00 . A A . 2 CYS H 1 1
5 945 1 1 2 CYS HA H 1.128 -2.934 -3.871 1.00 . A A . 2 CYS HA 1 1
5 946 1 1 2 CYS HB2 H -0.540 -0.575 -4.555 1.00 . A A . 2 CYS HB2 1 1
5 947 1 1 2 CYS HB3 H -0.508 -1.886 -5.730 1.00 . A A . 2 CYS HB3 1 1
5 948 1 1 2 CYS N N 1.557 -0.998 -3.300 1.00 . A A . 2 CYS N 1 1
5 949 1 1 2 CYS O O 2.747 -0.973 -5.741 1.00 . A A . 2 CYS O 1 1
5 950 1 1 2 CYS SG S -1.604 -2.535 -3.715 1.00 . A A . 2 CYS SG 1 1
5 951 1 1 3 ALA C C 2.323 -1.893 -8.547 1.00 . A A . 3 ALA C 1 1
5 952 1 1 3 ALA CA C 2.657 -3.034 -7.592 1.00 . A A . 3 ALA CA 1 1
5 953 1 1 3 ALA CB C 2.430 -4.377 -8.270 1.00 . A A . 3 ALA CB 1 1
5 954 1 1 3 ALA H H 1.234 -3.663 -6.157 1.00 . A A . 3 ALA H 1 1
5 955 1 1 3 ALA HA H 3.700 -2.968 -7.318 1.00 . A A . 3 ALA HA 1 1
5 956 1 1 3 ALA HB1 H 3.141 -4.496 -9.076 1.00 . A A . 3 ALA HB1 1 1
5 957 1 1 3 ALA HB2 H 2.565 -5.171 -7.551 1.00 . A A . 3 ALA HB2 1 1
5 958 1 1 3 ALA HB3 H 1.427 -4.415 -8.667 1.00 . A A . 3 ALA HB3 1 1
5 959 1 1 3 ALA N N 1.865 -2.945 -6.371 1.00 . A A . 3 ALA N 1 1
5 960 1 1 3 ALA O O 1.164 -1.498 -8.676 1.00 . A A . 3 ALA O 1 1
5 961 1 1 4 SER C C 2.416 0.890 -9.495 1.00 . A A . 4 SER C 1 1
5 962 1 1 4 SER CA C 3.163 -0.266 -10.152 1.00 . A A . 4 SER CA 1 1
5 963 1 1 4 SER CB C 2.398 -0.746 -11.387 1.00 . A A . 4 SER CB 1 1
5 964 1 1 4 SER H H 4.247 -1.724 -9.064 1.00 . A A . 4 SER H 1 1
5 965 1 1 4 SER HA H 4.140 0.077 -10.455 1.00 . A A . 4 SER HA 1 1
5 966 1 1 4 SER HB2 H 2.905 -1.598 -11.814 1.00 . A A . 4 SER HB2 1 1
5 967 1 1 4 SER HB3 H 1.396 -1.033 -11.098 1.00 . A A . 4 SER HB3 1 1
5 968 1 1 4 SER HG H 2.556 -0.083 -13.223 1.00 . A A . 4 SER HG 1 1
5 969 1 1 4 SER N N 3.346 -1.366 -9.212 1.00 . A A . 4 SER N 1 1
5 970 1 1 4 SER O O 1.668 1.614 -10.151 1.00 . A A . 4 SER O 1 1
5 971 1 1 4 SER OG O 2.317 0.275 -12.365 1.00 . A A . 4 SER OG 1 1
5 972 1 1 5 GLY C C 0.454 2.018 -7.519 1.00 . A A . 5 GLY C 1 1
5 973 1 1 5 GLY CA C 1.965 2.128 -7.467 1.00 . A A . 5 GLY CA 1 1
5 974 1 1 5 GLY H H 3.232 0.450 -7.720 1.00 . A A . 5 GLY H 1 1
5 975 1 1 5 GLY HA2 H 2.283 2.098 -6.435 1.00 . A A . 5 GLY HA2 1 1
5 976 1 1 5 GLY HA3 H 2.260 3.074 -7.897 1.00 . A A . 5 GLY HA3 1 1
5 977 1 1 5 GLY N N 2.625 1.058 -8.192 1.00 . A A . 5 GLY N 1 1
5 978 1 1 5 GLY O O -0.256 2.995 -7.280 1.00 . A A . 5 GLY O 1 1
5 979 1 1 6 CYS C C -2.168 0.976 -6.613 1.00 . A A . 6 CYS C 1 1
5 980 1 1 6 CYS CA C -1.476 0.590 -7.917 1.00 . A A . 6 CYS CA 1 1
5 981 1 1 6 CYS CB C -1.756 -0.879 -8.240 1.00 . A A . 6 CYS CB 1 1
5 982 1 1 6 CYS H H 0.577 0.083 -8.012 1.00 . A A . 6 CYS H 1 1
5 983 1 1 6 CYS HA H -1.867 1.205 -8.713 1.00 . A A . 6 CYS HA 1 1
5 984 1 1 6 CYS HB2 H -0.983 -1.491 -7.797 1.00 . A A . 6 CYS HB2 1 1
5 985 1 1 6 CYS HB3 H -2.712 -1.157 -7.820 1.00 . A A . 6 CYS HB3 1 1
5 986 1 1 6 CYS N N -0.040 0.824 -7.832 1.00 . A A . 6 CYS N 1 1
5 987 1 1 6 CYS O O -1.515 1.352 -5.639 1.00 . A A . 6 CYS O 1 1
5 988 1 1 6 CYS SG S -1.803 -1.253 -10.022 1.00 . A A . 6 CYS SG 1 1
5 989 1 1 7 ARG C C -4.595 -0.030 -4.601 1.00 . A A . 7 ARG C 1 1
5 990 1 1 7 ARG CA C -4.275 1.218 -5.418 1.00 . A A . 7 ARG CA 1 1
5 991 1 1 7 ARG CB C -5.571 1.923 -5.821 1.00 . A A . 7 ARG CB 1 1
5 992 1 1 7 ARG CD C -5.021 4.298 -5.209 1.00 . A A . 7 ARG CD 1 1
5 993 1 1 7 ARG CG C -5.361 3.337 -6.338 1.00 . A A . 7 ARG CG 1 1
5 994 1 1 7 ARG CZ C -5.926 4.855 -2.992 1.00 . A A . 7 ARG CZ 1 1
5 995 1 1 7 ARG H H -3.958 0.572 -7.409 1.00 . A A . 7 ARG H 1 1
5 996 1 1 7 ARG HA H -3.685 1.889 -4.812 1.00 . A A . 7 ARG HA 1 1
5 997 1 1 7 ARG HB2 H -6.053 1.348 -6.598 1.00 . A A . 7 ARG HB2 1 1
5 998 1 1 7 ARG HB3 H -6.223 1.970 -4.962 1.00 . A A . 7 ARG HB3 1 1
5 999 1 1 7 ARG HD2 H -4.122 3.953 -4.718 1.00 . A A . 7 ARG HD2 1 1
5 1000 1 1 7 ARG HD3 H -4.848 5.277 -5.627 1.00 . A A . 7 ARG HD3 1 1
5 1001 1 1 7 ARG HE H -6.985 4.078 -4.494 1.00 . A A . 7 ARG HE 1 1
5 1002 1 1 7 ARG HG2 H -4.548 3.333 -7.049 1.00 . A A . 7 ARG HG2 1 1
5 1003 1 1 7 ARG HG3 H -6.265 3.672 -6.823 1.00 . A A . 7 ARG HG3 1 1
5 1004 1 1 7 ARG HH11 H -3.958 5.243 -3.229 1.00 . A A . 7 ARG HH11 1 1
5 1005 1 1 7 ARG HH12 H -4.608 5.632 -1.671 1.00 . A A . 7 ARG HH12 1 1
5 1006 1 1 7 ARG HH21 H -7.853 4.586 -2.446 1.00 . A A . 7 ARG HH21 1 1
5 1007 1 1 7 ARG HH22 H -6.824 5.257 -1.226 1.00 . A A . 7 ARG HH22 1 1
5 1008 1 1 7 ARG N N -3.494 0.878 -6.601 1.00 . A A . 7 ARG N 1 1
5 1009 1 1 7 ARG NE N -6.095 4.385 -4.223 1.00 . A A . 7 ARG NE 1 1
5 1010 1 1 7 ARG NH1 N -4.733 5.278 -2.598 1.00 . A A . 7 ARG NH1 1 1
5 1011 1 1 7 ARG NH2 N -6.952 4.904 -2.153 1.00 . A A . 7 ARG NH2 1 1
5 1012 1 1 7 ARG O O -4.736 -1.124 -5.148 1.00 . A A . 7 ARG O 1 1
5 1013 1 1 8 LYS C C -6.515 -1.229 -2.340 1.00 . A A . 8 LYS C 1 1
5 1014 1 1 8 LYS CA C -5.012 -0.971 -2.395 1.00 . A A . 8 LYS CA 1 1
5 1015 1 1 8 LYS CB C -4.481 -0.682 -0.989 1.00 . A A . 8 LYS CB 1 1
5 1016 1 1 8 LYS CD C -2.478 -0.636 0.526 1.00 . A A . 8 LYS CD 1 1
5 1017 1 1 8 LYS CE C -2.930 -1.418 1.750 1.00 . A A . 8 LYS CE 1 1
5 1018 1 1 8 LYS CG C -3.076 -1.205 -0.749 1.00 . A A . 8 LYS CG 1 1
5 1019 1 1 8 LYS H H -4.584 1.038 -2.911 1.00 . A A . 8 LYS H 1 1
5 1020 1 1 8 LYS HA H -4.521 -1.851 -2.782 1.00 . A A . 8 LYS HA 1 1
5 1021 1 1 8 LYS HB2 H -4.477 0.387 -0.831 1.00 . A A . 8 LYS HB2 1 1
5 1022 1 1 8 LYS HB3 H -5.142 -1.140 -0.266 1.00 . A A . 8 LYS HB3 1 1
5 1023 1 1 8 LYS HD2 H -1.402 -0.681 0.460 1.00 . A A . 8 LYS HD2 1 1
5 1024 1 1 8 LYS HD3 H -2.791 0.394 0.631 1.00 . A A . 8 LYS HD3 1 1
5 1025 1 1 8 LYS HE2 H -2.928 -2.469 1.510 1.00 . A A . 8 LYS HE2 1 1
5 1026 1 1 8 LYS HE3 H -2.235 -1.232 2.555 1.00 . A A . 8 LYS HE3 1 1
5 1027 1 1 8 LYS HG2 H -3.111 -2.282 -0.668 1.00 . A A . 8 LYS HG2 1 1
5 1028 1 1 8 LYS HG3 H -2.451 -0.926 -1.586 1.00 . A A . 8 LYS HG3 1 1
5 1029 1 1 8 LYS HZ1 H -4.575 -0.132 1.727 1.00 . A A . 8 LYS HZ1 1 1
5 1030 1 1 8 LYS HZ2 H -4.316 -0.886 3.219 1.00 . A A . 8 LYS HZ2 1 1
5 1031 1 1 8 LYS HZ3 H -4.981 -1.761 1.933 1.00 . A A . 8 LYS HZ3 1 1
5 1032 1 1 8 LYS N N -4.708 0.140 -3.289 1.00 . A A . 8 LYS N 1 1
5 1033 1 1 8 LYS NZ N -4.296 -1.022 2.188 1.00 . A A . 8 LYS NZ 1 1
5 1034 1 1 8 LYS O O -7.319 -0.313 -2.511 1.00 . A A . 8 LYS O 1 1
5 1035 1 1 9 LYS C C -8.597 -3.539 -0.685 1.00 . A A . 9 LYS C 1 1
5 1036 1 1 9 LYS CA C -8.292 -2.860 -2.016 1.00 . A A . 9 LYS CA 1 1
5 1037 1 1 9 LYS CB C -8.657 -3.794 -3.172 1.00 . A A . 9 LYS CB 1 1
5 1038 1 1 9 LYS CD C -8.460 -4.324 -5.620 1.00 . A A . 9 LYS CD 1 1
5 1039 1 1 9 LYS CE C -7.831 -5.686 -5.363 1.00 . A A . 9 LYS CE 1 1
5 1040 1 1 9 LYS CG C -8.119 -3.336 -4.518 1.00 . A A . 9 LYS CG 1 1
5 1041 1 1 9 LYS H H -6.198 -3.168 -1.969 1.00 . A A . 9 LYS H 1 1
5 1042 1 1 9 LYS HA H -8.883 -1.961 -2.091 1.00 . A A . 9 LYS HA 1 1
5 1043 1 1 9 LYS HB2 H -8.260 -4.777 -2.965 1.00 . A A . 9 LYS HB2 1 1
5 1044 1 1 9 LYS HB3 H -9.734 -3.858 -3.242 1.00 . A A . 9 LYS HB3 1 1
5 1045 1 1 9 LYS HD2 H -9.533 -4.440 -5.670 1.00 . A A . 9 LYS HD2 1 1
5 1046 1 1 9 LYS HD3 H -8.094 -3.941 -6.562 1.00 . A A . 9 LYS HD3 1 1
5 1047 1 1 9 LYS HE2 H -7.577 -6.135 -6.310 1.00 . A A . 9 LYS HE2 1 1
5 1048 1 1 9 LYS HE3 H -6.935 -5.548 -4.777 1.00 . A A . 9 LYS HE3 1 1
5 1049 1 1 9 LYS HG2 H -8.553 -2.378 -4.761 1.00 . A A . 9 LYS HG2 1 1
5 1050 1 1 9 LYS HG3 H -7.045 -3.241 -4.451 1.00 . A A . 9 LYS HG3 1 1
5 1051 1 1 9 LYS HZ1 H -9.193 -7.269 -5.288 1.00 . A A . 9 LYS HZ1 1 1
5 1052 1 1 9 LYS HZ2 H -9.507 -6.042 -4.167 1.00 . A A . 9 LYS HZ2 1 1
5 1053 1 1 9 LYS HZ3 H -8.234 -7.124 -3.902 1.00 . A A . 9 LYS HZ3 1 1
5 1054 1 1 9 LYS N N -6.886 -2.481 -2.098 1.00 . A A . 9 LYS N 1 1
5 1055 1 1 9 LYS NZ N -8.756 -6.593 -4.629 1.00 . A A . 9 LYS NZ 1 1
5 1056 1 1 9 LYS O O -7.687 -3.967 0.027 1.00 . A A . 9 LYS O 1 1
5 1057 1 1 10 ARG C C -9.761 -5.687 0.994 1.00 . A A . 10 ARG C 1 1
5 1058 1 1 10 ARG CA C -10.304 -4.264 0.891 1.00 . A A . 10 ARG CA 1 1
5 1059 1 1 10 ARG CB C -11.830 -4.281 0.985 1.00 . A A . 10 ARG CB 1 1
5 1060 1 1 10 ARG CD C -13.772 -3.729 2.483 1.00 . A A . 10 ARG CD 1 1
5 1061 1 1 10 ARG CG C -12.353 -4.273 2.413 1.00 . A A . 10 ARG CG 1 1
5 1062 1 1 10 ARG CZ C -14.386 -3.956 4.852 1.00 . A A . 10 ARG CZ 1 1
5 1063 1 1 10 ARG H H -10.559 -3.277 -0.964 1.00 . A A . 10 ARG H 1 1
5 1064 1 1 10 ARG HA H -9.908 -3.680 1.708 1.00 . A A . 10 ARG HA 1 1
5 1065 1 1 10 ARG HB2 H -12.221 -3.411 0.477 1.00 . A A . 10 ARG HB2 1 1
5 1066 1 1 10 ARG HB3 H -12.199 -5.169 0.494 1.00 . A A . 10 ARG HB3 1 1
5 1067 1 1 10 ARG HD2 H -13.726 -2.660 2.624 1.00 . A A . 10 ARG HD2 1 1
5 1068 1 1 10 ARG HD3 H -14.273 -3.949 1.553 1.00 . A A . 10 ARG HD3 1 1
5 1069 1 1 10 ARG HE H -15.175 -5.023 3.364 1.00 . A A . 10 ARG HE 1 1
5 1070 1 1 10 ARG HG2 H -12.346 -5.283 2.794 1.00 . A A . 10 ARG HG2 1 1
5 1071 1 1 10 ARG HG3 H -11.708 -3.652 3.018 1.00 . A A . 10 ARG HG3 1 1
5 1072 1 1 10 ARG HH11 H -12.973 -2.565 4.471 1.00 . A A . 10 ARG HH11 1 1
5 1073 1 1 10 ARG HH12 H -13.415 -2.734 6.137 1.00 . A A . 10 ARG HH12 1 1
5 1074 1 1 10 ARG HH21 H -15.767 -5.255 5.554 1.00 . A A . 10 ARG HH21 1 1
5 1075 1 1 10 ARG HH22 H -15.004 -4.265 6.752 1.00 . A A . 10 ARG HH22 1 1
5 1076 1 1 10 ARG N N -9.881 -3.637 -0.355 1.00 . A A . 10 ARG N 1 1
5 1077 1 1 10 ARG NE N -14.529 -4.320 3.583 1.00 . A A . 10 ARG NE 1 1
5 1078 1 1 10 ARG NH1 N -13.520 -3.007 5.180 1.00 . A A . 10 ARG NH1 1 1
5 1079 1 1 10 ARG NH2 N -15.112 -4.540 5.798 1.00 . A A . 10 ARG NH2 1 1
5 1080 1 1 10 ARG O O -9.311 -6.114 2.058 1.00 . A A . 10 ARG O 1 1
5 1081 1 1 11 HIS C C -7.830 -7.846 0.162 1.00 . A A . 11 HIS C 1 1
5 1082 1 1 11 HIS CA C -9.322 -7.790 -0.150 1.00 . A A . 11 HIS CA 1 1
5 1083 1 1 11 HIS CB C -9.592 -8.414 -1.519 1.00 . A A . 11 HIS CB 1 1
5 1084 1 1 11 HIS CD2 C -12.137 -7.919 -1.595 1.00 . A A . 11 HIS CD2 1 1
5 1085 1 1 11 HIS CE1 C -12.814 -9.845 -2.395 1.00 . A A . 11 HIS CE1 1 1
5 1086 1 1 11 HIS CG C -11.040 -8.694 -1.775 1.00 . A A . 11 HIS CG 1 1
5 1087 1 1 11 HIS H H -10.179 -6.019 -0.932 1.00 . A A . 11 HIS H 1 1
5 1088 1 1 11 HIS HA H -9.856 -8.349 0.602 1.00 . A A . 11 HIS HA 1 1
5 1089 1 1 11 HIS HB2 H -9.242 -7.743 -2.289 1.00 . A A . 11 HIS HB2 1 1
5 1090 1 1 11 HIS HB3 H -9.055 -9.350 -1.593 1.00 . A A . 11 HIS HB3 1 1
5 1091 1 1 11 HIS HD1 H -10.943 -10.666 -2.511 1.00 . A A . 11 HIS HD1 1 1
5 1092 1 1 11 HIS HD2 H -12.152 -6.908 -1.214 1.00 . A A . 11 HIS HD2 1 1
5 1093 1 1 11 HIS HE1 H -13.446 -10.640 -2.761 1.00 . A A . 11 HIS HE1 1 1
5 1094 1 1 11 HIS N N -9.808 -6.415 -0.116 1.00 . A A . 11 HIS N 1 1
5 1095 1 1 11 HIS ND1 N -11.500 -9.894 -2.276 1.00 . A A . 11 HIS ND1 1 1
5 1096 1 1 11 HIS NE2 N -13.226 -8.658 -1.988 1.00 . A A . 11 HIS NE2 1 1
5 1097 1 1 11 HIS O O -7.300 -8.895 0.525 1.00 . A A . 11 HIS O 1 1
5 1098 1 1 12 GLY C C -4.903 -6.588 -0.979 1.00 . A A . 12 GLY C 1 1
5 1099 1 1 12 GLY CA C -5.732 -6.650 0.289 1.00 . A A . 12 GLY CA 1 1
5 1100 1 1 12 GLY H H -7.631 -5.902 -0.274 1.00 . A A . 12 GLY H 1 1
5 1101 1 1 12 GLY HA2 H -5.524 -5.773 0.884 1.00 . A A . 12 GLY HA2 1 1
5 1102 1 1 12 GLY HA3 H -5.447 -7.529 0.847 1.00 . A A . 12 GLY HA3 1 1
5 1103 1 1 12 GLY N N -7.156 -6.708 0.018 1.00 . A A . 12 GLY N 1 1
5 1104 1 1 12 GLY O O -3.733 -6.211 -0.947 1.00 . A A . 12 GLY O 1 1
5 1105 1 1 13 GLY C C -4.596 -5.532 -3.893 1.00 . A A . 13 GLY C 1 1
5 1106 1 1 13 GLY CA C -4.807 -6.939 -3.370 1.00 . A A . 13 GLY CA 1 1
5 1107 1 1 13 GLY H H -6.448 -7.251 -2.068 1.00 . A A . 13 GLY H 1 1
5 1108 1 1 13 GLY HA2 H -3.845 -7.413 -3.242 1.00 . A A . 13 GLY HA2 1 1
5 1109 1 1 13 GLY HA3 H -5.379 -7.498 -4.096 1.00 . A A . 13 GLY HA3 1 1
5 1110 1 1 13 GLY N N -5.512 -6.960 -2.102 1.00 . A A . 13 GLY N 1 1
5 1111 1 1 13 GLY O O -4.800 -4.556 -3.170 1.00 . A A . 13 GLY O 1 1
5 1112 1 1 14 CYS C C -4.787 -3.963 -7.034 1.00 . A A . 14 CYS C 1 1
5 1113 1 1 14 CYS CA C -3.944 -4.129 -5.772 1.00 . A A . 14 CYS CA 1 1
5 1114 1 1 14 CYS CB C -2.460 -3.970 -6.111 1.00 . A A . 14 CYS CB 1 1
5 1115 1 1 14 CYS H H -4.040 -6.241 -5.679 1.00 . A A . 14 CYS H 1 1
5 1116 1 1 14 CYS HA H -4.225 -3.365 -5.063 1.00 . A A . 14 CYS HA 1 1
5 1117 1 1 14 CYS HB2 H -2.216 -4.624 -6.936 1.00 . A A . 14 CYS HB2 1 1
5 1118 1 1 14 CYS HB3 H -2.273 -2.948 -6.402 1.00 . A A . 14 CYS HB3 1 1
5 1119 1 1 14 CYS N N -4.185 -5.426 -5.152 1.00 . A A . 14 CYS N 1 1
5 1120 1 1 14 CYS O O -4.720 -4.783 -7.949 1.00 . A A . 14 CYS O 1 1
5 1121 1 1 14 CYS SG S -1.336 -4.372 -4.736 1.00 . A A . 14 CYS SG 1 1
5 1122 1 1 15 SER C C -5.643 -1.978 -9.352 1.00 . A A . 15 SER C 1 1
5 1123 1 1 15 SER CA C -6.437 -2.625 -8.221 1.00 . A A . 15 SER CA 1 1
5 1124 1 1 15 SER CB C -7.597 -1.716 -7.812 1.00 . A A . 15 SER CB 1 1
5 1125 1 1 15 SER H H -5.588 -2.279 -6.312 1.00 . A A . 15 SER H 1 1
5 1126 1 1 15 SER HA H -6.833 -3.567 -8.568 1.00 . A A . 15 SER HA 1 1
5 1127 1 1 15 SER HB2 H -7.910 -1.965 -6.810 1.00 . A A . 15 SER HB2 1 1
5 1128 1 1 15 SER HB3 H -7.273 -0.686 -7.842 1.00 . A A . 15 SER HB3 1 1
5 1129 1 1 15 SER HG H -9.378 -2.402 -8.258 1.00 . A A . 15 SER HG 1 1
5 1130 1 1 15 SER N N -5.579 -2.897 -7.074 1.00 . A A . 15 SER N 1 1
5 1131 1 1 15 SER O O -5.249 -0.815 -9.263 1.00 . A A . 15 SER O 1 1
5 1132 1 1 15 SER OG O -8.701 -1.874 -8.688 1.00 . A A . 15 SER OG 1 1
5 1133 1 1 16 CYS C C -5.521 -2.285 -12.828 1.00 . A A . 16 CYS C 1 1
5 1134 1 1 16 CYS CA C -4.665 -2.244 -11.565 1.00 . A A . 16 CYS CA 1 1
5 1135 1 1 16 CYS CB C -3.395 -3.071 -11.770 1.00 . A A . 16 CYS CB 1 1
5 1136 1 1 16 CYS H H -5.752 -3.660 -10.427 1.00 . A A . 16 CYS H 1 1
5 1137 1 1 16 CYS HA H -4.389 -1.220 -11.364 1.00 . A A . 16 CYS HA 1 1
5 1138 1 1 16 CYS HB2 H -3.668 -4.057 -12.116 1.00 . A A . 16 CYS HB2 1 1
5 1139 1 1 16 CYS HB3 H -2.779 -2.591 -12.516 1.00 . A A . 16 CYS HB3 1 1
5 1140 1 1 16 CYS N N -5.412 -2.740 -10.415 1.00 . A A . 16 CYS N 1 1
5 1141 1 1 16 CYS O O -6.661 -2.747 -12.803 1.00 . A A . 16 CYS O 1 1
5 1142 1 1 16 CYS SG S -2.389 -3.274 -10.265 1.00 . A A . 16 CYS SG 1 1
5 1143 1 1 17 NH2 HN1 H -5.449 -1.784 -14.804 1.00 . A A . 17 NH2 HN1 1 1
5 1144 1 1 17 NH2 HN2 H -4.049 -1.441 -13.888 1.00 . A A . 17 NH2 HN2 1 1
5 1145 1 1 17 NH2 N N -4.962 -1.796 -13.930 1.00 . A A . 17 NH2 N 1 1
6 1146 1 1 1 TRP C C 2.102 -1.017 -2.303 1.00 . A A . 1 TRP C 1 1
6 1147 1 1 1 TRP CA C 2.536 0.183 -1.468 1.00 . A A . 1 TRP CA 1 1
6 1148 1 1 1 TRP CB C 4.061 0.291 -1.459 1.00 . A A . 1 TRP CB 1 1
6 1149 1 1 1 TRP CD1 C 5.069 1.678 -3.365 1.00 . A A . 1 TRP CD1 1 1
6 1150 1 1 1 TRP CD2 C 4.883 -0.509 -3.815 1.00 . A A . 1 TRP CD2 1 1
6 1151 1 1 1 TRP CE2 C 5.446 0.135 -4.934 1.00 . A A . 1 TRP CE2 1 1
6 1152 1 1 1 TRP CE3 C 4.673 -1.889 -3.867 1.00 . A A . 1 TRP CE3 1 1
6 1153 1 1 1 TRP CG C 4.650 0.495 -2.822 1.00 . A A . 1 TRP CG 1 1
6 1154 1 1 1 TRP CH2 C 5.583 -1.908 -6.113 1.00 . A A . 1 TRP CH2 1 1
6 1155 1 1 1 TRP CZ2 C 5.799 -0.557 -6.091 1.00 . A A . 1 TRP CZ2 1 1
6 1156 1 1 1 TRP CZ3 C 5.024 -2.574 -5.015 1.00 . A A . 1 TRP CZ3 1 1
6 1157 1 1 1 TRP H1 H 1.800 -0.805 0.254 1.00 . A A . 1 TRP H1 1 1
6 1158 1 1 1 TRP HA H 2.123 1.080 -1.906 1.00 . A A . 1 TRP HA 1 1
6 1159 1 1 1 TRP HB2 H 4.353 1.126 -0.841 1.00 . A A . 1 TRP HB2 1 1
6 1160 1 1 1 TRP HB3 H 4.476 -0.619 -1.050 1.00 . A A . 1 TRP HB3 1 1
6 1161 1 1 1 TRP HD1 H 5.021 2.630 -2.858 1.00 . A A . 1 TRP HD1 1 1
6 1162 1 1 1 TRP HE1 H 5.907 2.160 -5.230 1.00 . A A . 1 TRP HE1 1 1
6 1163 1 1 1 TRP HE3 H 4.244 -2.421 -3.030 1.00 . A A . 1 TRP HE3 1 1
6 1164 1 1 1 TRP HH2 H 5.841 -2.482 -6.990 1.00 . A A . 1 TRP HH2 1 1
6 1165 1 1 1 TRP HZ2 H 6.231 -0.057 -6.945 1.00 . A A . 1 TRP HZ2 1 1
6 1166 1 1 1 TRP HZ3 H 4.869 -3.641 -5.074 1.00 . A A . 1 TRP HZ3 1 1
6 1167 1 1 1 TRP N N 2.028 0.079 -0.104 1.00 . A A . 1 TRP N 1 1
6 1168 1 1 1 TRP NE1 N 5.548 1.468 -4.635 1.00 . A A . 1 TRP NE1 1 1
6 1169 1 1 1 TRP O O 2.263 -2.165 -1.888 1.00 . A A . 1 TRP O 1 1
6 1170 1 1 2 CYS C C 1.919 -1.819 -5.661 1.00 . A A . 2 CYS C 1 1
6 1171 1 1 2 CYS CA C 1.097 -1.801 -4.377 1.00 . A A . 2 CYS CA 1 1
6 1172 1 1 2 CYS CB C -0.384 -1.612 -4.708 1.00 . A A . 2 CYS CB 1 1
6 1173 1 1 2 CYS H H 1.452 0.192 -3.758 1.00 . A A . 2 CYS H 1 1
6 1174 1 1 2 CYS HA H 1.226 -2.744 -3.868 1.00 . A A . 2 CYS HA 1 1
6 1175 1 1 2 CYS HB2 H -0.638 -0.567 -4.606 1.00 . A A . 2 CYS HB2 1 1
6 1176 1 1 2 CYS HB3 H -0.559 -1.922 -5.729 1.00 . A A . 2 CYS HB3 1 1
6 1177 1 1 2 CYS N N 1.553 -0.744 -3.482 1.00 . A A . 2 CYS N 1 1
6 1178 1 1 2 CYS O O 2.611 -0.854 -5.981 1.00 . A A . 2 CYS O 1 1
6 1179 1 1 2 CYS SG S -1.513 -2.563 -3.639 1.00 . A A . 2 CYS SG 1 1
6 1180 1 1 3 ALA C C 2.253 -1.926 -8.603 1.00 . A A . 3 ALA C 1 1
6 1181 1 1 3 ALA CA C 2.572 -3.068 -7.645 1.00 . A A . 3 ALA CA 1 1
6 1182 1 1 3 ALA CB C 2.254 -4.408 -8.294 1.00 . A A . 3 ALA CB 1 1
6 1183 1 1 3 ALA H H 1.269 -3.661 -6.087 1.00 . A A . 3 ALA H 1 1
6 1184 1 1 3 ALA HA H 3.628 -3.049 -7.417 1.00 . A A . 3 ALA HA 1 1
6 1185 1 1 3 ALA HB1 H 2.845 -5.182 -7.826 1.00 . A A . 3 ALA HB1 1 1
6 1186 1 1 3 ALA HB2 H 1.204 -4.628 -8.166 1.00 . A A . 3 ALA HB2 1 1
6 1187 1 1 3 ALA HB3 H 2.487 -4.362 -9.347 1.00 . A A . 3 ALA HB3 1 1
6 1188 1 1 3 ALA N N 1.838 -2.925 -6.394 1.00 . A A . 3 ALA N 1 1
6 1189 1 1 3 ALA O O 1.099 -1.519 -8.737 1.00 . A A . 3 ALA O 1 1
6 1190 1 1 4 SER C C 2.385 0.858 -9.554 1.00 . A A . 4 SER C 1 1
6 1191 1 1 4 SER CA C 3.112 -0.312 -10.210 1.00 . A A . 4 SER CA 1 1
6 1192 1 1 4 SER CB C 2.337 -0.784 -11.442 1.00 . A A . 4 SER CB 1 1
6 1193 1 1 4 SER H H 4.179 -1.779 -9.118 1.00 . A A . 4 SER H 1 1
6 1194 1 1 4 SER HA H 4.094 0.016 -10.517 1.00 . A A . 4 SER HA 1 1
6 1195 1 1 4 SER HB2 H 2.748 -1.721 -11.785 1.00 . A A . 4 SER HB2 1 1
6 1196 1 1 4 SER HB3 H 1.298 -0.919 -11.179 1.00 . A A . 4 SER HB3 1 1
6 1197 1 1 4 SER HG H 2.370 -0.289 -13.337 1.00 . A A . 4 SER HG 1 1
6 1198 1 1 4 SER N N 3.283 -1.412 -9.267 1.00 . A A . 4 SER N 1 1
6 1199 1 1 4 SER O O 1.630 1.579 -10.207 1.00 . A A . 4 SER O 1 1
6 1200 1 1 4 SER OG O 2.422 0.164 -12.492 1.00 . A A . 4 SER OG 1 1
6 1201 1 1 5 GLY C C 0.467 2.014 -7.543 1.00 . A A . 5 GLY C 1 1
6 1202 1 1 5 GLY CA C 1.978 2.124 -7.535 1.00 . A A . 5 GLY CA 1 1
6 1203 1 1 5 GLY H H 3.230 0.434 -7.789 1.00 . A A . 5 GLY H 1 1
6 1204 1 1 5 GLY HA2 H 2.324 2.112 -6.511 1.00 . A A . 5 GLY HA2 1 1
6 1205 1 1 5 GLY HA3 H 2.262 3.061 -7.989 1.00 . A A . 5 GLY HA3 1 1
6 1206 1 1 5 GLY N N 2.619 1.040 -8.258 1.00 . A A . 5 GLY N 1 1
6 1207 1 1 5 GLY O O -0.236 2.996 -7.307 1.00 . A A . 5 GLY O 1 1
6 1208 1 1 6 CYS C C -2.127 0.964 -6.536 1.00 . A A . 6 CYS C 1 1
6 1209 1 1 6 CYS CA C -1.474 0.579 -7.860 1.00 . A A . 6 CYS CA 1 1
6 1210 1 1 6 CYS CB C -1.762 -0.891 -8.175 1.00 . A A . 6 CYS CB 1 1
6 1211 1 1 6 CYS H H 0.576 0.069 -7.998 1.00 . A A . 6 CYS H 1 1
6 1212 1 1 6 CYS HA H -1.889 1.194 -8.644 1.00 . A A . 6 CYS HA 1 1
6 1213 1 1 6 CYS HB2 H -0.984 -1.502 -7.743 1.00 . A A . 6 CYS HB2 1 1
6 1214 1 1 6 CYS HB3 H -2.711 -1.164 -7.738 1.00 . A A . 6 CYS HB3 1 1
6 1215 1 1 6 CYS N N -0.035 0.815 -7.818 1.00 . A A . 6 CYS N 1 1
6 1216 1 1 6 CYS O O -1.447 1.357 -5.587 1.00 . A A . 6 CYS O 1 1
6 1217 1 1 6 CYS SG S -1.838 -1.270 -9.954 1.00 . A A . 6 CYS SG 1 1
6 1218 1 1 7 ARG C C -4.560 -0.070 -4.489 1.00 . A A . 7 ARG C 1 1
6 1219 1 1 7 ARG CA C -4.195 1.187 -5.272 1.00 . A A . 7 ARG CA 1 1
6 1220 1 1 7 ARG CB C -5.462 1.964 -5.630 1.00 . A A . 7 ARG CB 1 1
6 1221 1 1 7 ARG CD C -6.537 4.194 -6.063 1.00 . A A . 7 ARG CD 1 1
6 1222 1 1 7 ARG CG C -5.231 3.455 -5.819 1.00 . A A . 7 ARG CG 1 1
6 1223 1 1 7 ARG CZ C -8.222 4.424 -7.838 1.00 . A A . 7 ARG CZ 1 1
6 1224 1 1 7 ARG H H -3.937 0.532 -7.267 1.00 . A A . 7 ARG H 1 1
6 1225 1 1 7 ARG HA H -3.563 1.810 -4.656 1.00 . A A . 7 ARG HA 1 1
6 1226 1 1 7 ARG HB2 H -5.867 1.567 -6.550 1.00 . A A . 7 ARG HB2 1 1
6 1227 1 1 7 ARG HB3 H -6.187 1.831 -4.841 1.00 . A A . 7 ARG HB3 1 1
6 1228 1 1 7 ARG HD2 H -7.230 3.945 -5.273 1.00 . A A . 7 ARG HD2 1 1
6 1229 1 1 7 ARG HD3 H -6.342 5.256 -6.048 1.00 . A A . 7 ARG HD3 1 1
6 1230 1 1 7 ARG HE H -6.703 3.131 -7.868 1.00 . A A . 7 ARG HE 1 1
6 1231 1 1 7 ARG HG2 H -4.766 3.852 -4.928 1.00 . A A . 7 ARG HG2 1 1
6 1232 1 1 7 ARG HG3 H -4.579 3.604 -6.665 1.00 . A A . 7 ARG HG3 1 1
6 1233 1 1 7 ARG HH11 H -8.464 5.673 -6.270 1.00 . A A . 7 ARG HH11 1 1
6 1234 1 1 7 ARG HH12 H -9.645 5.825 -7.529 1.00 . A A . 7 ARG HH12 1 1
6 1235 1 1 7 ARG HH21 H -8.252 3.322 -9.533 1.00 . A A . 7 ARG HH21 1 1
6 1236 1 1 7 ARG HH22 H -9.524 4.487 -9.383 1.00 . A A . 7 ARG HH22 1 1
6 1237 1 1 7 ARG N N -3.450 0.849 -6.479 1.00 . A A . 7 ARG N 1 1
6 1238 1 1 7 ARG NE N -7.134 3.840 -7.348 1.00 . A A . 7 ARG NE 1 1
6 1239 1 1 7 ARG NH1 N -8.827 5.386 -7.156 1.00 . A A . 7 ARG NH1 1 1
6 1240 1 1 7 ARG NH2 N -8.706 4.047 -9.015 1.00 . A A . 7 ARG NH2 1 1
6 1241 1 1 7 ARG O O -4.756 -1.140 -5.068 1.00 . A A . 7 ARG O 1 1
6 1242 1 1 8 LYS C C -6.501 -1.280 -2.273 1.00 . A A . 8 LYS C 1 1
6 1243 1 1 8 LYS CA C -4.991 -1.059 -2.307 1.00 . A A . 8 LYS CA 1 1
6 1244 1 1 8 LYS CB C -4.469 -0.818 -0.889 1.00 . A A . 8 LYS CB 1 1
6 1245 1 1 8 LYS CD C -2.547 -1.002 0.717 1.00 . A A . 8 LYS CD 1 1
6 1246 1 1 8 LYS CE C -1.509 -1.991 1.226 1.00 . A A . 8 LYS CE 1 1
6 1247 1 1 8 LYS CG C -3.098 -1.421 -0.636 1.00 . A A . 8 LYS CG 1 1
6 1248 1 1 8 LYS H H -4.482 0.943 -2.768 1.00 . A A . 8 LYS H 1 1
6 1249 1 1 8 LYS HA H -4.520 -1.942 -2.710 1.00 . A A . 8 LYS HA 1 1
6 1250 1 1 8 LYS HB2 H -4.408 0.247 -0.718 1.00 . A A . 8 LYS HB2 1 1
6 1251 1 1 8 LYS HB3 H -5.165 -1.249 -0.184 1.00 . A A . 8 LYS HB3 1 1
6 1252 1 1 8 LYS HD2 H -2.085 -0.030 0.623 1.00 . A A . 8 LYS HD2 1 1
6 1253 1 1 8 LYS HD3 H -3.360 -0.950 1.427 1.00 . A A . 8 LYS HD3 1 1
6 1254 1 1 8 LYS HE2 H -1.174 -1.672 2.201 1.00 . A A . 8 LYS HE2 1 1
6 1255 1 1 8 LYS HE3 H -1.968 -2.966 1.304 1.00 . A A . 8 LYS HE3 1 1
6 1256 1 1 8 LYS HG2 H -3.178 -2.497 -0.662 1.00 . A A . 8 LYS HG2 1 1
6 1257 1 1 8 LYS HG3 H -2.420 -1.089 -1.409 1.00 . A A . 8 LYS HG3 1 1
6 1258 1 1 8 LYS HZ1 H -0.115 -1.142 -0.078 1.00 . A A . 8 LYS HZ1 1 1
6 1259 1 1 8 LYS HZ2 H -0.538 -2.732 -0.469 1.00 . A A . 8 LYS HZ2 1 1
6 1260 1 1 8 LYS HZ3 H 0.496 -2.429 0.835 1.00 . A A . 8 LYS HZ3 1 1
6 1261 1 1 8 LYS N N -4.649 0.064 -3.171 1.00 . A A . 8 LYS N 1 1
6 1262 1 1 8 LYS NZ N -0.333 -2.080 0.315 1.00 . A A . 8 LYS NZ 1 1
6 1263 1 1 8 LYS O O -7.279 -0.336 -2.413 1.00 . A A . 8 LYS O 1 1
6 1264 1 1 9 LYS C C -8.667 -3.551 -0.706 1.00 . A A . 9 LYS C 1 1
6 1265 1 1 9 LYS CA C -8.323 -2.875 -2.029 1.00 . A A . 9 LYS CA 1 1
6 1266 1 1 9 LYS CB C -8.691 -3.795 -3.194 1.00 . A A . 9 LYS CB 1 1
6 1267 1 1 9 LYS CD C -8.440 -4.336 -5.635 1.00 . A A . 9 LYS CD 1 1
6 1268 1 1 9 LYS CE C -7.799 -5.690 -5.371 1.00 . A A . 9 LYS CE 1 1
6 1269 1 1 9 LYS CG C -8.121 -3.344 -4.529 1.00 . A A . 9 LYS CG 1 1
6 1270 1 1 9 LYS H H -6.239 -3.240 -1.979 1.00 . A A . 9 LYS H 1 1
6 1271 1 1 9 LYS HA H -8.890 -1.960 -2.111 1.00 . A A . 9 LYS HA 1 1
6 1272 1 1 9 LYS HB2 H -8.321 -4.787 -2.986 1.00 . A A . 9 LYS HB2 1 1
6 1273 1 1 9 LYS HB3 H -9.767 -3.833 -3.282 1.00 . A A . 9 LYS HB3 1 1
6 1274 1 1 9 LYS HD2 H -9.510 -4.463 -5.695 1.00 . A A . 9 LYS HD2 1 1
6 1275 1 1 9 LYS HD3 H -8.068 -3.947 -6.573 1.00 . A A . 9 LYS HD3 1 1
6 1276 1 1 9 LYS HE2 H -7.526 -6.135 -6.316 1.00 . A A . 9 LYS HE2 1 1
6 1277 1 1 9 LYS HE3 H -6.912 -5.542 -4.773 1.00 . A A . 9 LYS HE3 1 1
6 1278 1 1 9 LYS HG2 H -8.547 -2.385 -4.786 1.00 . A A . 9 LYS HG2 1 1
6 1279 1 1 9 LYS HG3 H -7.049 -3.252 -4.439 1.00 . A A . 9 LYS HG3 1 1
6 1280 1 1 9 LYS HZ1 H -9.670 -6.186 -4.587 1.00 . A A . 9 LYS HZ1 1 1
6 1281 1 1 9 LYS HZ2 H -8.369 -6.789 -3.690 1.00 . A A . 9 LYS HZ2 1 1
6 1282 1 1 9 LYS HZ3 H -8.792 -7.515 -5.158 1.00 . A A . 9 LYS HZ3 1 1
6 1283 1 1 9 LYS N N -6.907 -2.530 -2.084 1.00 . A A . 9 LYS N 1 1
6 1284 1 1 9 LYS NZ N -8.722 -6.610 -4.651 1.00 . A A . 9 LYS NZ 1 1
6 1285 1 1 9 LYS O O -7.779 -3.945 0.049 1.00 . A A . 9 LYS O 1 1
6 1286 1 1 10 ARG C C -9.843 -5.716 0.942 1.00 . A A . 10 ARG C 1 1
6 1287 1 1 10 ARG CA C -10.421 -4.312 0.800 1.00 . A A . 10 ARG CA 1 1
6 1288 1 1 10 ARG CB C -11.949 -4.371 0.827 1.00 . A A . 10 ARG CB 1 1
6 1289 1 1 10 ARG CD C -13.945 -3.021 1.540 1.00 . A A . 10 ARG CD 1 1
6 1290 1 1 10 ARG CG C -12.614 -3.005 0.805 1.00 . A A . 10 ARG CG 1 1
6 1291 1 1 10 ARG CZ C -14.816 -2.562 3.793 1.00 . A A . 10 ARG CZ 1 1
6 1292 1 1 10 ARG H H -10.622 -3.348 -1.073 1.00 . A A . 10 ARG H 1 1
6 1293 1 1 10 ARG HA H -10.079 -3.709 1.628 1.00 . A A . 10 ARG HA 1 1
6 1294 1 1 10 ARG HB2 H -12.292 -4.927 -0.035 1.00 . A A . 10 ARG HB2 1 1
6 1295 1 1 10 ARG HB3 H -12.262 -4.885 1.723 1.00 . A A . 10 ARG HB3 1 1
6 1296 1 1 10 ARG HD2 H -14.603 -2.296 1.082 1.00 . A A . 10 ARG HD2 1 1
6 1297 1 1 10 ARG HD3 H -14.377 -4.005 1.451 1.00 . A A . 10 ARG HD3 1 1
6 1298 1 1 10 ARG HE H -12.883 -2.566 3.296 1.00 . A A . 10 ARG HE 1 1
6 1299 1 1 10 ARG HG2 H -11.960 -2.289 1.283 1.00 . A A . 10 ARG HG2 1 1
6 1300 1 1 10 ARG HG3 H -12.782 -2.712 -0.221 1.00 . A A . 10 ARG HG3 1 1
6 1301 1 1 10 ARG HH11 H -16.225 -2.954 2.400 1.00 . A A . 10 ARG HH11 1 1
6 1302 1 1 10 ARG HH12 H -16.825 -2.628 3.992 1.00 . A A . 10 ARG HH12 1 1
6 1303 1 1 10 ARG HH21 H -13.661 -2.137 5.397 1.00 . A A . 10 ARG HH21 1 1
6 1304 1 1 10 ARG HH22 H -15.366 -2.164 5.696 1.00 . A A . 10 ARG HH22 1 1
6 1305 1 1 10 ARG N N -9.961 -3.682 -0.432 1.00 . A A . 10 ARG N 1 1
6 1306 1 1 10 ARG NE N -13.793 -2.694 2.955 1.00 . A A . 10 ARG NE 1 1
6 1307 1 1 10 ARG NH1 N -16.058 -2.727 3.359 1.00 . A A . 10 ARG NH1 1 1
6 1308 1 1 10 ARG NH2 N -14.596 -2.263 5.067 1.00 . A A . 10 ARG NH2 1 1
6 1309 1 1 10 ARG O O -9.391 -6.107 2.019 1.00 . A A . 10 ARG O 1 1
6 1310 1 1 11 HIS C C -7.850 -7.844 0.173 1.00 . A A . 11 HIS C 1 1
6 1311 1 1 11 HIS CA C -9.340 -7.834 -0.149 1.00 . A A . 11 HIS CA 1 1
6 1312 1 1 11 HIS CB C -9.585 -8.499 -1.504 1.00 . A A . 11 HIS CB 1 1
6 1313 1 1 11 HIS CD2 C -12.020 -7.723 -1.949 1.00 . A A . 11 HIS CD2 1 1
6 1314 1 1 11 HIS CE1 C -12.905 -9.681 -2.389 1.00 . A A . 11 HIS CE1 1 1
6 1315 1 1 11 HIS CG C -11.037 -8.647 -1.845 1.00 . A A . 11 HIS CG 1 1
6 1316 1 1 11 HIS H H -10.237 -6.105 -0.980 1.00 . A A . 11 HIS H 1 1
6 1317 1 1 11 HIS HA H -9.864 -8.389 0.614 1.00 . A A . 11 HIS HA 1 1
6 1318 1 1 11 HIS HB2 H -9.122 -7.904 -2.278 1.00 . A A . 11 HIS HB2 1 1
6 1319 1 1 11 HIS HB3 H -9.142 -9.484 -1.500 1.00 . A A . 11 HIS HB3 1 1
6 1320 1 1 11 HIS HD1 H -11.167 -10.730 -2.132 1.00 . A A . 11 HIS HD1 1 1
6 1321 1 1 11 HIS HD2 H -11.919 -6.658 -1.794 1.00 . A A . 11 HIS HD2 1 1
6 1322 1 1 11 HIS HE1 H -13.614 -10.454 -2.642 1.00 . A A . 11 HIS HE1 1 1
6 1323 1 1 11 HIS N N -9.863 -6.472 -0.152 1.00 . A A . 11 HIS N 1 1
6 1324 1 1 11 HIS ND1 N -11.623 -9.863 -2.126 1.00 . A A . 11 HIS ND1 1 1
6 1325 1 1 11 HIS NE2 N -13.171 -8.391 -2.287 1.00 . A A . 11 HIS NE2 1 1
6 1326 1 1 11 HIS O O -7.295 -8.871 0.562 1.00 . A A . 11 HIS O 1 1
6 1327 1 1 12 GLY C C -4.950 -6.534 -0.979 1.00 . A A . 12 GLY C 1 1
6 1328 1 1 12 GLY CA C -5.785 -6.590 0.286 1.00 . A A . 12 GLY CA 1 1
6 1329 1 1 12 GLY H H -7.699 -5.905 -0.305 1.00 . A A . 12 GLY H 1 1
6 1330 1 1 12 GLY HA2 H -5.604 -5.696 0.864 1.00 . A A . 12 GLY HA2 1 1
6 1331 1 1 12 GLY HA3 H -5.480 -7.450 0.865 1.00 . A A . 12 GLY HA3 1 1
6 1332 1 1 12 GLY N N -7.205 -6.692 0.009 1.00 . A A . 12 GLY N 1 1
6 1333 1 1 12 GLY O O -3.789 -6.127 -0.946 1.00 . A A . 12 GLY O 1 1
6 1334 1 1 13 GLY C C -4.580 -5.528 -3.872 1.00 . A A . 13 GLY C 1 1
6 1335 1 1 13 GLY CA C -4.829 -6.933 -3.360 1.00 . A A . 13 GLY CA 1 1
6 1336 1 1 13 GLY H H -6.469 -7.259 -2.062 1.00 . A A . 13 GLY H 1 1
6 1337 1 1 13 GLY HA2 H -3.880 -7.432 -3.231 1.00 . A A . 13 GLY HA2 1 1
6 1338 1 1 13 GLY HA3 H -5.412 -7.472 -4.094 1.00 . A A . 13 GLY HA3 1 1
6 1339 1 1 13 GLY N N -5.541 -6.945 -2.095 1.00 . A A . 13 GLY N 1 1
6 1340 1 1 13 GLY O O -4.762 -4.552 -3.143 1.00 . A A . 13 GLY O 1 1
6 1341 1 1 14 CYS C C -4.693 -3.943 -7.016 1.00 . A A . 14 CYS C 1 1
6 1342 1 1 14 CYS CA C -3.882 -4.128 -5.737 1.00 . A A . 14 CYS CA 1 1
6 1343 1 1 14 CYS CB C -2.389 -3.994 -6.043 1.00 . A A . 14 CYS CB 1 1
6 1344 1 1 14 CYS H H -4.033 -6.238 -5.660 1.00 . A A . 14 CYS H 1 1
6 1345 1 1 14 CYS HA H -4.167 -3.362 -5.032 1.00 . A A . 14 CYS HA 1 1
6 1346 1 1 14 CYS HB2 H -2.137 -4.651 -6.864 1.00 . A A . 14 CYS HB2 1 1
6 1347 1 1 14 CYS HB3 H -2.178 -2.974 -6.328 1.00 . A A . 14 CYS HB3 1 1
6 1348 1 1 14 CYS N N -4.160 -5.424 -5.128 1.00 . A A . 14 CYS N 1 1
6 1349 1 1 14 CYS O O -4.585 -4.736 -7.952 1.00 . A A . 14 CYS O 1 1
6 1350 1 1 14 CYS SG S -1.302 -4.417 -4.644 1.00 . A A . 14 CYS SG 1 1
6 1351 1 1 15 SER C C -5.527 -1.913 -9.303 1.00 . A A . 15 SER C 1 1
6 1352 1 1 15 SER CA C -6.339 -2.604 -8.211 1.00 . A A . 15 SER CA 1 1
6 1353 1 1 15 SER CB C -7.525 -1.726 -7.810 1.00 . A A . 15 SER CB 1 1
6 1354 1 1 15 SER H H -5.548 -2.297 -6.271 1.00 . A A . 15 SER H 1 1
6 1355 1 1 15 SER HA H -6.709 -3.544 -8.594 1.00 . A A . 15 SER HA 1 1
6 1356 1 1 15 SER HB2 H -7.831 -1.976 -6.805 1.00 . A A . 15 SER HB2 1 1
6 1357 1 1 15 SER HB3 H -7.231 -0.688 -7.849 1.00 . A A . 15 SER HB3 1 1
6 1358 1 1 15 SER HG H -9.288 -1.251 -8.519 1.00 . A A . 15 SER HG 1 1
6 1359 1 1 15 SER N N -5.506 -2.892 -7.049 1.00 . A A . 15 SER N 1 1
6 1360 1 1 15 SER O O -4.800 -0.954 -9.041 1.00 . A A . 15 SER O 1 1
6 1361 1 1 15 SER OG O -8.623 -1.924 -8.684 1.00 . A A . 15 SER OG 1 1
6 1362 1 1 16 CYS C C -5.847 -1.715 -12.879 1.00 . A A . 16 CYS C 1 1
6 1363 1 1 16 CYS CA C -4.935 -1.842 -11.662 1.00 . A A . 16 CYS CA 1 1
6 1364 1 1 16 CYS CB C -3.723 -2.708 -12.009 1.00 . A A . 16 CYS CB 1 1
6 1365 1 1 16 CYS H H -6.250 -3.175 -10.676 1.00 . A A . 16 CYS H 1 1
6 1366 1 1 16 CYS HA H -4.594 -0.857 -11.380 1.00 . A A . 16 CYS HA 1 1
6 1367 1 1 16 CYS HB2 H -4.066 -3.640 -12.434 1.00 . A A . 16 CYS HB2 1 1
6 1368 1 1 16 CYS HB3 H -3.115 -2.190 -12.735 1.00 . A A . 16 CYS HB3 1 1
6 1369 1 1 16 CYS N N -5.655 -2.409 -10.530 1.00 . A A . 16 CYS N 1 1
6 1370 1 1 16 CYS O O -6.964 -2.234 -12.887 1.00 . A A . 16 CYS O 1 1
6 1371 1 1 16 CYS SG S -2.664 -3.110 -10.581 1.00 . A A . 16 CYS SG 1 1
6 1372 1 1 17 NH2 HN1 H -5.894 -0.890 -14.743 1.00 . A A . 17 NH2 HN1 1 1
6 1373 1 1 17 NH2 HN2 H -4.468 -0.631 -13.839 1.00 . A A . 17 NH2 HN2 1 1
6 1374 1 1 17 NH2 N N -5.365 -1.021 -13.905 1.00 . A A . 17 NH2 N 1 1
7 1375 1 1 1 TRP C C 1.827 -1.148 -2.169 1.00 . A A . 1 TRP C 1 1
7 1376 1 1 1 TRP CA C 2.196 0.024 -1.267 1.00 . A A . 1 TRP CA 1 1
7 1377 1 1 1 TRP CB C 3.716 0.108 -1.117 1.00 . A A . 1 TRP CB 1 1
7 1378 1 1 1 TRP CD1 C 4.910 1.532 -2.881 1.00 . A A . 1 TRP CD1 1 1
7 1379 1 1 1 TRP CD2 C 4.740 -0.637 -3.410 1.00 . A A . 1 TRP CD2 1 1
7 1380 1 1 1 TRP CE2 C 5.411 0.028 -4.454 1.00 . A A . 1 TRP CE2 1 1
7 1381 1 1 1 TRP CE3 C 4.519 -2.013 -3.520 1.00 . A A . 1 TRP CE3 1 1
7 1382 1 1 1 TRP CG C 4.429 0.342 -2.414 1.00 . A A . 1 TRP CG 1 1
7 1383 1 1 1 TRP CH2 C 5.630 -1.982 -5.674 1.00 . A A . 1 TRP CH2 1 1
7 1384 1 1 1 TRP CZ2 C 5.859 -0.636 -5.593 1.00 . A A . 1 TRP CZ2 1 1
7 1385 1 1 1 TRP CZ3 C 4.965 -2.671 -4.650 1.00 . A A . 1 TRP CZ3 1 1
7 1386 1 1 1 TRP H1 H 1.664 -0.946 0.539 1.00 . A A . 1 TRP H1 1 1
7 1387 1 1 1 TRP HA H 1.837 0.937 -1.717 1.00 . A A . 1 TRP HA 1 1
7 1388 1 1 1 TRP HB2 H 3.961 0.921 -0.449 1.00 . A A . 1 TRP HB2 1 1
7 1389 1 1 1 TRP HB3 H 4.080 -0.818 -0.697 1.00 . A A . 1 TRP HB3 1 1
7 1390 1 1 1 TRP HD1 H 4.828 2.470 -2.354 1.00 . A A . 1 TRP HD1 1 1
7 1391 1 1 1 TRP HE1 H 5.921 2.053 -4.647 1.00 . A A . 1 TRP HE1 1 1
7 1392 1 1 1 TRP HE3 H 4.009 -2.561 -2.741 1.00 . A A . 1 TRP HE3 1 1
7 1393 1 1 1 TRP HH2 H 5.961 -2.537 -6.539 1.00 . A A . 1 TRP HH2 1 1
7 1394 1 1 1 TRP HZ2 H 6.374 -0.120 -6.390 1.00 . A A . 1 TRP HZ2 1 1
7 1395 1 1 1 TRP HZ3 H 4.802 -3.734 -4.754 1.00 . A A . 1 TRP HZ3 1 1
7 1396 1 1 1 TRP N N 1.564 -0.107 0.042 1.00 . A A . 1 TRP N 1 1
7 1397 1 1 1 TRP NE1 N 5.501 1.350 -4.108 1.00 . A A . 1 TRP NE1 1 1
7 1398 1 1 1 TRP O O 1.922 -2.308 -1.768 1.00 . A A . 1 TRP O 1 1
7 1399 1 1 2 CYS C C 1.926 -1.830 -5.578 1.00 . A A . 2 CYS C 1 1
7 1400 1 1 2 CYS CA C 1.020 -1.866 -4.351 1.00 . A A . 2 CYS CA 1 1
7 1401 1 1 2 CYS CB C -0.439 -1.680 -4.773 1.00 . A A . 2 CYS CB 1 1
7 1402 1 1 2 CYS H H 1.350 0.105 -3.654 1.00 . A A . 2 CYS H 1 1
7 1403 1 1 2 CYS HA H 1.126 -2.827 -3.869 1.00 . A A . 2 CYS HA 1 1
7 1404 1 1 2 CYS HB2 H -0.696 -0.634 -4.696 1.00 . A A . 2 CYS HB2 1 1
7 1405 1 1 2 CYS HB3 H -0.551 -1.998 -5.798 1.00 . A A . 2 CYS HB3 1 1
7 1406 1 1 2 CYS N N 1.405 -0.839 -3.391 1.00 . A A . 2 CYS N 1 1
7 1407 1 1 2 CYS O O 2.648 -0.859 -5.801 1.00 . A A . 2 CYS O 1 1
7 1408 1 1 2 CYS SG S -1.630 -2.619 -3.765 1.00 . A A . 2 CYS SG 1 1
7 1409 1 1 3 ALA C C 2.368 -1.850 -8.545 1.00 . A A . 3 ALA C 1 1
7 1410 1 1 3 ALA CA C 2.693 -2.983 -7.579 1.00 . A A . 3 ALA CA 1 1
7 1411 1 1 3 ALA CB C 2.489 -4.330 -8.255 1.00 . A A . 3 ALA CB 1 1
7 1412 1 1 3 ALA H H 1.283 -3.638 -6.142 1.00 . A A . 3 ALA H 1 1
7 1413 1 1 3 ALA HA H 3.731 -2.908 -7.287 1.00 . A A . 3 ALA HA 1 1
7 1414 1 1 3 ALA HB1 H 2.770 -5.121 -7.574 1.00 . A A . 3 ALA HB1 1 1
7 1415 1 1 3 ALA HB2 H 1.450 -4.443 -8.528 1.00 . A A . 3 ALA HB2 1 1
7 1416 1 1 3 ALA HB3 H 3.103 -4.385 -9.142 1.00 . A A . 3 ALA HB3 1 1
7 1417 1 1 3 ALA N N 1.880 -2.895 -6.373 1.00 . A A . 3 ALA N 1 1
7 1418 1 1 3 ALA O O 1.210 -1.456 -8.689 1.00 . A A . 3 ALA O 1 1
7 1419 1 1 4 SER C C 2.457 0.922 -9.517 1.00 . A A . 4 SER C 1 1
7 1420 1 1 4 SER CA C 3.220 -0.235 -10.155 1.00 . A A . 4 SER CA 1 1
7 1421 1 1 4 SER CB C 2.477 -0.727 -11.399 1.00 . A A . 4 SER CB 1 1
7 1422 1 1 4 SER H H 4.296 -1.684 -9.048 1.00 . A A . 4 SER H 1 1
7 1423 1 1 4 SER HA H 4.200 0.113 -10.446 1.00 . A A . 4 SER HA 1 1
7 1424 1 1 4 SER HB2 H 2.910 -1.659 -11.728 1.00 . A A . 4 SER HB2 1 1
7 1425 1 1 4 SER HB3 H 1.435 -0.880 -11.156 1.00 . A A . 4 SER HB3 1 1
7 1426 1 1 4 SER HG H 1.693 0.372 -12.818 1.00 . A A . 4 SER HG 1 1
7 1427 1 1 4 SER N N 3.396 -1.327 -9.205 1.00 . A A . 4 SER N 1 1
7 1428 1 1 4 SER O O 1.698 1.623 -10.185 1.00 . A A . 4 SER O 1 1
7 1429 1 1 4 SER OG O 2.567 0.215 -12.453 1.00 . A A . 4 SER OG 1 1
7 1430 1 1 5 GLY C C 0.478 2.068 -7.583 1.00 . A A . 5 GLY C 1 1
7 1431 1 1 5 GLY CA C 1.988 2.186 -7.510 1.00 . A A . 5 GLY CA 1 1
7 1432 1 1 5 GLY H H 3.280 0.524 -7.736 1.00 . A A . 5 GLY H 1 1
7 1433 1 1 5 GLY HA2 H 2.291 2.165 -6.474 1.00 . A A . 5 GLY HA2 1 1
7 1434 1 1 5 GLY HA3 H 2.285 3.130 -7.943 1.00 . A A . 5 GLY HA3 1 1
7 1435 1 1 5 GLY N N 2.664 1.114 -8.217 1.00 . A A . 5 GLY N 1 1
7 1436 1 1 5 GLY O O -0.238 3.056 -7.414 1.00 . A A . 5 GLY O 1 1
7 1437 1 1 6 CYS C C -2.147 0.992 -6.636 1.00 . A A . 6 CYS C 1 1
7 1438 1 1 6 CYS CA C -1.441 0.614 -7.935 1.00 . A A . 6 CYS CA 1 1
7 1439 1 1 6 CYS CB C -1.708 -0.856 -8.264 1.00 . A A . 6 CYS CB 1 1
7 1440 1 1 6 CYS H H 0.614 0.109 -7.962 1.00 . A A . 6 CYS H 1 1
7 1441 1 1 6 CYS HA H -1.829 1.228 -8.733 1.00 . A A . 6 CYS HA 1 1
7 1442 1 1 6 CYS HB2 H -0.939 -1.464 -7.810 1.00 . A A . 6 CYS HB2 1 1
7 1443 1 1 6 CYS HB3 H -2.668 -1.139 -7.858 1.00 . A A . 6 CYS HB3 1 1
7 1444 1 1 6 CYS N N -0.007 0.858 -7.838 1.00 . A A . 6 CYS N 1 1
7 1445 1 1 6 CYS O O -1.507 1.386 -5.661 1.00 . A A . 6 CYS O 1 1
7 1446 1 1 6 CYS SG S -1.727 -1.228 -10.047 1.00 . A A . 6 CYS SG 1 1
7 1447 1 1 7 ARG C C -4.558 -0.049 -4.628 1.00 . A A . 7 ARG C 1 1
7 1448 1 1 7 ARG CA C -4.263 1.201 -5.453 1.00 . A A . 7 ARG CA 1 1
7 1449 1 1 7 ARG CB C -5.574 1.872 -5.866 1.00 . A A . 7 ARG CB 1 1
7 1450 1 1 7 ARG CD C -6.791 4.043 -6.215 1.00 . A A . 7 ARG CD 1 1
7 1451 1 1 7 ARG CG C -5.435 3.359 -6.150 1.00 . A A . 7 ARG CG 1 1
7 1452 1 1 7 ARG CZ C -7.628 3.504 -8.463 1.00 . A A . 7 ARG CZ 1 1
7 1453 1 1 7 ARG H H -3.924 0.551 -7.439 1.00 . A A . 7 ARG H 1 1
7 1454 1 1 7 ARG HA H -3.692 1.889 -4.850 1.00 . A A . 7 ARG HA 1 1
7 1455 1 1 7 ARG HB2 H -5.947 1.390 -6.759 1.00 . A A . 7 ARG HB2 1 1
7 1456 1 1 7 ARG HB3 H -6.296 1.745 -5.073 1.00 . A A . 7 ARG HB3 1 1
7 1457 1 1 7 ARG HD2 H -7.230 4.036 -5.229 1.00 . A A . 7 ARG HD2 1 1
7 1458 1 1 7 ARG HD3 H -6.649 5.064 -6.538 1.00 . A A . 7 ARG HD3 1 1
7 1459 1 1 7 ARG HE H -8.394 2.799 -6.762 1.00 . A A . 7 ARG HE 1 1
7 1460 1 1 7 ARG HG2 H -4.852 3.812 -5.363 1.00 . A A . 7 ARG HG2 1 1
7 1461 1 1 7 ARG HG3 H -4.930 3.489 -7.096 1.00 . A A . 7 ARG HG3 1 1
7 1462 1 1 7 ARG HH11 H -6.045 4.759 -8.423 1.00 . A A . 7 ARG HH11 1 1
7 1463 1 1 7 ARG HH12 H -6.645 4.371 -10.002 1.00 . A A . 7 ARG HH12 1 1
7 1464 1 1 7 ARG HH21 H -9.194 2.281 -8.835 1.00 . A A . 7 ARG HH21 1 1
7 1465 1 1 7 ARG HH22 H -8.436 2.962 -10.235 1.00 . A A . 7 ARG HH22 1 1
7 1466 1 1 7 ARG N N -3.471 0.871 -6.631 1.00 . A A . 7 ARG N 1 1
7 1467 1 1 7 ARG NE N -7.699 3.374 -7.143 1.00 . A A . 7 ARG NE 1 1
7 1468 1 1 7 ARG NH1 N -6.697 4.276 -9.008 1.00 . A A . 7 ARG NH1 1 1
7 1469 1 1 7 ARG NH2 N -8.490 2.863 -9.242 1.00 . A A . 7 ARG NH2 1 1
7 1470 1 1 7 ARG O O -4.607 -1.159 -5.158 1.00 . A A . 7 ARG O 1 1
7 1471 1 1 8 LYS C C -6.538 -1.265 -2.390 1.00 . A A . 8 LYS C 1 1
7 1472 1 1 8 LYS CA C -5.041 -0.971 -2.427 1.00 . A A . 8 LYS CA 1 1
7 1473 1 1 8 LYS CB C -4.537 -0.656 -1.018 1.00 . A A . 8 LYS CB 1 1
7 1474 1 1 8 LYS CD C -2.685 -0.840 0.669 1.00 . A A . 8 LYS CD 1 1
7 1475 1 1 8 LYS CE C -2.418 0.647 0.851 1.00 . A A . 8 LYS CE 1 1
7 1476 1 1 8 LYS CG C -3.128 -1.157 -0.749 1.00 . A A . 8 LYS CG 1 1
7 1477 1 1 8 LYS H H -4.698 1.048 -2.963 1.00 . A A . 8 LYS H 1 1
7 1478 1 1 8 LYS HA H -4.524 -1.842 -2.799 1.00 . A A . 8 LYS HA 1 1
7 1479 1 1 8 LYS HB2 H -4.549 0.414 -0.874 1.00 . A A . 8 LYS HB2 1 1
7 1480 1 1 8 LYS HB3 H -5.203 -1.115 -0.299 1.00 . A A . 8 LYS HB3 1 1
7 1481 1 1 8 LYS HD2 H -3.461 -1.140 1.356 1.00 . A A . 8 LYS HD2 1 1
7 1482 1 1 8 LYS HD3 H -1.779 -1.388 0.885 1.00 . A A . 8 LYS HD3 1 1
7 1483 1 1 8 LYS HE2 H -3.229 1.202 0.405 1.00 . A A . 8 LYS HE2 1 1
7 1484 1 1 8 LYS HE3 H -2.370 0.864 1.907 1.00 . A A . 8 LYS HE3 1 1
7 1485 1 1 8 LYS HG2 H -3.103 -2.227 -0.891 1.00 . A A . 8 LYS HG2 1 1
7 1486 1 1 8 LYS HG3 H -2.449 -0.683 -1.443 1.00 . A A . 8 LYS HG3 1 1
7 1487 1 1 8 LYS HZ1 H -0.733 0.269 -0.325 1.00 . A A . 8 LYS HZ1 1 1
7 1488 1 1 8 LYS HZ2 H -0.456 1.359 0.938 1.00 . A A . 8 LYS HZ2 1 1
7 1489 1 1 8 LYS HZ3 H -1.304 1.857 -0.438 1.00 . A A . 8 LYS HZ3 1 1
7 1490 1 1 8 LYS N N -4.751 0.139 -3.328 1.00 . A A . 8 LYS N 1 1
7 1491 1 1 8 LYS NZ N -1.139 1.062 0.212 1.00 . A A . 8 LYS NZ 1 1
7 1492 1 1 8 LYS O O -7.357 -0.409 -2.724 1.00 . A A . 8 LYS O 1 1
7 1493 1 1 9 LYS C C -8.574 -3.568 -0.564 1.00 . A A . 9 LYS C 1 1
7 1494 1 1 9 LYS CA C -8.284 -2.887 -1.897 1.00 . A A . 9 LYS CA 1 1
7 1495 1 1 9 LYS CB C -8.633 -3.830 -3.051 1.00 . A A . 9 LYS CB 1 1
7 1496 1 1 9 LYS CD C -8.547 -4.293 -5.518 1.00 . A A . 9 LYS CD 1 1
7 1497 1 1 9 LYS CE C -7.951 -5.683 -5.354 1.00 . A A . 9 LYS CE 1 1
7 1498 1 1 9 LYS CG C -8.110 -3.363 -4.398 1.00 . A A . 9 LYS CG 1 1
7 1499 1 1 9 LYS H H -6.187 -3.118 -1.729 1.00 . A A . 9 LYS H 1 1
7 1500 1 1 9 LYS HA H -8.893 -1.999 -1.974 1.00 . A A . 9 LYS HA 1 1
7 1501 1 1 9 LYS HB2 H -8.212 -4.804 -2.843 1.00 . A A . 9 LYS HB2 1 1
7 1502 1 1 9 LYS HB3 H -9.707 -3.919 -3.116 1.00 . A A . 9 LYS HB3 1 1
7 1503 1 1 9 LYS HD2 H -9.623 -4.372 -5.510 1.00 . A A . 9 LYS HD2 1 1
7 1504 1 1 9 LYS HD3 H -8.221 -3.881 -6.463 1.00 . A A . 9 LYS HD3 1 1
7 1505 1 1 9 LYS HE2 H -7.837 -6.129 -6.329 1.00 . A A . 9 LYS HE2 1 1
7 1506 1 1 9 LYS HE3 H -6.982 -5.591 -4.884 1.00 . A A . 9 LYS HE3 1 1
7 1507 1 1 9 LYS HG2 H -8.491 -2.372 -4.598 1.00 . A A . 9 LYS HG2 1 1
7 1508 1 1 9 LYS HG3 H -7.030 -3.336 -4.366 1.00 . A A . 9 LYS HG3 1 1
7 1509 1 1 9 LYS HZ1 H -8.302 -6.852 -3.659 1.00 . A A . 9 LYS HZ1 1 1
7 1510 1 1 9 LYS HZ2 H -9.085 -7.410 -5.051 1.00 . A A . 9 LYS HZ2 1 1
7 1511 1 1 9 LYS HZ3 H -9.676 -6.051 -4.234 1.00 . A A . 9 LYS HZ3 1 1
7 1512 1 1 9 LYS N N -6.887 -2.479 -1.981 1.00 . A A . 9 LYS N 1 1
7 1513 1 1 9 LYS NZ N -8.815 -6.560 -4.516 1.00 . A A . 9 LYS NZ 1 1
7 1514 1 1 9 LYS O O -7.661 -4.049 0.109 1.00 . A A . 9 LYS O 1 1
7 1515 1 1 10 ARG C C -9.791 -5.681 1.128 1.00 . A A . 10 ARG C 1 1
7 1516 1 1 10 ARG CA C -10.256 -4.230 1.065 1.00 . A A . 10 ARG CA 1 1
7 1517 1 1 10 ARG CB C -11.777 -4.163 1.220 1.00 . A A . 10 ARG CB 1 1
7 1518 1 1 10 ARG CD C -13.731 -2.628 1.591 1.00 . A A . 10 ARG CD 1 1
7 1519 1 1 10 ARG CG C -12.355 -2.782 0.961 1.00 . A A . 10 ARG CG 1 1
7 1520 1 1 10 ARG CZ C -13.895 -0.207 1.988 1.00 . A A . 10 ARG CZ 1 1
7 1521 1 1 10 ARG H H -10.530 -3.206 -0.767 1.00 . A A . 10 ARG H 1 1
7 1522 1 1 10 ARG HA H -9.797 -3.681 1.874 1.00 . A A . 10 ARG HA 1 1
7 1523 1 1 10 ARG HB2 H -12.229 -4.855 0.525 1.00 . A A . 10 ARG HB2 1 1
7 1524 1 1 10 ARG HB3 H -12.037 -4.456 2.227 1.00 . A A . 10 ARG HB3 1 1
7 1525 1 1 10 ARG HD2 H -14.391 -3.370 1.170 1.00 . A A . 10 ARG HD2 1 1
7 1526 1 1 10 ARG HD3 H -13.644 -2.786 2.656 1.00 . A A . 10 ARG HD3 1 1
7 1527 1 1 10 ARG HE H -15.011 -1.226 0.687 1.00 . A A . 10 ARG HE 1 1
7 1528 1 1 10 ARG HG2 H -11.694 -2.039 1.382 1.00 . A A . 10 ARG HG2 1 1
7 1529 1 1 10 ARG HG3 H -12.439 -2.631 -0.105 1.00 . A A . 10 ARG HG3 1 1
7 1530 1 1 10 ARG HH11 H -12.503 -1.158 3.101 1.00 . A A . 10 ARG HH11 1 1
7 1531 1 1 10 ARG HH12 H -12.628 0.549 3.371 1.00 . A A . 10 ARG HH12 1 1
7 1532 1 1 10 ARG HH21 H -15.185 1.022 1.033 1.00 . A A . 10 ARG HH21 1 1
7 1533 1 1 10 ARG HH22 H -14.155 1.787 2.195 1.00 . A A . 10 ARG HH22 1 1
7 1534 1 1 10 ARG N N -9.848 -3.606 -0.188 1.00 . A A . 10 ARG N 1 1
7 1535 1 1 10 ARG NE N -14.296 -1.301 1.353 1.00 . A A . 10 ARG NE 1 1
7 1536 1 1 10 ARG NH1 N -12.930 -0.278 2.894 1.00 . A A . 10 ARG NH1 1 1
7 1537 1 1 10 ARG NH2 N -14.458 0.964 1.716 1.00 . A A . 10 ARG NH2 1 1
7 1538 1 1 10 ARG O O -9.422 -6.180 2.191 1.00 . A A . 10 ARG O 1 1
7 1539 1 1 11 HIS C C -7.898 -7.882 0.192 1.00 . A A . 11 HIS C 1 1
7 1540 1 1 11 HIS CA C -9.391 -7.748 -0.095 1.00 . A A . 11 HIS CA 1 1
7 1541 1 1 11 HIS CB C -9.712 -8.325 -1.474 1.00 . A A . 11 HIS CB 1 1
7 1542 1 1 11 HIS CD2 C -12.230 -7.736 -1.668 1.00 . A A . 11 HIS CD2 1 1
7 1543 1 1 11 HIS CE1 C -12.995 -9.742 -2.115 1.00 . A A . 11 HIS CE1 1 1
7 1544 1 1 11 HIS CG C -11.171 -8.579 -1.693 1.00 . A A . 11 HIS CG 1 1
7 1545 1 1 11 HIS H H -10.115 -5.901 -0.833 1.00 . A A . 11 HIS H 1 1
7 1546 1 1 11 HIS HA H -9.939 -8.301 0.653 1.00 . A A . 11 HIS HA 1 1
7 1547 1 1 11 HIS HB2 H -9.379 -7.632 -2.233 1.00 . A A . 11 HIS HB2 1 1
7 1548 1 1 11 HIS HB3 H -9.189 -9.263 -1.595 1.00 . A A . 11 HIS HB3 1 1
7 1549 1 1 11 HIS HD1 H -11.164 -10.654 -2.061 1.00 . A A . 11 HIS HD1 1 1
7 1550 1 1 11 HIS HD2 H -12.199 -6.672 -1.475 1.00 . A A . 11 HIS HD2 1 1
7 1551 1 1 11 HIS HE1 H -13.662 -10.561 -2.340 1.00 . A A . 11 HIS HE1 1 1
7 1552 1 1 11 HIS N N -9.811 -6.354 -0.019 1.00 . A A . 11 HIS N 1 1
7 1553 1 1 11 HIS ND1 N -11.684 -9.828 -1.974 1.00 . A A . 11 HIS ND1 1 1
7 1554 1 1 11 HIS NE2 N -13.351 -8.483 -1.933 1.00 . A A . 11 HIS NE2 1 1
7 1555 1 1 11 HIS O O -7.413 -8.966 0.516 1.00 . A A . 11 HIS O 1 1
7 1556 1 1 12 GLY C C -4.934 -6.728 -0.961 1.00 . A A . 12 GLY C 1 1
7 1557 1 1 12 GLY CA C -5.745 -6.790 0.317 1.00 . A A . 12 GLY CA 1 1
7 1558 1 1 12 GLY H H -7.615 -5.938 -0.193 1.00 . A A . 12 GLY H 1 1
7 1559 1 1 12 GLY HA2 H -5.488 -5.942 0.935 1.00 . A A . 12 GLY HA2 1 1
7 1560 1 1 12 GLY HA3 H -5.494 -7.697 0.846 1.00 . A A . 12 GLY HA3 1 1
7 1561 1 1 12 GLY N N -7.175 -6.774 0.069 1.00 . A A . 12 GLY N 1 1
7 1562 1 1 12 GLY O O -3.747 -6.404 -0.938 1.00 . A A . 12 GLY O 1 1
7 1563 1 1 13 GLY C C -4.682 -5.609 -3.882 1.00 . A A . 13 GLY C 1 1
7 1564 1 1 13 GLY CA C -4.890 -7.017 -3.362 1.00 . A A . 13 GLY CA 1 1
7 1565 1 1 13 GLY H H -6.521 -7.294 -2.042 1.00 . A A . 13 GLY H 1 1
7 1566 1 1 13 GLY HA2 H -3.927 -7.495 -3.251 1.00 . A A . 13 GLY HA2 1 1
7 1567 1 1 13 GLY HA3 H -5.474 -7.572 -4.082 1.00 . A A . 13 GLY HA3 1 1
7 1568 1 1 13 GLY N N -5.576 -7.043 -2.083 1.00 . A A . 13 GLY N 1 1
7 1569 1 1 13 GLY O O -4.873 -4.635 -3.151 1.00 . A A . 13 GLY O 1 1
7 1570 1 1 14 CYS C C -4.925 -4.018 -7.003 1.00 . A A . 14 CYS C 1 1
7 1571 1 1 14 CYS CA C -4.054 -4.198 -5.763 1.00 . A A . 14 CYS CA 1 1
7 1572 1 1 14 CYS CB C -2.578 -4.048 -6.137 1.00 . A A . 14 CYS CB 1 1
7 1573 1 1 14 CYS H H -4.155 -6.311 -5.678 1.00 . A A . 14 CYS H 1 1
7 1574 1 1 14 CYS HA H -4.313 -3.437 -5.043 1.00 . A A . 14 CYS HA 1 1
7 1575 1 1 14 CYS HB2 H -2.358 -4.701 -6.971 1.00 . A A . 14 CYS HB2 1 1
7 1576 1 1 14 CYS HB3 H -2.390 -3.025 -6.429 1.00 . A A . 14 CYS HB3 1 1
7 1577 1 1 14 CYS N N -4.290 -5.498 -5.146 1.00 . A A . 14 CYS N 1 1
7 1578 1 1 14 CYS O O -5.228 -4.981 -7.707 1.00 . A A . 14 CYS O 1 1
7 1579 1 1 14 CYS SG S -1.423 -4.463 -4.791 1.00 . A A . 14 CYS SG 1 1
7 1580 1 1 15 SER C C -5.350 -1.805 -9.519 1.00 . A A . 15 SER C 1 1
7 1581 1 1 15 SER CA C -6.165 -2.470 -8.415 1.00 . A A . 15 SER CA 1 1
7 1582 1 1 15 SER CB C -7.324 -1.561 -8.000 1.00 . A A . 15 SER CB 1 1
7 1583 1 1 15 SER H H -5.052 -2.051 -6.664 1.00 . A A . 15 SER H 1 1
7 1584 1 1 15 SER HA H -6.565 -3.401 -8.791 1.00 . A A . 15 SER HA 1 1
7 1585 1 1 15 SER HB2 H -7.953 -2.083 -7.296 1.00 . A A . 15 SER HB2 1 1
7 1586 1 1 15 SER HB3 H -6.928 -0.668 -7.539 1.00 . A A . 15 SER HB3 1 1
7 1587 1 1 15 SER HG H -8.733 -0.510 -8.863 1.00 . A A . 15 SER HG 1 1
7 1588 1 1 15 SER N N -5.326 -2.777 -7.262 1.00 . A A . 15 SER N 1 1
7 1589 1 1 15 SER O O -4.786 -0.727 -9.326 1.00 . A A . 15 SER O 1 1
7 1590 1 1 15 SER OG O -8.105 -1.188 -9.123 1.00 . A A . 15 SER OG 1 1
7 1591 1 1 16 CYS C C -5.430 -1.854 -13.056 1.00 . A A . 16 CYS C 1 1
7 1592 1 1 16 CYS CA C -4.547 -1.927 -11.813 1.00 . A A . 16 CYS CA 1 1
7 1593 1 1 16 CYS CB C -3.322 -2.798 -12.095 1.00 . A A . 16 CYS CB 1 1
7 1594 1 1 16 CYS H H -5.764 -3.309 -10.770 1.00 . A A . 16 CYS H 1 1
7 1595 1 1 16 CYS HA H -4.219 -0.930 -11.562 1.00 . A A . 16 CYS HA 1 1
7 1596 1 1 16 CYS HB2 H -3.648 -3.737 -12.519 1.00 . A A . 16 CYS HB2 1 1
7 1597 1 1 16 CYS HB3 H -2.684 -2.292 -12.805 1.00 . A A . 16 CYS HB3 1 1
7 1598 1 1 16 CYS N N -5.293 -2.453 -10.677 1.00 . A A . 16 CYS N 1 1
7 1599 1 1 16 CYS O O -6.345 -2.657 -13.227 1.00 . A A . 16 CYS O 1 1
7 1600 1 1 16 CYS SG S -2.323 -3.175 -10.619 1.00 . A A . 16 CYS SG 1 1
7 1601 1 1 17 NH2 HN1 H -5.671 -0.763 -14.762 1.00 . A A . 17 NH2 HN1 1 1
7 1602 1 1 17 NH2 HN2 H -4.403 -0.274 -13.729 1.00 . A A . 17 NH2 HN2 1 1
7 1603 1 1 17 NH2 N N -5.145 -0.884 -13.921 1.00 . A A . 17 NH2 N 1 1
8 1604 1 1 1 TRP C C 1.560 -0.849 -2.104 1.00 . A A . 1 TRP C 1 1
8 1605 1 1 1 TRP CA C 1.936 0.375 -1.277 1.00 . A A . 1 TRP CA 1 1
8 1606 1 1 1 TRP CB C 3.435 0.356 -0.967 1.00 . A A . 1 TRP CB 1 1
8 1607 1 1 1 TRP CD1 C 4.945 1.511 -2.684 1.00 . A A . 1 TRP CD1 1 1
8 1608 1 1 1 TRP CD2 C 4.600 -0.667 -3.078 1.00 . A A . 1 TRP CD2 1 1
8 1609 1 1 1 TRP CE2 C 5.440 -0.155 -4.087 1.00 . A A . 1 TRP CE2 1 1
8 1610 1 1 1 TRP CE3 C 4.247 -2.019 -3.118 1.00 . A A . 1 TRP CE3 1 1
8 1611 1 1 1 TRP CG C 4.296 0.415 -2.192 1.00 . A A . 1 TRP CG 1 1
8 1612 1 1 1 TRP CH2 C 5.567 -2.268 -5.135 1.00 . A A . 1 TRP CH2 1 1
8 1613 1 1 1 TRP CZ2 C 5.929 -0.948 -5.121 1.00 . A A . 1 TRP CZ2 1 1
8 1614 1 1 1 TRP CZ3 C 4.732 -2.804 -4.146 1.00 . A A . 1 TRP CZ3 1 1
8 1615 1 1 1 TRP H1 H 1.600 0.194 0.805 1.00 . A A . 1 TRP H1 1 1
8 1616 1 1 1 TRP HA H 1.709 1.264 -1.847 1.00 . A A . 1 TRP HA 1 1
8 1617 1 1 1 TRP HB2 H 3.678 1.204 -0.346 1.00 . A A . 1 TRP HB2 1 1
8 1618 1 1 1 TRP HB3 H 3.672 -0.555 -0.435 1.00 . A A . 1 TRP HB3 1 1
8 1619 1 1 1 TRP HD1 H 4.912 2.491 -2.234 1.00 . A A . 1 TRP HD1 1 1
8 1620 1 1 1 TRP HE1 H 6.179 1.789 -4.361 1.00 . A A . 1 TRP HE1 1 1
8 1621 1 1 1 TRP HE3 H 3.605 -2.450 -2.364 1.00 . A A . 1 TRP HE3 1 1
8 1622 1 1 1 TRP HH2 H 5.923 -2.919 -5.920 1.00 . A A . 1 TRP HH2 1 1
8 1623 1 1 1 TRP HZ2 H 6.574 -0.550 -5.891 1.00 . A A . 1 TRP HZ2 1 1
8 1624 1 1 1 TRP HZ3 H 4.470 -3.850 -4.193 1.00 . A A . 1 TRP HZ3 1 1
8 1625 1 1 1 TRP N N 1.164 0.428 -0.042 1.00 . A A . 1 TRP N 1 1
8 1626 1 1 1 TRP NE1 N 5.635 1.174 -3.824 1.00 . A A . 1 TRP NE1 1 1
8 1627 1 1 1 TRP O O 1.402 -1.947 -1.569 1.00 . A A . 1 TRP O 1 1
8 1628 1 1 2 CYS C C 1.960 -1.751 -5.542 1.00 . A A . 2 CYS C 1 1
8 1629 1 1 2 CYS CA C 1.058 -1.742 -4.311 1.00 . A A . 2 CYS CA 1 1
8 1630 1 1 2 CYS CB C -0.405 -1.617 -4.740 1.00 . A A . 2 CYS CB 1 1
8 1631 1 1 2 CYS H H 1.555 0.245 -3.779 1.00 . A A . 2 CYS H 1 1
8 1632 1 1 2 CYS HA H 1.189 -2.672 -3.779 1.00 . A A . 2 CYS HA 1 1
8 1633 1 1 2 CYS HB2 H -0.688 -0.575 -4.725 1.00 . A A . 2 CYS HB2 1 1
8 1634 1 1 2 CYS HB3 H -0.513 -1.999 -5.745 1.00 . A A . 2 CYS HB3 1 1
8 1635 1 1 2 CYS N N 1.417 -0.654 -3.411 1.00 . A A . 2 CYS N 1 1
8 1636 1 1 2 CYS O O 2.694 -0.794 -5.793 1.00 . A A . 2 CYS O 1 1
8 1637 1 1 2 CYS SG S -1.572 -2.523 -3.674 1.00 . A A . 2 CYS SG 1 1
8 1638 1 1 3 ALA C C 2.376 -1.873 -8.519 1.00 . A A . 3 ALA C 1 1
8 1639 1 1 3 ALA CA C 2.710 -2.967 -7.511 1.00 . A A . 3 ALA CA 1 1
8 1640 1 1 3 ALA CB C 2.510 -4.341 -8.134 1.00 . A A . 3 ALA CB 1 1
8 1641 1 1 3 ALA H H 1.297 -3.566 -6.054 1.00 . A A . 3 ALA H 1 1
8 1642 1 1 3 ALA HA H 3.750 -2.876 -7.227 1.00 . A A . 3 ALA HA 1 1
8 1643 1 1 3 ALA HB1 H 1.594 -4.346 -8.707 1.00 . A A . 3 ALA HB1 1 1
8 1644 1 1 3 ALA HB2 H 3.343 -4.566 -8.784 1.00 . A A . 3 ALA HB2 1 1
8 1645 1 1 3 ALA HB3 H 2.451 -5.085 -7.353 1.00 . A A . 3 ALA HB3 1 1
8 1646 1 1 3 ALA N N 1.901 -2.836 -6.306 1.00 . A A . 3 ALA N 1 1
8 1647 1 1 3 ALA O O 1.215 -1.496 -8.677 1.00 . A A . 3 ALA O 1 1
8 1648 1 1 4 SER C C 2.455 0.866 -9.592 1.00 . A A . 4 SER C 1 1
8 1649 1 1 4 SER CA C 3.214 -0.314 -10.189 1.00 . A A . 4 SER CA 1 1
8 1650 1 1 4 SER CB C 2.463 -0.855 -11.407 1.00 . A A . 4 SER CB 1 1
8 1651 1 1 4 SER H H 4.302 -1.711 -9.029 1.00 . A A . 4 SER H 1 1
8 1652 1 1 4 SER HA H 4.191 0.023 -10.502 1.00 . A A . 4 SER HA 1 1
8 1653 1 1 4 SER HB2 H 2.704 -1.898 -11.542 1.00 . A A . 4 SER HB2 1 1
8 1654 1 1 4 SER HB3 H 1.400 -0.749 -11.246 1.00 . A A . 4 SER HB3 1 1
8 1655 1 1 4 SER HG H 2.766 0.796 -12.417 1.00 . A A . 4 SER HG 1 1
8 1656 1 1 4 SER N N 3.400 -1.368 -9.200 1.00 . A A . 4 SER N 1 1
8 1657 1 1 4 SER O O 1.691 1.540 -10.280 1.00 . A A . 4 SER O 1 1
8 1658 1 1 4 SER OG O 2.819 -0.148 -12.582 1.00 . A A . 4 SER OG 1 1
8 1659 1 1 5 GLY C C 0.491 2.073 -7.666 1.00 . A A . 5 GLY C 1 1
8 1660 1 1 5 GLY CA C 2.001 2.207 -7.631 1.00 . A A . 5 GLY CA 1 1
8 1661 1 1 5 GLY H H 3.293 0.538 -7.803 1.00 . A A . 5 GLY H 1 1
8 1662 1 1 5 GLY HA2 H 2.326 2.238 -6.602 1.00 . A A . 5 GLY HA2 1 1
8 1663 1 1 5 GLY HA3 H 2.279 3.132 -8.114 1.00 . A A . 5 GLY HA3 1 1
8 1664 1 1 5 GLY N N 2.672 1.109 -8.302 1.00 . A A . 5 GLY N 1 1
8 1665 1 1 5 GLY O O -0.231 3.051 -7.477 1.00 . A A . 5 GLY O 1 1
8 1666 1 1 6 CYS C C -2.103 1.001 -6.668 1.00 . A A . 6 CYS C 1 1
8 1667 1 1 6 CYS CA C -1.420 0.597 -7.971 1.00 . A A . 6 CYS CA 1 1
8 1668 1 1 6 CYS CB C -1.679 -0.883 -8.257 1.00 . A A . 6 CYS CB 1 1
8 1669 1 1 6 CYS H H 0.640 0.116 -8.052 1.00 . A A . 6 CYS H 1 1
8 1670 1 1 6 CYS HA H -1.830 1.187 -8.777 1.00 . A A . 6 CYS HA 1 1
8 1671 1 1 6 CYS HB2 H -0.906 -1.474 -7.787 1.00 . A A . 6 CYS HB2 1 1
8 1672 1 1 6 CYS HB3 H -2.637 -1.160 -7.841 1.00 . A A . 6 CYS HB3 1 1
8 1673 1 1 6 CYS N N 0.013 0.856 -7.910 1.00 . A A . 6 CYS N 1 1
8 1674 1 1 6 CYS O O -1.446 1.427 -5.717 1.00 . A A . 6 CYS O 1 1
8 1675 1 1 6 CYS SG S -1.698 -1.307 -10.029 1.00 . A A . 6 CYS SG 1 1
8 1676 1 1 7 ARG C C -4.494 -0.019 -4.604 1.00 . A A . 7 ARG C 1 1
8 1677 1 1 7 ARG CA C -4.196 1.219 -5.447 1.00 . A A . 7 ARG CA 1 1
8 1678 1 1 7 ARG CB C -5.505 1.902 -5.848 1.00 . A A . 7 ARG CB 1 1
8 1679 1 1 7 ARG CD C -6.701 4.077 -6.240 1.00 . A A . 7 ARG CD 1 1
8 1680 1 1 7 ARG CG C -5.351 3.384 -6.149 1.00 . A A . 7 ARG CG 1 1
8 1681 1 1 7 ARG CZ C -6.490 5.310 -8.356 1.00 . A A . 7 ARG CZ 1 1
8 1682 1 1 7 ARG H H -3.892 0.522 -7.421 1.00 . A A . 7 ARG H 1 1
8 1683 1 1 7 ARG HA H -3.607 1.907 -4.859 1.00 . A A . 7 ARG HA 1 1
8 1684 1 1 7 ARG HB2 H -5.894 1.417 -6.731 1.00 . A A . 7 ARG HB2 1 1
8 1685 1 1 7 ARG HB3 H -6.215 1.792 -5.044 1.00 . A A . 7 ARG HB3 1 1
8 1686 1 1 7 ARG HD2 H -7.408 3.401 -6.695 1.00 . A A . 7 ARG HD2 1 1
8 1687 1 1 7 ARG HD3 H -7.031 4.325 -5.243 1.00 . A A . 7 ARG HD3 1 1
8 1688 1 1 7 ARG HE H -6.704 6.155 -6.562 1.00 . A A . 7 ARG HE 1 1
8 1689 1 1 7 ARG HG2 H -4.775 3.844 -5.360 1.00 . A A . 7 ARG HG2 1 1
8 1690 1 1 7 ARG HG3 H -4.832 3.499 -7.089 1.00 . A A . 7 ARG HG3 1 1
8 1691 1 1 7 ARG HH11 H -6.434 3.299 -8.536 1.00 . A A . 7 ARG HH11 1 1
8 1692 1 1 7 ARG HH12 H -6.287 4.180 -10.019 1.00 . A A . 7 ARG HH12 1 1
8 1693 1 1 7 ARG HH21 H -6.511 7.326 -8.510 1.00 . A A . 7 ARG HH21 1 1
8 1694 1 1 7 ARG HH22 H -6.330 6.470 -10.004 1.00 . A A . 7 ARG HH22 1 1
8 1695 1 1 7 ARG N N -3.425 0.867 -6.632 1.00 . A A . 7 ARG N 1 1
8 1696 1 1 7 ARG NE N -6.635 5.300 -7.036 1.00 . A A . 7 ARG NE 1 1
8 1697 1 1 7 ARG NH1 N -6.395 4.169 -9.025 1.00 . A A . 7 ARG NH1 1 1
8 1698 1 1 7 ARG NH2 N -6.440 6.464 -9.011 1.00 . A A . 7 ARG NH2 1 1
8 1699 1 1 7 ARG O O -4.516 -1.139 -5.113 1.00 . A A . 7 ARG O 1 1
8 1700 1 1 8 LYS C C -6.509 -1.232 -2.409 1.00 . A A . 8 LYS C 1 1
8 1701 1 1 8 LYS CA C -5.020 -0.903 -2.398 1.00 . A A . 8 LYS CA 1 1
8 1702 1 1 8 LYS CB C -4.578 -0.544 -0.978 1.00 . A A . 8 LYS CB 1 1
8 1703 1 1 8 LYS CD C -2.626 -0.295 0.584 1.00 . A A . 8 LYS CD 1 1
8 1704 1 1 8 LYS CE C -3.148 -0.923 1.867 1.00 . A A . 8 LYS CE 1 1
8 1705 1 1 8 LYS CG C -3.169 -1.005 -0.645 1.00 . A A . 8 LYS CG 1 1
8 1706 1 1 8 LYS H H -4.692 1.110 -2.965 1.00 . A A . 8 LYS H 1 1
8 1707 1 1 8 LYS HA H -4.470 -1.770 -2.729 1.00 . A A . 8 LYS HA 1 1
8 1708 1 1 8 LYS HB2 H -4.619 0.529 -0.861 1.00 . A A . 8 LYS HB2 1 1
8 1709 1 1 8 LYS HB3 H -5.259 -1.001 -0.275 1.00 . A A . 8 LYS HB3 1 1
8 1710 1 1 8 LYS HD2 H -1.547 -0.359 0.578 1.00 . A A . 8 LYS HD2 1 1
8 1711 1 1 8 LYS HD3 H -2.927 0.742 0.552 1.00 . A A . 8 LYS HD3 1 1
8 1712 1 1 8 LYS HE2 H -3.179 -1.994 1.742 1.00 . A A . 8 LYS HE2 1 1
8 1713 1 1 8 LYS HE3 H -2.475 -0.674 2.674 1.00 . A A . 8 LYS HE3 1 1
8 1714 1 1 8 LYS HG2 H -3.183 -2.068 -0.457 1.00 . A A . 8 LYS HG2 1 1
8 1715 1 1 8 LYS HG3 H -2.524 -0.795 -1.486 1.00 . A A . 8 LYS HG3 1 1
8 1716 1 1 8 LYS HZ1 H -5.229 -1.003 1.708 1.00 . A A . 8 LYS HZ1 1 1
8 1717 1 1 8 LYS HZ2 H -4.620 0.559 1.923 1.00 . A A . 8 LYS HZ2 1 1
8 1718 1 1 8 LYS HZ3 H -4.677 -0.513 3.230 1.00 . A A . 8 LYS HZ3 1 1
8 1719 1 1 8 LYS N N -4.723 0.194 -3.313 1.00 . A A . 8 LYS N 1 1
8 1720 1 1 8 LYS NZ N -4.515 -0.436 2.206 1.00 . A A . 8 LYS NZ 1 1
8 1721 1 1 8 LYS O O -7.335 -0.411 -2.811 1.00 . A A . 8 LYS O 1 1
8 1722 1 1 9 LYS C C -8.547 -3.575 -0.602 1.00 . A A . 9 LYS C 1 1
8 1723 1 1 9 LYS CA C -8.238 -2.876 -1.921 1.00 . A A . 9 LYS CA 1 1
8 1724 1 1 9 LYS CB C -8.535 -3.816 -3.091 1.00 . A A . 9 LYS CB 1 1
8 1725 1 1 9 LYS CD C -8.365 -4.259 -5.558 1.00 . A A . 9 LYS CD 1 1
8 1726 1 1 9 LYS CE C -7.805 -5.658 -5.344 1.00 . A A . 9 LYS CE 1 1
8 1727 1 1 9 LYS CG C -7.985 -3.327 -4.420 1.00 . A A . 9 LYS CG 1 1
8 1728 1 1 9 LYS H H -6.144 -3.049 -1.659 1.00 . A A . 9 LYS H 1 1
8 1729 1 1 9 LYS HA H -8.864 -2.001 -2.007 1.00 . A A . 9 LYS HA 1 1
8 1730 1 1 9 LYS HB2 H -8.101 -4.783 -2.880 1.00 . A A . 9 LYS HB2 1 1
8 1731 1 1 9 LYS HB3 H -9.606 -3.925 -3.187 1.00 . A A . 9 LYS HB3 1 1
8 1732 1 1 9 LYS HD2 H -9.441 -4.320 -5.618 1.00 . A A . 9 LYS HD2 1 1
8 1733 1 1 9 LYS HD3 H -7.973 -3.862 -6.484 1.00 . A A . 9 LYS HD3 1 1
8 1734 1 1 9 LYS HE2 H -6.731 -5.594 -5.275 1.00 . A A . 9 LYS HE2 1 1
8 1735 1 1 9 LYS HE3 H -8.203 -6.053 -4.421 1.00 . A A . 9 LYS HE3 1 1
8 1736 1 1 9 LYS HG2 H -8.384 -2.346 -4.626 1.00 . A A . 9 LYS HG2 1 1
8 1737 1 1 9 LYS HG3 H -6.907 -3.274 -4.355 1.00 . A A . 9 LYS HG3 1 1
8 1738 1 1 9 LYS HZ1 H -8.754 -6.077 -7.157 1.00 . A A . 9 LYS HZ1 1 1
8 1739 1 1 9 LYS HZ2 H -8.699 -7.390 -6.094 1.00 . A A . 9 LYS HZ2 1 1
8 1740 1 1 9 LYS HZ3 H -7.305 -6.921 -6.930 1.00 . A A . 9 LYS HZ3 1 1
8 1741 1 1 9 LYS N N -6.848 -2.438 -1.965 1.00 . A A . 9 LYS N 1 1
8 1742 1 1 9 LYS NZ N -8.165 -6.576 -6.460 1.00 . A A . 9 LYS NZ 1 1
8 1743 1 1 9 LYS O O -7.645 -4.072 0.074 1.00 . A A . 9 LYS O 1 1
8 1744 1 1 10 ARG C C -9.787 -5.704 1.048 1.00 . A A . 10 ARG C 1 1
8 1745 1 1 10 ARG CA C -10.252 -4.252 0.997 1.00 . A A . 10 ARG CA 1 1
8 1746 1 1 10 ARG CB C -11.775 -4.188 1.130 1.00 . A A . 10 ARG CB 1 1
8 1747 1 1 10 ARG CD C -11.694 -4.384 3.634 1.00 . A A . 10 ARG CD 1 1
8 1748 1 1 10 ARG CG C -12.310 -4.918 2.351 1.00 . A A . 10 ARG CG 1 1
8 1749 1 1 10 ARG CZ C -12.148 -4.451 6.049 1.00 . A A . 10 ARG CZ 1 1
8 1750 1 1 10 ARG H H -10.498 -3.199 -0.822 1.00 . A A . 10 ARG H 1 1
8 1751 1 1 10 ARG HA H -9.805 -3.714 1.820 1.00 . A A . 10 ARG HA 1 1
8 1752 1 1 10 ARG HB2 H -12.076 -3.153 1.197 1.00 . A A . 10 ARG HB2 1 1
8 1753 1 1 10 ARG HB3 H -12.220 -4.629 0.251 1.00 . A A . 10 ARG HB3 1 1
8 1754 1 1 10 ARG HD2 H -10.741 -4.868 3.790 1.00 . A A . 10 ARG HD2 1 1
8 1755 1 1 10 ARG HD3 H -11.543 -3.319 3.530 1.00 . A A . 10 ARG HD3 1 1
8 1756 1 1 10 ARG HE H -13.459 -4.945 4.629 1.00 . A A . 10 ARG HE 1 1
8 1757 1 1 10 ARG HG2 H -13.381 -4.786 2.398 1.00 . A A . 10 ARG HG2 1 1
8 1758 1 1 10 ARG HG3 H -12.078 -5.969 2.261 1.00 . A A . 10 ARG HG3 1 1
8 1759 1 1 10 ARG HH11 H -10.288 -3.839 5.551 1.00 . A A . 10 ARG HH11 1 1
8 1760 1 1 10 ARG HH12 H -10.623 -3.891 7.251 1.00 . A A . 10 ARG HH12 1 1
8 1761 1 1 10 ARG HH21 H -13.910 -5.017 6.864 1.00 . A A . 10 ARG HH21 1 1
8 1762 1 1 10 ARG HH22 H -12.682 -4.562 7.997 1.00 . A A . 10 ARG HH22 1 1
8 1763 1 1 10 ARG N N -9.826 -3.613 -0.241 1.00 . A A . 10 ARG N 1 1
8 1764 1 1 10 ARG NE N -12.545 -4.630 4.795 1.00 . A A . 10 ARG NE 1 1
8 1765 1 1 10 ARG NH1 N -10.919 -4.026 6.305 1.00 . A A . 10 ARG NH1 1 1
8 1766 1 1 10 ARG NH2 N -12.982 -4.697 7.053 1.00 . A A . 10 ARG NH2 1 1
8 1767 1 1 10 ARG O O -9.356 -6.192 2.093 1.00 . A A . 10 ARG O 1 1
8 1768 1 1 11 HIS C C -7.976 -7.932 0.132 1.00 . A A . 11 HIS C 1 1
8 1769 1 1 11 HIS CA C -9.464 -7.785 -0.173 1.00 . A A . 11 HIS CA 1 1
8 1770 1 1 11 HIS CB C -9.769 -8.345 -1.562 1.00 . A A . 11 HIS CB 1 1
8 1771 1 1 11 HIS CD2 C -12.294 -7.862 -1.220 1.00 . A A . 11 HIS CD2 1 1
8 1772 1 1 11 HIS CE1 C -13.008 -8.472 -3.201 1.00 . A A . 11 HIS CE1 1 1
8 1773 1 1 11 HIS CG C -11.218 -8.271 -1.932 1.00 . A A . 11 HIS CG 1 1
8 1774 1 1 11 HIS H H -10.227 -5.944 -0.887 1.00 . A A . 11 HIS H 1 1
8 1775 1 1 11 HIS HA H -10.025 -8.342 0.562 1.00 . A A . 11 HIS HA 1 1
8 1776 1 1 11 HIS HB2 H -9.210 -7.788 -2.299 1.00 . A A . 11 HIS HB2 1 1
8 1777 1 1 11 HIS HB3 H -9.469 -9.382 -1.599 1.00 . A A . 11 HIS HB3 1 1
8 1778 1 1 11 HIS HD1 H -11.161 -8.991 -3.912 1.00 . A A . 11 HIS HD1 1 1
8 1779 1 1 11 HIS HD2 H -12.289 -7.498 -0.202 1.00 . A A . 11 HIS HD2 1 1
8 1780 1 1 11 HIS HE1 H -13.653 -8.681 -4.041 1.00 . A A . 11 HIS HE1 1 1
8 1781 1 1 11 HIS N N -9.876 -6.388 -0.088 1.00 . A A . 11 HIS N 1 1
8 1782 1 1 11 HIS ND1 N -11.699 -8.647 -3.169 1.00 . A A . 11 HIS ND1 1 1
8 1783 1 1 11 HIS NE2 N -13.394 -7.996 -2.031 1.00 . A A . 11 HIS NE2 1 1
8 1784 1 1 11 HIS O O -7.501 -9.023 0.445 1.00 . A A . 11 HIS O 1 1
8 1785 1 1 12 GLY C C -4.990 -6.775 -0.962 1.00 . A A . 12 GLY C 1 1
8 1786 1 1 12 GLY CA C -5.819 -6.853 0.305 1.00 . A A . 12 GLY CA 1 1
8 1787 1 1 12 GLY H H -7.678 -5.983 -0.217 1.00 . A A . 12 GLY H 1 1
8 1788 1 1 12 GLY HA2 H -5.567 -6.016 0.939 1.00 . A A . 12 GLY HA2 1 1
8 1789 1 1 12 GLY HA3 H -5.579 -7.770 0.822 1.00 . A A . 12 GLY HA3 1 1
8 1790 1 1 12 GLY N N -7.244 -6.825 0.038 1.00 . A A . 12 GLY N 1 1
8 1791 1 1 12 GLY O O -3.802 -6.458 -0.916 1.00 . A A . 12 GLY O 1 1
8 1792 1 1 13 GLY C C -4.676 -5.611 -3.851 1.00 . A A . 13 GLY C 1 1
8 1793 1 1 13 GLY CA C -4.913 -7.027 -3.365 1.00 . A A . 13 GLY CA 1 1
8 1794 1 1 13 GLY H H -6.565 -7.316 -2.072 1.00 . A A . 13 GLY H 1 1
8 1795 1 1 13 GLY HA2 H -3.960 -7.523 -3.252 1.00 . A A . 13 GLY HA2 1 1
8 1796 1 1 13 GLY HA3 H -5.496 -7.556 -4.106 1.00 . A A . 13 GLY HA3 1 1
8 1797 1 1 13 GLY N N -5.617 -7.069 -2.097 1.00 . A A . 13 GLY N 1 1
8 1798 1 1 13 GLY O O -4.859 -4.651 -3.101 1.00 . A A . 13 GLY O 1 1
8 1799 1 1 14 CYS C C -4.831 -3.958 -6.952 1.00 . A A . 14 CYS C 1 1
8 1800 1 1 14 CYS CA C -3.998 -4.170 -5.691 1.00 . A A . 14 CYS CA 1 1
8 1801 1 1 14 CYS CB C -2.511 -4.027 -6.020 1.00 . A A . 14 CYS CB 1 1
8 1802 1 1 14 CYS H H -4.135 -6.282 -5.656 1.00 . A A . 14 CYS H 1 1
8 1803 1 1 14 CYS HA H -4.270 -3.420 -4.964 1.00 . A A . 14 CYS HA 1 1
8 1804 1 1 14 CYS HB2 H -2.263 -4.699 -6.829 1.00 . A A . 14 CYS HB2 1 1
8 1805 1 1 14 CYS HB3 H -2.314 -3.012 -6.330 1.00 . A A . 14 CYS HB3 1 1
8 1806 1 1 14 CYS N N -4.264 -5.479 -5.107 1.00 . A A . 14 CYS N 1 1
8 1807 1 1 14 CYS O O -4.807 -4.778 -7.870 1.00 . A A . 14 CYS O 1 1
8 1808 1 1 14 CYS SG S -1.401 -4.409 -4.626 1.00 . A A . 14 CYS SG 1 1
8 1809 1 1 15 SER C C -5.596 -1.875 -9.243 1.00 . A A . 15 SER C 1 1
8 1810 1 1 15 SER CA C -6.411 -2.532 -8.135 1.00 . A A . 15 SER CA 1 1
8 1811 1 1 15 SER CB C -7.554 -1.609 -7.711 1.00 . A A . 15 SER CB 1 1
8 1812 1 1 15 SER H H -5.544 -2.237 -6.225 1.00 . A A . 15 SER H 1 1
8 1813 1 1 15 SER HA H -6.826 -3.457 -8.508 1.00 . A A . 15 SER HA 1 1
8 1814 1 1 15 SER HB2 H -7.883 -1.878 -6.719 1.00 . A A . 15 SER HB2 1 1
8 1815 1 1 15 SER HB3 H -7.206 -0.586 -7.709 1.00 . A A . 15 SER HB3 1 1
8 1816 1 1 15 SER HG H -8.432 -1.292 -9.434 1.00 . A A . 15 SER HG 1 1
8 1817 1 1 15 SER N N -5.568 -2.851 -6.988 1.00 . A A . 15 SER N 1 1
8 1818 1 1 15 SER O O -4.997 -0.817 -9.046 1.00 . A A . 15 SER O 1 1
8 1819 1 1 15 SER OG O -8.653 -1.716 -8.600 1.00 . A A . 15 SER OG 1 1
8 1820 1 1 16 CYS C C -5.736 -1.868 -12.777 1.00 . A A . 16 CYS C 1 1
8 1821 1 1 16 CYS CA C -4.834 -1.990 -11.552 1.00 . A A . 16 CYS CA 1 1
8 1822 1 1 16 CYS CB C -3.644 -2.897 -11.871 1.00 . A A . 16 CYS CB 1 1
8 1823 1 1 16 CYS H H -6.072 -3.351 -10.506 1.00 . A A . 16 CYS H 1 1
8 1824 1 1 16 CYS HA H -4.468 -1.008 -11.292 1.00 . A A . 16 CYS HA 1 1
8 1825 1 1 16 CYS HB2 H -4.011 -3.854 -12.212 1.00 . A A . 16 CYS HB2 1 1
8 1826 1 1 16 CYS HB3 H -3.054 -2.444 -12.653 1.00 . A A . 16 CYS HB3 1 1
8 1827 1 1 16 CYS N N -5.576 -2.510 -10.410 1.00 . A A . 16 CYS N 1 1
8 1828 1 1 16 CYS O O -6.934 -2.142 -12.708 1.00 . A A . 16 CYS O 1 1
8 1829 1 1 16 CYS SG S -2.542 -3.203 -10.452 1.00 . A A . 16 CYS SG 1 1
8 1830 1 1 17 NH2 HN1 H -5.666 -1.347 -14.747 1.00 . A A . 17 NH2 HN1 1 1
8 1831 1 1 17 NH2 HN2 H -4.192 -1.252 -13.889 1.00 . A A . 17 NH2 HN2 1 1
8 1832 1 1 17 NH2 N N -5.151 -1.456 -13.897 1.00 . A A . 17 NH2 N 1 1
9 1833 1 1 1 TRP C C 1.230 -0.631 -2.197 1.00 . A A . 1 TRP C 1 1
9 1834 1 1 1 TRP CA C 1.474 0.662 -1.428 1.00 . A A . 1 TRP CA 1 1
9 1835 1 1 1 TRP CB C 2.966 0.820 -1.130 1.00 . A A . 1 TRP CB 1 1
9 1836 1 1 1 TRP CD1 C 4.301 2.075 -2.922 1.00 . A A . 1 TRP CD1 1 1
9 1837 1 1 1 TRP CD2 C 4.260 -0.149 -3.192 1.00 . A A . 1 TRP CD2 1 1
9 1838 1 1 1 TRP CE2 C 5.020 0.417 -4.235 1.00 . A A . 1 TRP CE2 1 1
9 1839 1 1 1 TRP CE3 C 4.097 -1.536 -3.153 1.00 . A A . 1 TRP CE3 1 1
9 1840 1 1 1 TRP CG C 3.810 0.929 -2.364 1.00 . A A . 1 TRP CG 1 1
9 1841 1 1 1 TRP CH2 C 5.436 -1.714 -5.166 1.00 . A A . 1 TRP CH2 1 1
9 1842 1 1 1 TRP CZ2 C 5.613 -0.358 -5.228 1.00 . A A . 1 TRP CZ2 1 1
9 1843 1 1 1 TRP CZ3 C 4.685 -2.303 -4.140 1.00 . A A . 1 TRP CZ3 1 1
9 1844 1 1 1 TRP H1 H 0.979 0.105 0.554 1.00 . A A . 1 TRP H1 1 1
9 1845 1 1 1 TRP HA H 1.147 1.495 -2.034 1.00 . A A . 1 TRP HA 1 1
9 1846 1 1 1 TRP HB2 H 3.117 1.714 -0.542 1.00 . A A . 1 TRP HB2 1 1
9 1847 1 1 1 TRP HB3 H 3.305 -0.038 -0.568 1.00 . A A . 1 TRP HB3 1 1
9 1848 1 1 1 TRP HD1 H 4.133 3.065 -2.527 1.00 . A A . 1 TRP HD1 1 1
9 1849 1 1 1 TRP HE1 H 5.484 2.426 -4.622 1.00 . A A . 1 TRP HE1 1 1
9 1850 1 1 1 TRP HE3 H 3.522 -2.009 -2.371 1.00 . A A . 1 TRP HE3 1 1
9 1851 1 1 1 TRP HH2 H 5.878 -2.351 -5.916 1.00 . A A . 1 TRP HH2 1 1
9 1852 1 1 1 TRP HZ2 H 6.195 0.082 -6.025 1.00 . A A . 1 TRP HZ2 1 1
9 1853 1 1 1 TRP HZ3 H 4.569 -3.377 -4.127 1.00 . A A . 1 TRP HZ3 1 1
9 1854 1 1 1 TRP N N 0.705 0.684 -0.188 1.00 . A A . 1 TRP N 1 1
9 1855 1 1 1 TRP NE1 N 5.030 1.774 -4.048 1.00 . A A . 1 TRP NE1 1 1
9 1856 1 1 1 TRP O O 1.078 -1.699 -1.603 1.00 . A A . 1 TRP O 1 1
9 1857 1 1 2 CYS C C 1.899 -1.669 -5.582 1.00 . A A . 2 CYS C 1 1
9 1858 1 1 2 CYS CA C 0.970 -1.691 -4.373 1.00 . A A . 2 CYS CA 1 1
9 1859 1 1 2 CYS CB C -0.488 -1.734 -4.837 1.00 . A A . 2 CYS CB 1 1
9 1860 1 1 2 CYS H H 1.322 0.350 -3.938 1.00 . A A . 2 CYS H 1 1
9 1861 1 1 2 CYS HA H 1.178 -2.575 -3.790 1.00 . A A . 2 CYS HA 1 1
9 1862 1 1 2 CYS HB2 H -0.874 -0.726 -4.879 1.00 . A A . 2 CYS HB2 1 1
9 1863 1 1 2 CYS HB3 H -0.531 -2.173 -5.823 1.00 . A A . 2 CYS HB3 1 1
9 1864 1 1 2 CYS N N 1.195 -0.529 -3.522 1.00 . A A . 2 CYS N 1 1
9 1865 1 1 2 CYS O O 2.514 -0.646 -5.886 1.00 . A A . 2 CYS O 1 1
9 1866 1 1 2 CYS SG S -1.585 -2.702 -3.751 1.00 . A A . 2 CYS SG 1 1
9 1867 1 1 3 ALA C C 2.505 -1.842 -8.474 1.00 . A A . 3 ALA C 1 1
9 1868 1 1 3 ALA CA C 2.851 -2.913 -7.445 1.00 . A A . 3 ALA CA 1 1
9 1869 1 1 3 ALA CB C 2.726 -4.299 -8.059 1.00 . A A . 3 ALA CB 1 1
9 1870 1 1 3 ALA H H 1.483 -3.583 -5.975 1.00 . A A . 3 ALA H 1 1
9 1871 1 1 3 ALA HA H 3.874 -2.776 -7.128 1.00 . A A . 3 ALA HA 1 1
9 1872 1 1 3 ALA HB1 H 3.316 -4.345 -8.963 1.00 . A A . 3 ALA HB1 1 1
9 1873 1 1 3 ALA HB2 H 3.084 -5.037 -7.357 1.00 . A A . 3 ALA HB2 1 1
9 1874 1 1 3 ALA HB3 H 1.691 -4.496 -8.294 1.00 . A A . 3 ALA HB3 1 1
9 1875 1 1 3 ALA N N 1.997 -2.802 -6.268 1.00 . A A . 3 ALA N 1 1
9 1876 1 1 3 ALA O O 1.333 -1.544 -8.706 1.00 . A A . 3 ALA O 1 1
9 1877 1 1 4 SER C C 2.528 0.935 -9.521 1.00 . A A . 4 SER C 1 1
9 1878 1 1 4 SER CA C 3.338 -0.226 -10.093 1.00 . A A . 4 SER CA 1 1
9 1879 1 1 4 SER CB C 2.629 -0.799 -11.323 1.00 . A A . 4 SER CB 1 1
9 1880 1 1 4 SER H H 4.444 -1.548 -8.864 1.00 . A A . 4 SER H 1 1
9 1881 1 1 4 SER HA H 4.310 0.138 -10.387 1.00 . A A . 4 SER HA 1 1
9 1882 1 1 4 SER HB2 H 3.123 -1.709 -11.628 1.00 . A A . 4 SER HB2 1 1
9 1883 1 1 4 SER HB3 H 1.600 -1.013 -11.074 1.00 . A A . 4 SER HB3 1 1
9 1884 1 1 4 SER HG H 3.335 -0.145 -13.030 1.00 . A A . 4 SER HG 1 1
9 1885 1 1 4 SER N N 3.532 -1.267 -9.091 1.00 . A A . 4 SER N 1 1
9 1886 1 1 4 SER O O 1.764 1.583 -10.234 1.00 . A A . 4 SER O 1 1
9 1887 1 1 4 SER OG O 2.657 0.119 -12.401 1.00 . A A . 4 SER OG 1 1
9 1888 1 1 5 GLY C C 0.482 2.075 -7.624 1.00 . A A . 5 GLY C 1 1
9 1889 1 1 5 GLY CA C 1.985 2.271 -7.581 1.00 . A A . 5 GLY CA 1 1
9 1890 1 1 5 GLY H H 3.326 0.638 -7.710 1.00 . A A . 5 GLY H 1 1
9 1891 1 1 5 GLY HA2 H 2.299 2.332 -6.551 1.00 . A A . 5 GLY HA2 1 1
9 1892 1 1 5 GLY HA3 H 2.229 3.198 -8.078 1.00 . A A . 5 GLY HA3 1 1
9 1893 1 1 5 GLY N N 2.704 1.189 -8.229 1.00 . A A . 5 GLY N 1 1
9 1894 1 1 5 GLY O O -0.280 3.029 -7.468 1.00 . A A . 5 GLY O 1 1
9 1895 1 1 6 CYS C C -2.077 0.930 -6.618 1.00 . A A . 6 CYS C 1 1
9 1896 1 1 6 CYS CA C -1.367 0.516 -7.905 1.00 . A A . 6 CYS CA 1 1
9 1897 1 1 6 CYS CB C -1.565 -0.980 -8.151 1.00 . A A . 6 CYS CB 1 1
9 1898 1 1 6 CYS H H 0.711 0.116 -7.955 1.00 . A A . 6 CYS H 1 1
9 1899 1 1 6 CYS HA H -1.792 1.068 -8.729 1.00 . A A . 6 CYS HA 1 1
9 1900 1 1 6 CYS HB2 H -0.743 -1.522 -7.705 1.00 . A A . 6 CYS HB2 1 1
9 1901 1 1 6 CYS HB3 H -2.489 -1.294 -7.690 1.00 . A A . 6 CYS HB3 1 1
9 1902 1 1 6 CYS N N 0.055 0.835 -7.838 1.00 . A A . 6 CYS N 1 1
9 1903 1 1 6 CYS O O -1.447 1.406 -5.674 1.00 . A A . 6 CYS O 1 1
9 1904 1 1 6 CYS SG S -1.638 -1.440 -9.913 1.00 . A A . 6 CYS SG 1 1
9 1905 1 1 7 ARG C C -4.529 -0.144 -4.599 1.00 . A A . 7 ARG C 1 1
9 1906 1 1 7 ARG CA C -4.189 1.097 -5.420 1.00 . A A . 7 ARG CA 1 1
9 1907 1 1 7 ARG CB C -5.475 1.806 -5.848 1.00 . A A . 7 ARG CB 1 1
9 1908 1 1 7 ARG CD C -6.424 4.086 -6.313 1.00 . A A . 7 ARG CD 1 1
9 1909 1 1 7 ARG CG C -5.235 3.157 -6.503 1.00 . A A . 7 ARG CG 1 1
9 1910 1 1 7 ARG CZ C -5.606 5.823 -4.777 1.00 . A A . 7 ARG CZ 1 1
9 1911 1 1 7 ARG H H -3.839 0.360 -7.373 1.00 . A A . 7 ARG H 1 1
9 1912 1 1 7 ARG HA H -3.603 1.768 -4.811 1.00 . A A . 7 ARG HA 1 1
9 1913 1 1 7 ARG HB2 H -6.002 1.178 -6.552 1.00 . A A . 7 ARG HB2 1 1
9 1914 1 1 7 ARG HB3 H -6.094 1.958 -4.977 1.00 . A A . 7 ARG HB3 1 1
9 1915 1 1 7 ARG HD2 H -6.419 4.823 -7.102 1.00 . A A . 7 ARG HD2 1 1
9 1916 1 1 7 ARG HD3 H -7.332 3.504 -6.371 1.00 . A A . 7 ARG HD3 1 1
9 1917 1 1 7 ARG HE H -6.960 4.434 -4.310 1.00 . A A . 7 ARG HE 1 1
9 1918 1 1 7 ARG HG2 H -4.363 3.613 -6.059 1.00 . A A . 7 ARG HG2 1 1
9 1919 1 1 7 ARG HG3 H -5.069 3.010 -7.559 1.00 . A A . 7 ARG HG3 1 1
9 1920 1 1 7 ARG HH11 H -4.799 5.877 -6.628 1.00 . A A . 7 ARG HH11 1 1
9 1921 1 1 7 ARG HH12 H -4.232 7.096 -5.535 1.00 . A A . 7 ARG HH12 1 1
9 1922 1 1 7 ARG HH21 H -6.221 6.034 -2.862 1.00 . A A . 7 ARG HH21 1 1
9 1923 1 1 7 ARG HH22 H -5.040 7.184 -3.393 1.00 . A A . 7 ARG HH22 1 1
9 1924 1 1 7 ARG N N -3.392 0.743 -6.589 1.00 . A A . 7 ARG N 1 1
9 1925 1 1 7 ARG NE N -6.382 4.774 -5.025 1.00 . A A . 7 ARG NE 1 1
9 1926 1 1 7 ARG NH1 N -4.814 6.305 -5.724 1.00 . A A . 7 ARG NH1 1 1
9 1927 1 1 7 ARG NH2 N -5.624 6.394 -3.579 1.00 . A A . 7 ARG NH2 1 1
9 1928 1 1 7 ARG O O -4.714 -1.232 -5.145 1.00 . A A . 7 ARG O 1 1
9 1929 1 1 8 LYS C C -6.437 -1.295 -2.307 1.00 . A A . 8 LYS C 1 1
9 1930 1 1 8 LYS CA C -4.929 -1.076 -2.386 1.00 . A A . 8 LYS CA 1 1
9 1931 1 1 8 LYS CB C -4.369 -0.801 -0.989 1.00 . A A . 8 LYS CB 1 1
9 1932 1 1 8 LYS CD C -2.378 -0.886 0.540 1.00 . A A . 8 LYS CD 1 1
9 1933 1 1 8 LYS CE C -1.365 -1.878 1.092 1.00 . A A . 8 LYS CE 1 1
9 1934 1 1 8 LYS CG C -2.981 -1.376 -0.766 1.00 . A A . 8 LYS CG 1 1
9 1935 1 1 8 LYS H H -4.453 0.920 -2.907 1.00 . A A . 8 LYS H 1 1
9 1936 1 1 8 LYS HA H -4.468 -1.968 -2.780 1.00 . A A . 8 LYS HA 1 1
9 1937 1 1 8 LYS HB2 H -4.323 0.267 -0.836 1.00 . A A . 8 LYS HB2 1 1
9 1938 1 1 8 LYS HB3 H -5.036 -1.234 -0.256 1.00 . A A . 8 LYS HB3 1 1
9 1939 1 1 8 LYS HD2 H -1.883 0.057 0.367 1.00 . A A . 8 LYS HD2 1 1
9 1940 1 1 8 LYS HD3 H -3.169 -0.753 1.264 1.00 . A A . 8 LYS HD3 1 1
9 1941 1 1 8 LYS HE2 H -1.888 -2.762 1.422 1.00 . A A . 8 LYS HE2 1 1
9 1942 1 1 8 LYS HE3 H -0.673 -2.143 0.305 1.00 . A A . 8 LYS HE3 1 1
9 1943 1 1 8 LYS HG2 H -3.046 -2.453 -0.739 1.00 . A A . 8 LYS HG2 1 1
9 1944 1 1 8 LYS HG3 H -2.341 -1.073 -1.583 1.00 . A A . 8 LYS HG3 1 1
9 1945 1 1 8 LYS HZ1 H 0.259 -1.872 2.405 1.00 . A A . 8 LYS HZ1 1 1
9 1946 1 1 8 LYS HZ2 H -1.183 -1.325 3.098 1.00 . A A . 8 LYS HZ2 1 1
9 1947 1 1 8 LYS HZ3 H -0.327 -0.328 2.032 1.00 . A A . 8 LYS HZ3 1 1
9 1948 1 1 8 LYS N N -4.611 0.028 -3.284 1.00 . A A . 8 LYS N 1 1
9 1949 1 1 8 LYS NZ N -0.601 -1.310 2.237 1.00 . A A . 8 LYS NZ 1 1
9 1950 1 1 8 LYS O O -7.222 -0.378 -2.549 1.00 . A A . 8 LYS O 1 1
9 1951 1 1 9 LYS C C -8.540 -3.526 -0.513 1.00 . A A . 9 LYS C 1 1
9 1952 1 1 9 LYS CA C -8.249 -2.856 -1.852 1.00 . A A . 9 LYS CA 1 1
9 1953 1 1 9 LYS CB C -8.666 -3.778 -2.998 1.00 . A A . 9 LYS CB 1 1
9 1954 1 1 9 LYS CD C -8.641 -4.248 -5.466 1.00 . A A . 9 LYS CD 1 1
9 1955 1 1 9 LYS CE C -8.045 -5.642 -5.345 1.00 . A A . 9 LYS CE 1 1
9 1956 1 1 9 LYS CG C -8.151 -3.334 -4.355 1.00 . A A . 9 LYS CG 1 1
9 1957 1 1 9 LYS H H -6.161 -3.205 -1.784 1.00 . A A . 9 LYS H 1 1
9 1958 1 1 9 LYS HA H -8.816 -1.940 -1.913 1.00 . A A . 9 LYS HA 1 1
9 1959 1 1 9 LYS HB2 H -8.290 -4.772 -2.801 1.00 . A A . 9 LYS HB2 1 1
9 1960 1 1 9 LYS HB3 H -9.746 -3.814 -3.041 1.00 . A A . 9 LYS HB3 1 1
9 1961 1 1 9 LYS HD2 H -9.717 -4.323 -5.409 1.00 . A A . 9 LYS HD2 1 1
9 1962 1 1 9 LYS HD3 H -8.358 -3.826 -6.419 1.00 . A A . 9 LYS HD3 1 1
9 1963 1 1 9 LYS HE2 H -7.928 -6.057 -6.334 1.00 . A A . 9 LYS HE2 1 1
9 1964 1 1 9 LYS HE3 H -7.077 -5.565 -4.870 1.00 . A A . 9 LYS HE3 1 1
9 1965 1 1 9 LYS HG2 H -8.497 -2.330 -4.551 1.00 . A A . 9 LYS HG2 1 1
9 1966 1 1 9 LYS HG3 H -7.069 -3.348 -4.342 1.00 . A A . 9 LYS HG3 1 1
9 1967 1 1 9 LYS HZ1 H -8.852 -7.518 -4.908 1.00 . A A . 9 LYS HZ1 1 1
9 1968 1 1 9 LYS HZ2 H -9.899 -6.229 -4.584 1.00 . A A . 9 LYS HZ2 1 1
9 1969 1 1 9 LYS HZ3 H -8.601 -6.547 -3.546 1.00 . A A . 9 LYS HZ3 1 1
9 1970 1 1 9 LYS N N -6.835 -2.516 -1.965 1.00 . A A . 9 LYS N 1 1
9 1971 1 1 9 LYS NZ N -8.910 -6.547 -4.539 1.00 . A A . 9 LYS NZ 1 1
9 1972 1 1 9 LYS O O -7.633 -4.027 0.153 1.00 . A A . 9 LYS O 1 1
9 1973 1 1 10 ARG C C -9.799 -5.609 1.192 1.00 . A A . 10 ARG C 1 1
9 1974 1 1 10 ARG CA C -10.222 -4.144 1.135 1.00 . A A . 10 ARG CA 1 1
9 1975 1 1 10 ARG CB C -11.738 -4.032 1.310 1.00 . A A . 10 ARG CB 1 1
9 1976 1 1 10 ARG CD C -13.521 -3.587 -0.405 1.00 . A A . 10 ARG CD 1 1
9 1977 1 1 10 ARG CG C -12.529 -4.601 0.143 1.00 . A A . 10 ARG CG 1 1
9 1978 1 1 10 ARG CZ C -14.711 -3.116 -2.504 1.00 . A A . 10 ARG CZ 1 1
9 1979 1 1 10 ARG H H -10.489 -3.120 -0.698 1.00 . A A . 10 ARG H 1 1
9 1980 1 1 10 ARG HA H -9.736 -3.610 1.936 1.00 . A A . 10 ARG HA 1 1
9 1981 1 1 10 ARG HB2 H -12.026 -4.564 2.204 1.00 . A A . 10 ARG HB2 1 1
9 1982 1 1 10 ARG HB3 H -11.999 -2.991 1.419 1.00 . A A . 10 ARG HB3 1 1
9 1983 1 1 10 ARG HD2 H -14.436 -3.656 0.163 1.00 . A A . 10 ARG HD2 1 1
9 1984 1 1 10 ARG HD3 H -13.102 -2.598 -0.294 1.00 . A A . 10 ARG HD3 1 1
9 1985 1 1 10 ARG HE H -13.332 -4.538 -2.270 1.00 . A A . 10 ARG HE 1 1
9 1986 1 1 10 ARG HG2 H -11.843 -4.879 -0.644 1.00 . A A . 10 ARG HG2 1 1
9 1987 1 1 10 ARG HG3 H -13.069 -5.475 0.478 1.00 . A A . 10 ARG HG3 1 1
9 1988 1 1 10 ARG HH11 H -15.224 -1.930 -0.951 1.00 . A A . 10 ARG HH11 1 1
9 1989 1 1 10 ARG HH12 H -16.056 -1.609 -2.437 1.00 . A A . 10 ARG HH12 1 1
9 1990 1 1 10 ARG HH21 H -14.420 -4.125 -4.232 1.00 . A A . 10 ARG HH21 1 1
9 1991 1 1 10 ARG HH22 H -15.598 -2.859 -4.301 1.00 . A A . 10 ARG HH22 1 1
9 1992 1 1 10 ARG N N -9.812 -3.535 -0.125 1.00 . A A . 10 ARG N 1 1
9 1993 1 1 10 ARG NE N -13.819 -3.821 -1.815 1.00 . A A . 10 ARG NE 1 1
9 1994 1 1 10 ARG NH1 N -15.386 -2.139 -1.916 1.00 . A A . 10 ARG NH1 1 1
9 1995 1 1 10 ARG NH2 N -14.927 -3.389 -3.784 1.00 . A A . 10 ARG NH2 1 1
9 1996 1 1 10 ARG O O -9.444 -6.122 2.254 1.00 . A A . 10 ARG O 1 1
9 1997 1 1 11 HIS C C -7.961 -7.856 0.185 1.00 . A A . 11 HIS C 1 1
9 1998 1 1 11 HIS CA C -9.461 -7.684 -0.037 1.00 . A A . 11 HIS CA 1 1
9 1999 1 1 11 HIS CB C -9.858 -8.264 -1.394 1.00 . A A . 11 HIS CB 1 1
9 2000 1 1 11 HIS CD2 C -12.275 -7.444 -1.849 1.00 . A A . 11 HIS CD2 1 1
9 2001 1 1 11 HIS CE1 C -13.300 -9.377 -1.719 1.00 . A A . 11 HIS CE1 1 1
9 2002 1 1 11 HIS CG C -11.338 -8.383 -1.585 1.00 . A A . 11 HIS CG 1 1
9 2003 1 1 11 HIS H H -10.131 -5.814 -0.769 1.00 . A A . 11 HIS H 1 1
9 2004 1 1 11 HIS HA H -9.989 -8.215 0.740 1.00 . A A . 11 HIS HA 1 1
9 2005 1 1 11 HIS HB2 H -9.473 -7.626 -2.177 1.00 . A A . 11 HIS HB2 1 1
9 2006 1 1 11 HIS HB3 H -9.428 -9.250 -1.497 1.00 . A A . 11 HIS HB3 1 1
9 2007 1 1 11 HIS HD1 H -11.607 -10.457 -1.328 1.00 . A A . 11 HIS HD1 1 1
9 2008 1 1 11 HIS HD2 H -12.104 -6.383 -1.976 1.00 . A A . 11 HIS HD2 1 1
9 2009 1 1 11 HIS HE1 H -14.070 -10.134 -1.719 1.00 . A A . 11 HIS HE1 1 1
9 2010 1 1 11 HIS N N -9.839 -6.278 0.043 1.00 . A A . 11 HIS N 1 1
9 2011 1 1 11 HIS ND1 N -12.013 -9.584 -1.508 1.00 . A A . 11 HIS ND1 1 1
9 2012 1 1 11 HIS NE2 N -13.487 -8.087 -1.928 1.00 . A A . 11 HIS NE2 1 1
9 2013 1 1 11 HIS O O -7.491 -8.951 0.491 1.00 . A A . 11 HIS O 1 1
9 2014 1 1 12 GLY C C -5.021 -6.780 -1.099 1.00 . A A . 12 GLY C 1 1
9 2015 1 1 12 GLY CA C -5.777 -6.818 0.213 1.00 . A A . 12 GLY CA 1 1
9 2016 1 1 12 GLY H H -7.646 -5.920 -0.217 1.00 . A A . 12 GLY H 1 1
9 2017 1 1 12 GLY HA2 H -5.473 -5.977 0.817 1.00 . A A . 12 GLY HA2 1 1
9 2018 1 1 12 GLY HA3 H -5.526 -7.731 0.734 1.00 . A A . 12 GLY HA3 1 1
9 2019 1 1 12 GLY N N -7.215 -6.766 0.027 1.00 . A A . 12 GLY N 1 1
9 2020 1 1 12 GLY O O -3.826 -6.491 -1.128 1.00 . A A . 12 GLY O 1 1
9 2021 1 1 13 GLY C C -4.747 -5.670 -3.971 1.00 . A A . 13 GLY C 1 1
9 2022 1 1 13 GLY CA C -5.090 -7.069 -3.499 1.00 . A A . 13 GLY CA 1 1
9 2023 1 1 13 GLY H H -6.670 -7.298 -2.109 1.00 . A A . 13 GLY H 1 1
9 2024 1 1 13 GLY HA2 H -4.184 -7.655 -3.453 1.00 . A A . 13 GLY HA2 1 1
9 2025 1 1 13 GLY HA3 H -5.763 -7.522 -4.213 1.00 . A A . 13 GLY HA3 1 1
9 2026 1 1 13 GLY N N -5.720 -7.075 -2.192 1.00 . A A . 13 GLY N 1 1
9 2027 1 1 13 GLY O O -4.794 -4.716 -3.195 1.00 . A A . 13 GLY O 1 1
9 2028 1 1 14 CYS C C -4.833 -3.994 -7.103 1.00 . A A . 14 CYS C 1 1
9 2029 1 1 14 CYS CA C -4.043 -4.256 -5.823 1.00 . A A . 14 CYS CA 1 1
9 2030 1 1 14 CYS CB C -2.543 -4.200 -6.116 1.00 . A A . 14 CYS CB 1 1
9 2031 1 1 14 CYS H H -4.378 -6.346 -5.817 1.00 . A A . 14 CYS H 1 1
9 2032 1 1 14 CYS HA H -4.289 -3.492 -5.101 1.00 . A A . 14 CYS HA 1 1
9 2033 1 1 14 CYS HB2 H -2.311 -4.904 -6.902 1.00 . A A . 14 CYS HB2 1 1
9 2034 1 1 14 CYS HB3 H -2.285 -3.204 -6.445 1.00 . A A . 14 CYS HB3 1 1
9 2035 1 1 14 CYS N N -4.399 -5.548 -5.248 1.00 . A A . 14 CYS N 1 1
9 2036 1 1 14 CYS O O -4.709 -4.729 -8.082 1.00 . A A . 14 CYS O 1 1
9 2037 1 1 14 CYS SG S -1.490 -4.602 -4.685 1.00 . A A . 14 CYS SG 1 1
9 2038 1 1 15 SER C C -5.587 -2.033 -9.368 1.00 . A A . 15 SER C 1 1
9 2039 1 1 15 SER CA C -6.457 -2.585 -8.243 1.00 . A A . 15 SER CA 1 1
9 2040 1 1 15 SER CB C -7.517 -1.554 -7.850 1.00 . A A . 15 SER CB 1 1
9 2041 1 1 15 SER H H -5.700 -2.394 -6.275 1.00 . A A . 15 SER H 1 1
9 2042 1 1 15 SER HA H -6.950 -3.481 -8.590 1.00 . A A . 15 SER HA 1 1
9 2043 1 1 15 SER HB2 H -8.102 -1.939 -7.028 1.00 . A A . 15 SER HB2 1 1
9 2044 1 1 15 SER HB3 H -7.030 -0.638 -7.549 1.00 . A A . 15 SER HB3 1 1
9 2045 1 1 15 SER HG H -8.683 -2.099 -9.326 1.00 . A A . 15 SER HG 1 1
9 2046 1 1 15 SER N N -5.645 -2.941 -7.086 1.00 . A A . 15 SER N 1 1
9 2047 1 1 15 SER O O -5.168 -0.875 -9.333 1.00 . A A . 15 SER O 1 1
9 2048 1 1 15 SER OG O -8.384 -1.275 -8.935 1.00 . A A . 15 SER OG 1 1
9 2049 1 1 16 CYS C C -5.280 -2.595 -12.807 1.00 . A A . 16 CYS C 1 1
9 2050 1 1 16 CYS CA C -4.500 -2.468 -11.502 1.00 . A A . 16 CYS CA 1 1
9 2051 1 1 16 CYS CB C -3.229 -3.318 -11.568 1.00 . A A . 16 CYS CB 1 1
9 2052 1 1 16 CYS H H -5.682 -3.780 -10.337 1.00 . A A . 16 CYS H 1 1
9 2053 1 1 16 CYS HA H -4.222 -1.433 -11.363 1.00 . A A . 16 CYS HA 1 1
9 2054 1 1 16 CYS HB2 H -3.493 -4.322 -11.870 1.00 . A A . 16 CYS HB2 1 1
9 2055 1 1 16 CYS HB3 H -2.558 -2.893 -12.298 1.00 . A A . 16 CYS HB3 1 1
9 2056 1 1 16 CYS N N -5.320 -2.869 -10.366 1.00 . A A . 16 CYS N 1 1
9 2057 1 1 16 CYS O O -6.247 -3.350 -12.892 1.00 . A A . 16 CYS O 1 1
9 2058 1 1 16 CYS SG S -2.330 -3.436 -9.988 1.00 . A A . 16 CYS SG 1 1
9 2059 1 1 17 NH2 HN1 H -5.300 -1.874 -14.715 1.00 . A A . 17 NH2 HN1 1 1
9 2060 1 1 17 NH2 HN2 H -4.073 -1.270 -13.693 1.00 . A A . 17 NH2 HN2 1 1
9 2061 1 1 17 NH2 N N -4.850 -1.852 -13.822 1.00 . A A . 17 NH2 N 1 1
10 2062 1 1 1 TRP C C 1.745 -0.849 -2.167 1.00 . A A . 1 TRP C 1 1
10 2063 1 1 1 TRP CA C 2.097 0.368 -1.319 1.00 . A A . 1 TRP CA 1 1
10 2064 1 1 1 TRP CB C 3.611 0.444 -1.115 1.00 . A A . 1 TRP CB 1 1
10 2065 1 1 1 TRP CD1 C 4.898 1.715 -2.932 1.00 . A A . 1 TRP CD1 1 1
10 2066 1 1 1 TRP CD2 C 4.706 -0.485 -3.307 1.00 . A A . 1 TRP CD2 1 1
10 2067 1 1 1 TRP CE2 C 5.428 0.091 -4.370 1.00 . A A . 1 TRP CE2 1 1
10 2068 1 1 1 TRP CE3 C 4.464 -1.861 -3.326 1.00 . A A . 1 TRP CE3 1 1
10 2069 1 1 1 TRP CG C 4.377 0.571 -2.397 1.00 . A A . 1 TRP CG 1 1
10 2070 1 1 1 TRP CH2 C 5.654 -2.006 -5.431 1.00 . A A . 1 TRP CH2 1 1
10 2071 1 1 1 TRP CZ2 C 5.907 -0.662 -5.439 1.00 . A A . 1 TRP CZ2 1 1
10 2072 1 1 1 TRP CZ3 C 4.939 -2.607 -4.387 1.00 . A A . 1 TRP CZ3 1 1
10 2073 1 1 1 TRP H1 H 1.941 0.415 0.792 1.00 . A A . 1 TRP H1 1 1
10 2074 1 1 1 TRP HA H 1.767 1.259 -1.834 1.00 . A A . 1 TRP HA 1 1
10 2075 1 1 1 TRP HB2 H 3.843 1.302 -0.503 1.00 . A A . 1 TRP HB2 1 1
10 2076 1 1 1 TRP HB3 H 3.945 -0.453 -0.614 1.00 . A A . 1 TRP HB3 1 1
10 2077 1 1 1 TRP HD1 H 4.815 2.691 -2.477 1.00 . A A . 1 TRP HD1 1 1
10 2078 1 1 1 TRP HE1 H 5.983 2.089 -4.690 1.00 . A A . 1 TRP HE1 1 1
10 2079 1 1 1 TRP HE3 H 3.914 -2.342 -2.530 1.00 . A A . 1 TRP HE3 1 1
10 2080 1 1 1 TRP HH2 H 6.007 -2.628 -6.240 1.00 . A A . 1 TRP HH2 1 1
10 2081 1 1 1 TRP HZ2 H 6.460 -0.214 -6.251 1.00 . A A . 1 TRP HZ2 1 1
10 2082 1 1 1 TRP HZ3 H 4.760 -3.672 -4.419 1.00 . A A . 1 TRP HZ3 1 1
10 2083 1 1 1 TRP N N 1.415 0.320 -0.030 1.00 . A A . 1 TRP N 1 1
10 2084 1 1 1 TRP NE1 N 5.530 1.434 -4.118 1.00 . A A . 1 TRP NE1 1 1
10 2085 1 1 1 TRP O O 1.800 -1.984 -1.694 1.00 . A A . 1 TRP O 1 1
10 2086 1 1 2 CYS C C 1.937 -1.686 -5.560 1.00 . A A . 2 CYS C 1 1
10 2087 1 1 2 CYS CA C 1.024 -1.682 -4.337 1.00 . A A . 2 CYS CA 1 1
10 2088 1 1 2 CYS CB C -0.434 -1.539 -4.776 1.00 . A A . 2 CYS CB 1 1
10 2089 1 1 2 CYS H H 1.360 0.321 -3.742 1.00 . A A . 2 CYS H 1 1
10 2090 1 1 2 CYS HA H 1.143 -2.618 -3.812 1.00 . A A . 2 CYS HA 1 1
10 2091 1 1 2 CYS HB2 H -0.703 -0.493 -4.770 1.00 . A A . 2 CYS HB2 1 1
10 2092 1 1 2 CYS HB3 H -0.541 -1.927 -5.779 1.00 . A A . 2 CYS HB3 1 1
10 2093 1 1 2 CYS N N 1.385 -0.606 -3.422 1.00 . A A . 2 CYS N 1 1
10 2094 1 1 2 CYS O O 2.630 -0.705 -5.833 1.00 . A A . 2 CYS O 1 1
10 2095 1 1 2 CYS SG S -1.621 -2.420 -3.711 1.00 . A A . 2 CYS SG 1 1
10 2096 1 1 3 ALA C C 2.434 -1.832 -8.500 1.00 . A A . 3 ALA C 1 1
10 2097 1 1 3 ALA CA C 2.757 -2.926 -7.487 1.00 . A A . 3 ALA CA 1 1
10 2098 1 1 3 ALA CB C 2.567 -4.299 -8.112 1.00 . A A . 3 ALA CB 1 1
10 2099 1 1 3 ALA H H 1.359 -3.543 -6.023 1.00 . A A . 3 ALA H 1 1
10 2100 1 1 3 ALA HA H 3.792 -2.832 -7.189 1.00 . A A . 3 ALA HA 1 1
10 2101 1 1 3 ALA HB1 H 1.543 -4.405 -8.442 1.00 . A A . 3 ALA HB1 1 1
10 2102 1 1 3 ALA HB2 H 3.230 -4.406 -8.957 1.00 . A A . 3 ALA HB2 1 1
10 2103 1 1 3 ALA HB3 H 2.790 -5.061 -7.381 1.00 . A A . 3 ALA HB3 1 1
10 2104 1 1 3 ALA N N 1.932 -2.794 -6.292 1.00 . A A . 3 ALA N 1 1
10 2105 1 1 3 ALA O O 1.273 -1.467 -8.684 1.00 . A A . 3 ALA O 1 1
10 2106 1 1 4 SER C C 2.511 0.915 -9.558 1.00 . A A . 4 SER C 1 1
10 2107 1 1 4 SER CA C 3.295 -0.256 -10.143 1.00 . A A . 4 SER CA 1 1
10 2108 1 1 4 SER CB C 2.574 -0.801 -11.378 1.00 . A A . 4 SER CB 1 1
10 2109 1 1 4 SER H H 4.370 -1.645 -8.960 1.00 . A A . 4 SER H 1 1
10 2110 1 1 4 SER HA H 4.275 0.092 -10.433 1.00 . A A . 4 SER HA 1 1
10 2111 1 1 4 SER HB2 H 3.087 -1.683 -11.731 1.00 . A A . 4 SER HB2 1 1
10 2112 1 1 4 SER HB3 H 1.558 -1.057 -11.115 1.00 . A A . 4 SER HB3 1 1
10 2113 1 1 4 SER HG H 1.988 0.896 -12.163 1.00 . A A . 4 SER HG 1 1
10 2114 1 1 4 SER N N 3.469 -1.312 -9.152 1.00 . A A . 4 SER N 1 1
10 2115 1 1 4 SER O O 1.767 1.593 -10.265 1.00 . A A . 4 SER O 1 1
10 2116 1 1 4 SER OG O 2.550 0.161 -12.420 1.00 . A A . 4 SER OG 1 1
10 2117 1 1 5 GLY C C 0.480 2.078 -7.662 1.00 . A A . 5 GLY C 1 1
10 2118 1 1 5 GLY CA C 1.987 2.233 -7.600 1.00 . A A . 5 GLY CA 1 1
10 2119 1 1 5 GLY H H 3.290 0.570 -7.746 1.00 . A A . 5 GLY H 1 1
10 2120 1 1 5 GLY HA2 H 2.292 2.268 -6.565 1.00 . A A . 5 GLY HA2 1 1
10 2121 1 1 5 GLY HA3 H 2.261 3.163 -8.078 1.00 . A A . 5 GLY HA3 1 1
10 2122 1 1 5 GLY N N 2.684 1.145 -8.260 1.00 . A A . 5 GLY N 1 1
10 2123 1 1 5 GLY O O -0.259 3.047 -7.485 1.00 . A A . 5 GLY O 1 1
10 2124 1 1 6 CYS C C -2.121 0.994 -6.721 1.00 . A A . 6 CYS C 1 1
10 2125 1 1 6 CYS CA C -1.407 0.578 -8.004 1.00 . A A . 6 CYS CA 1 1
10 2126 1 1 6 CYS CB C -1.641 -0.909 -8.273 1.00 . A A . 6 CYS CB 1 1
10 2127 1 1 6 CYS H H 0.661 0.124 -8.048 1.00 . A A . 6 CYS H 1 1
10 2128 1 1 6 CYS HA H -1.807 1.152 -8.826 1.00 . A A . 6 CYS HA 1 1
10 2129 1 1 6 CYS HB2 H -0.880 -1.484 -7.765 1.00 . A A . 6 CYS HB2 1 1
10 2130 1 1 6 CYS HB3 H -2.611 -1.188 -7.888 1.00 . A A . 6 CYS HB3 1 1
10 2131 1 1 6 CYS N N 0.022 0.857 -7.916 1.00 . A A . 6 CYS N 1 1
10 2132 1 1 6 CYS O O -1.489 1.440 -5.762 1.00 . A A . 6 CYS O 1 1
10 2133 1 1 6 CYS SG S -1.592 -1.362 -10.036 1.00 . A A . 6 CYS SG 1 1
10 2134 1 1 7 ARG C C -4.491 -0.014 -4.660 1.00 . A A . 7 ARG C 1 1
10 2135 1 1 7 ARG CA C -4.242 1.204 -5.546 1.00 . A A . 7 ARG CA 1 1
10 2136 1 1 7 ARG CB C -5.577 1.809 -5.987 1.00 . A A . 7 ARG CB 1 1
10 2137 1 1 7 ARG CD C -6.700 3.798 -7.034 1.00 . A A . 7 ARG CD 1 1
10 2138 1 1 7 ARG CG C -5.429 2.965 -6.962 1.00 . A A . 7 ARG CG 1 1
10 2139 1 1 7 ARG CZ C -8.952 3.567 -7.992 1.00 . A A . 7 ARG CZ 1 1
10 2140 1 1 7 ARG H H -3.888 0.483 -7.505 1.00 . A A . 7 ARG H 1 1
10 2141 1 1 7 ARG HA H -3.692 1.940 -4.981 1.00 . A A . 7 ARG HA 1 1
10 2142 1 1 7 ARG HB2 H -6.169 1.040 -6.462 1.00 . A A . 7 ARG HB2 1 1
10 2143 1 1 7 ARG HB3 H -6.101 2.166 -5.113 1.00 . A A . 7 ARG HB3 1 1
10 2144 1 1 7 ARG HD2 H -6.928 4.170 -6.047 1.00 . A A . 7 ARG HD2 1 1
10 2145 1 1 7 ARG HD3 H -6.531 4.630 -7.702 1.00 . A A . 7 ARG HD3 1 1
10 2146 1 1 7 ARG HE H -7.762 2.045 -7.498 1.00 . A A . 7 ARG HE 1 1
10 2147 1 1 7 ARG HG2 H -4.616 3.598 -6.635 1.00 . A A . 7 ARG HG2 1 1
10 2148 1 1 7 ARG HG3 H -5.210 2.571 -7.942 1.00 . A A . 7 ARG HG3 1 1
10 2149 1 1 7 ARG HH11 H -8.336 5.471 -7.719 1.00 . A A . 7 ARG HH11 1 1
10 2150 1 1 7 ARG HH12 H -9.921 5.294 -8.394 1.00 . A A . 7 ARG HH12 1 1
10 2151 1 1 7 ARG HH21 H -9.848 1.798 -8.386 1.00 . A A . 7 ARG HH21 1 1
10 2152 1 1 7 ARG HH22 H -10.782 3.204 -8.772 1.00 . A A . 7 ARG HH22 1 1
10 2153 1 1 7 ARG N N -3.442 0.844 -6.710 1.00 . A A . 7 ARG N 1 1
10 2154 1 1 7 ARG NE N -7.836 3.021 -7.522 1.00 . A A . 7 ARG NE 1 1
10 2155 1 1 7 ARG NH1 N -9.081 4.885 -8.038 1.00 . A A . 7 ARG NH1 1 1
10 2156 1 1 7 ARG NH2 N -9.942 2.793 -8.419 1.00 . A A . 7 ARG NH2 1 1
10 2157 1 1 7 ARG O O -4.416 -1.154 -5.118 1.00 . A A . 7 ARG O 1 1
10 2158 1 1 8 LYS C C -6.532 -1.183 -2.402 1.00 . A A . 8 LYS C 1 1
10 2159 1 1 8 LYS CA C -5.048 -0.837 -2.438 1.00 . A A . 8 LYS CA 1 1
10 2160 1 1 8 LYS CB C -4.572 -0.434 -1.040 1.00 . A A . 8 LYS CB 1 1
10 2161 1 1 8 LYS CD C -2.741 -0.479 0.679 1.00 . A A . 8 LYS CD 1 1
10 2162 1 1 8 LYS CE C -2.542 1.024 0.799 1.00 . A A . 8 LYS CE 1 1
10 2163 1 1 8 LYS CG C -3.153 -0.876 -0.729 1.00 . A A . 8 LYS CG 1 1
10 2164 1 1 8 LYS H H -4.831 1.167 -3.084 1.00 . A A . 8 LYS H 1 1
10 2165 1 1 8 LYS HA H -4.495 -1.706 -2.760 1.00 . A A . 8 LYS HA 1 1
10 2166 1 1 8 LYS HB2 H -4.619 0.642 -0.953 1.00 . A A . 8 LYS HB2 1 1
10 2167 1 1 8 LYS HB3 H -5.233 -0.875 -0.307 1.00 . A A . 8 LYS HB3 1 1
10 2168 1 1 8 LYS HD2 H -3.513 -0.784 1.369 1.00 . A A . 8 LYS HD2 1 1
10 2169 1 1 8 LYS HD3 H -1.815 -0.978 0.927 1.00 . A A . 8 LYS HD3 1 1
10 2170 1 1 8 LYS HE2 H -3.388 1.523 0.353 1.00 . A A . 8 LYS HE2 1 1
10 2171 1 1 8 LYS HE3 H -2.482 1.283 1.846 1.00 . A A . 8 LYS HE3 1 1
10 2172 1 1 8 LYS HG2 H -3.091 -1.949 -0.822 1.00 . A A . 8 LYS HG2 1 1
10 2173 1 1 8 LYS HG3 H -2.478 -0.411 -1.435 1.00 . A A . 8 LYS HG3 1 1
10 2174 1 1 8 LYS HZ1 H -1.254 2.513 0.102 1.00 . A A . 8 LYS HZ1 1 1
10 2175 1 1 8 LYS HZ2 H -1.280 1.125 -0.863 1.00 . A A . 8 LYS HZ2 1 1
10 2176 1 1 8 LYS HZ3 H -0.463 1.111 0.618 1.00 . A A . 8 LYS HZ3 1 1
10 2177 1 1 8 LYS N N -4.787 0.237 -3.390 1.00 . A A . 8 LYS N 1 1
10 2178 1 1 8 LYS NZ N -1.297 1.475 0.117 1.00 . A A . 8 LYS NZ 1 1
10 2179 1 1 8 LYS O O -7.379 -0.375 -2.784 1.00 . A A . 8 LYS O 1 1
10 2180 1 1 9 LYS C C -8.479 -3.562 -0.528 1.00 . A A . 9 LYS C 1 1
10 2181 1 1 9 LYS CA C -8.226 -2.842 -1.849 1.00 . A A . 9 LYS CA 1 1
10 2182 1 1 9 LYS CB C -8.557 -3.770 -3.019 1.00 . A A . 9 LYS CB 1 1
10 2183 1 1 9 LYS CD C -8.499 -4.164 -5.500 1.00 . A A . 9 LYS CD 1 1
10 2184 1 1 9 LYS CE C -7.918 -5.563 -5.353 1.00 . A A . 9 LYS CE 1 1
10 2185 1 1 9 LYS CG C -8.062 -3.259 -4.361 1.00 . A A . 9 LYS CG 1 1
10 2186 1 1 9 LYS H H -6.124 -2.989 -1.649 1.00 . A A . 9 LYS H 1 1
10 2187 1 1 9 LYS HA H -8.864 -1.973 -1.900 1.00 . A A . 9 LYS HA 1 1
10 2188 1 1 9 LYS HB2 H -8.105 -4.735 -2.838 1.00 . A A . 9 LYS HB2 1 1
10 2189 1 1 9 LYS HB3 H -9.629 -3.890 -3.077 1.00 . A A . 9 LYS HB3 1 1
10 2190 1 1 9 LYS HD2 H -9.576 -4.234 -5.501 1.00 . A A . 9 LYS HD2 1 1
10 2191 1 1 9 LYS HD3 H -8.162 -3.741 -6.435 1.00 . A A . 9 LYS HD3 1 1
10 2192 1 1 9 LYS HE2 H -7.739 -5.969 -6.336 1.00 . A A . 9 LYS HE2 1 1
10 2193 1 1 9 LYS HE3 H -6.984 -5.496 -4.815 1.00 . A A . 9 LYS HE3 1 1
10 2194 1 1 9 LYS HG2 H -8.463 -2.270 -4.529 1.00 . A A . 9 LYS HG2 1 1
10 2195 1 1 9 LYS HG3 H -6.982 -3.212 -4.343 1.00 . A A . 9 LYS HG3 1 1
10 2196 1 1 9 LYS HZ1 H -9.385 -7.049 -5.286 1.00 . A A . 9 LYS HZ1 1 1
10 2197 1 1 9 LYS HZ2 H -9.500 -5.915 -4.036 1.00 . A A . 9 LYS HZ2 1 1
10 2198 1 1 9 LYS HZ3 H -8.295 -7.102 -3.992 1.00 . A A . 9 LYS HZ3 1 1
10 2199 1 1 9 LYS N N -6.843 -2.389 -1.938 1.00 . A A . 9 LYS N 1 1
10 2200 1 1 9 LYS NZ N -8.839 -6.472 -4.615 1.00 . A A . 9 LYS NZ 1 1
10 2201 1 1 9 LYS O O -7.573 -4.172 0.040 1.00 . A A . 9 LYS O 1 1
10 2202 1 1 10 ARG C C -9.790 -5.627 1.158 1.00 . A A . 10 ARG C 1 1
10 2203 1 1 10 ARG CA C -10.085 -4.131 1.208 1.00 . A A . 10 ARG CA 1 1
10 2204 1 1 10 ARG CB C -11.569 -3.902 1.505 1.00 . A A . 10 ARG CB 1 1
10 2205 1 1 10 ARG CD C -12.865 -6.045 1.289 1.00 . A A . 10 ARG CD 1 1
10 2206 1 1 10 ARG CG C -12.499 -4.725 0.628 1.00 . A A . 10 ARG CG 1 1
10 2207 1 1 10 ARG CZ C -14.586 -6.939 2.801 1.00 . A A . 10 ARG CZ 1 1
10 2208 1 1 10 ARG H H -10.393 -2.985 -0.544 1.00 . A A . 10 ARG H 1 1
10 2209 1 1 10 ARG HA H -9.497 -3.687 1.996 1.00 . A A . 10 ARG HA 1 1
10 2210 1 1 10 ARG HB2 H -11.762 -4.159 2.536 1.00 . A A . 10 ARG HB2 1 1
10 2211 1 1 10 ARG HB3 H -11.796 -2.858 1.353 1.00 . A A . 10 ARG HB3 1 1
10 2212 1 1 10 ARG HD2 H -13.005 -6.790 0.521 1.00 . A A . 10 ARG HD2 1 1
10 2213 1 1 10 ARG HD3 H -12.055 -6.344 1.937 1.00 . A A . 10 ARG HD3 1 1
10 2214 1 1 10 ARG HE H -14.567 -5.085 2.064 1.00 . A A . 10 ARG HE 1 1
10 2215 1 1 10 ARG HG2 H -13.403 -4.161 0.451 1.00 . A A . 10 ARG HG2 1 1
10 2216 1 1 10 ARG HG3 H -12.007 -4.927 -0.312 1.00 . A A . 10 ARG HG3 1 1
10 2217 1 1 10 ARG HH11 H -13.118 -8.241 2.318 1.00 . A A . 10 ARG HH11 1 1
10 2218 1 1 10 ARG HH12 H -14.338 -8.858 3.383 1.00 . A A . 10 ARG HH12 1 1
10 2219 1 1 10 ARG HH21 H -16.177 -5.886 3.467 1.00 . A A . 10 ARG HH21 1 1
10 2220 1 1 10 ARG HH22 H -16.078 -7.518 4.035 1.00 . A A . 10 ARG HH22 1 1
10 2221 1 1 10 ARG N N -9.714 -3.486 -0.046 1.00 . A A . 10 ARG N 1 1
10 2222 1 1 10 ARG NE N -14.091 -5.941 2.077 1.00 . A A . 10 ARG NE 1 1
10 2223 1 1 10 ARG NH1 N -13.963 -8.108 2.836 1.00 . A A . 10 ARG NH1 1 1
10 2224 1 1 10 ARG NH2 N -15.706 -6.767 3.491 1.00 . A A . 10 ARG NH2 1 1
10 2225 1 1 10 ARG O O -9.565 -6.261 2.190 1.00 . A A . 10 ARG O 1 1
10 2226 1 1 11 HIS C C -8.065 -7.929 0.061 1.00 . A A . 11 HIS C 1 1
10 2227 1 1 11 HIS CA C -9.527 -7.608 -0.232 1.00 . A A . 11 HIS CA 1 1
10 2228 1 1 11 HIS CB C -9.878 -8.034 -1.659 1.00 . A A . 11 HIS CB 1 1
10 2229 1 1 11 HIS CD2 C -12.053 -6.723 -2.189 1.00 . A A . 11 HIS CD2 1 1
10 2230 1 1 11 HIS CE1 C -13.396 -8.433 -2.471 1.00 . A A . 11 HIS CE1 1 1
10 2231 1 1 11 HIS CG C -11.325 -7.848 -1.999 1.00 . A A . 11 HIS CG 1 1
10 2232 1 1 11 HIS H H -9.981 -5.629 -0.832 1.00 . A A . 11 HIS H 1 1
10 2233 1 1 11 HIS HA H -10.149 -8.155 0.461 1.00 . A A . 11 HIS HA 1 1
10 2234 1 1 11 HIS HB2 H -9.297 -7.449 -2.355 1.00 . A A . 11 HIS HB2 1 1
10 2235 1 1 11 HIS HB3 H -9.638 -9.080 -1.784 1.00 . A A . 11 HIS HB3 1 1
10 2236 1 1 11 HIS HD1 H -11.968 -9.852 -2.111 1.00 . A A . 11 HIS HD1 1 1
10 2237 1 1 11 HIS HD2 H -11.691 -5.707 -2.125 1.00 . A A . 11 HIS HD2 1 1
10 2238 1 1 11 HIS HE1 H -14.277 -9.027 -2.664 1.00 . A A . 11 HIS HE1 1 1
10 2239 1 1 11 HIS N N -9.794 -6.186 -0.048 1.00 . A A . 11 HIS N 1 1
10 2240 1 1 11 HIS ND1 N -12.196 -8.902 -2.181 1.00 . A A . 11 HIS ND1 1 1
10 2241 1 1 11 HIS NE2 N -13.337 -7.114 -2.482 1.00 . A A . 11 HIS NE2 1 1
10 2242 1 1 11 HIS O O -7.706 -9.082 0.296 1.00 . A A . 11 HIS O 1 1
10 2243 1 1 12 GLY C C -4.968 -7.012 -0.948 1.00 . A A . 12 GLY C 1 1
10 2244 1 1 12 GLY CA C -5.810 -7.092 0.310 1.00 . A A . 12 GLY CA 1 1
10 2245 1 1 12 GLY H H -7.566 -6.002 -0.148 1.00 . A A . 12 GLY H 1 1
10 2246 1 1 12 GLY HA2 H -5.477 -6.334 1.003 1.00 . A A . 12 GLY HA2 1 1
10 2247 1 1 12 GLY HA3 H -5.669 -8.064 0.761 1.00 . A A . 12 GLY HA3 1 1
10 2248 1 1 12 GLY N N -7.223 -6.900 0.045 1.00 . A A . 12 GLY N 1 1
10 2249 1 1 12 GLY O O -3.752 -6.840 -0.879 1.00 . A A . 12 GLY O 1 1
10 2250 1 1 13 GLY C C -4.687 -5.655 -3.840 1.00 . A A . 13 GLY C 1 1
10 2251 1 1 13 GLY CA C -4.903 -7.078 -3.364 1.00 . A A . 13 GLY CA 1 1
10 2252 1 1 13 GLY H H -6.587 -7.273 -2.096 1.00 . A A . 13 GLY H 1 1
10 2253 1 1 13 GLY HA2 H -3.942 -7.556 -3.246 1.00 . A A . 13 GLY HA2 1 1
10 2254 1 1 13 GLY HA3 H -5.471 -7.613 -4.111 1.00 . A A . 13 GLY HA3 1 1
10 2255 1 1 13 GLY N N -5.617 -7.138 -2.102 1.00 . A A . 13 GLY N 1 1
10 2256 1 1 13 GLY O O -4.895 -4.702 -3.089 1.00 . A A . 13 GLY O 1 1
10 2257 1 1 14 CYS C C -4.865 -3.982 -6.925 1.00 . A A . 14 CYS C 1 1
10 2258 1 1 14 CYS CA C -4.023 -4.192 -5.670 1.00 . A A . 14 CYS CA 1 1
10 2259 1 1 14 CYS CB C -2.538 -4.028 -6.004 1.00 . A A . 14 CYS CB 1 1
10 2260 1 1 14 CYS H H -4.121 -6.307 -5.644 1.00 . A A . 14 CYS H 1 1
10 2261 1 1 14 CYS HA H -4.301 -3.451 -4.936 1.00 . A A . 14 CYS HA 1 1
10 2262 1 1 14 CYS HB2 H -2.275 -4.725 -6.788 1.00 . A A . 14 CYS HB2 1 1
10 2263 1 1 14 CYS HB3 H -2.365 -3.021 -6.353 1.00 . A A . 14 CYS HB3 1 1
10 2264 1 1 14 CYS N N -4.269 -5.509 -5.093 1.00 . A A . 14 CYS N 1 1
10 2265 1 1 14 CYS O O -4.919 -4.845 -7.800 1.00 . A A . 14 CYS O 1 1
10 2266 1 1 14 CYS SG S -1.421 -4.330 -4.598 1.00 . A A . 14 CYS SG 1 1
10 2267 1 1 15 SER C C -5.520 -2.010 -9.320 1.00 . A A . 15 SER C 1 1
10 2268 1 1 15 SER CA C -6.363 -2.506 -8.150 1.00 . A A . 15 SER CA 1 1
10 2269 1 1 15 SER CB C -7.397 -1.446 -7.766 1.00 . A A . 15 SER CB 1 1
10 2270 1 1 15 SER H H -5.437 -2.180 -6.273 1.00 . A A . 15 SER H 1 1
10 2271 1 1 15 SER HA H -6.877 -3.407 -8.448 1.00 . A A . 15 SER HA 1 1
10 2272 1 1 15 SER HB2 H -8.006 -1.816 -6.955 1.00 . A A . 15 SER HB2 1 1
10 2273 1 1 15 SER HB3 H -6.887 -0.546 -7.451 1.00 . A A . 15 SER HB3 1 1
10 2274 1 1 15 SER HG H -8.694 -1.926 -9.153 1.00 . A A . 15 SER HG 1 1
10 2275 1 1 15 SER N N -5.521 -2.828 -7.004 1.00 . A A . 15 SER N 1 1
10 2276 1 1 15 SER O O -5.128 -0.843 -9.369 1.00 . A A . 15 SER O 1 1
10 2277 1 1 15 SER OG O -8.239 -1.133 -8.863 1.00 . A A . 15 SER OG 1 1
10 2278 1 1 16 CYS C C -5.244 -2.786 -12.719 1.00 . A A . 16 CYS C 1 1
10 2279 1 1 16 CYS CA C -4.449 -2.561 -11.436 1.00 . A A . 16 CYS CA 1 1
10 2280 1 1 16 CYS CB C -3.164 -3.389 -11.466 1.00 . A A . 16 CYS CB 1 1
10 2281 1 1 16 CYS H H -5.587 -3.819 -10.170 1.00 . A A . 16 CYS H 1 1
10 2282 1 1 16 CYS HA H -4.191 -1.514 -11.367 1.00 . A A . 16 CYS HA 1 1
10 2283 1 1 16 CYS HB2 H -3.413 -4.417 -11.689 1.00 . A A . 16 CYS HB2 1 1
10 2284 1 1 16 CYS HB3 H -2.515 -3.005 -12.239 1.00 . A A . 16 CYS HB3 1 1
10 2285 1 1 16 CYS N N -5.246 -2.904 -10.264 1.00 . A A . 16 CYS N 1 1
10 2286 1 1 16 CYS O O -6.071 -3.694 -12.797 1.00 . A A . 16 CYS O 1 1
10 2287 1 1 16 CYS SG S -2.232 -3.374 -9.901 1.00 . A A . 16 CYS SG 1 1
10 2288 1 1 17 NH2 HN1 H -5.459 -2.029 -14.601 1.00 . A A . 17 NH2 HN1 1 1
10 2289 1 1 17 NH2 HN2 H -4.316 -1.250 -13.600 1.00 . A A . 17 NH2 HN2 1 1
10 2290 1 1 17 NH2 N N -4.987 -1.954 -13.722 1.00 . A A . 17 NH2 N 1 1
11 2291 1 1 1 TRP C C 1.649 -1.567 -2.073 1.00 . A A . 1 TRP C 1 1
11 2292 1 1 1 TRP CA C 2.151 -0.522 -1.083 1.00 . A A . 1 TRP CA 1 1
11 2293 1 1 1 TRP CB C 3.631 -0.762 -0.777 1.00 . A A . 1 TRP CB 1 1
11 2294 1 1 1 TRP CD1 C 5.293 0.506 -2.260 1.00 . A A . 1 TRP CD1 1 1
11 2295 1 1 1 TRP CD2 C 4.728 -1.519 -3.033 1.00 . A A . 1 TRP CD2 1 1
11 2296 1 1 1 TRP CE2 C 5.639 -0.932 -3.933 1.00 . A A . 1 TRP CE2 1 1
11 2297 1 1 1 TRP CE3 C 4.234 -2.796 -3.311 1.00 . A A . 1 TRP CE3 1 1
11 2298 1 1 1 TRP CG C 4.520 -0.582 -1.970 1.00 . A A . 1 TRP CG 1 1
11 2299 1 1 1 TRP CH2 C 5.564 -2.829 -5.337 1.00 . A A . 1 TRP CH2 1 1
11 2300 1 1 1 TRP CZ2 C 6.064 -1.580 -5.090 1.00 . A A . 1 TRP CZ2 1 1
11 2301 1 1 1 TRP CZ3 C 4.656 -3.437 -4.460 1.00 . A A . 1 TRP CZ3 1 1
11 2302 1 1 1 TRP H1 H 1.693 -1.079 0.908 1.00 . A A . 1 TRP H1 1 1
11 2303 1 1 1 TRP HA H 2.038 0.458 -1.523 1.00 . A A . 1 TRP HA 1 1
11 2304 1 1 1 TRP HB2 H 3.951 -0.068 -0.015 1.00 . A A . 1 TRP HB2 1 1
11 2305 1 1 1 TRP HB3 H 3.757 -1.772 -0.415 1.00 . A A . 1 TRP HB3 1 1
11 2306 1 1 1 TRP HD1 H 5.353 1.391 -1.645 1.00 . A A . 1 TRP HD1 1 1
11 2307 1 1 1 TRP HE1 H 6.586 0.938 -3.858 1.00 . A A . 1 TRP HE1 1 1
11 2308 1 1 1 TRP HE3 H 3.533 -3.281 -2.647 1.00 . A A . 1 TRP HE3 1 1
11 2309 1 1 1 TRP HH2 H 5.866 -3.368 -6.222 1.00 . A A . 1 TRP HH2 1 1
11 2310 1 1 1 TRP HZ2 H 6.763 -1.125 -5.776 1.00 . A A . 1 TRP HZ2 1 1
11 2311 1 1 1 TRP HZ3 H 4.284 -4.425 -4.692 1.00 . A A . 1 TRP HZ3 1 1
11 2312 1 1 1 TRP N N 1.369 -0.552 0.147 1.00 . A A . 1 TRP N 1 1
11 2313 1 1 1 TRP NE1 N 5.968 0.302 -3.439 1.00 . A A . 1 TRP NE1 1 1
11 2314 1 1 1 TRP O O 1.387 -2.712 -1.703 1.00 . A A . 1 TRP O 1 1
11 2315 1 1 2 CYS C C 1.940 -1.989 -5.610 1.00 . A A . 2 CYS C 1 1
11 2316 1 1 2 CYS CA C 1.043 -2.068 -4.377 1.00 . A A . 2 CYS CA 1 1
11 2317 1 1 2 CYS CB C -0.398 -1.729 -4.759 1.00 . A A . 2 CYS CB 1 1
11 2318 1 1 2 CYS H H 1.740 -0.240 -3.567 1.00 . A A . 2 CYS H 1 1
11 2319 1 1 2 CYS HA H 1.076 -3.074 -3.987 1.00 . A A . 2 CYS HA 1 1
11 2320 1 1 2 CYS HB2 H -0.562 -0.670 -4.615 1.00 . A A . 2 CYS HB2 1 1
11 2321 1 1 2 CYS HB3 H -0.553 -1.972 -5.800 1.00 . A A . 2 CYS HB3 1 1
11 2322 1 1 2 CYS N N 1.515 -1.166 -3.333 1.00 . A A . 2 CYS N 1 1
11 2323 1 1 2 CYS O O 2.687 -1.027 -5.787 1.00 . A A . 2 CYS O 1 1
11 2324 1 1 2 CYS SG S -1.655 -2.620 -3.787 1.00 . A A . 2 CYS SG 1 1
11 2325 1 1 3 ALA C C 2.346 -1.873 -8.586 1.00 . A A . 3 ALA C 1 1
11 2326 1 1 3 ALA CA C 2.662 -3.055 -7.675 1.00 . A A . 3 ALA CA 1 1
11 2327 1 1 3 ALA CB C 2.429 -4.367 -8.410 1.00 . A A . 3 ALA CB 1 1
11 2328 1 1 3 ALA H H 1.246 -3.747 -6.262 1.00 . A A . 3 ALA H 1 1
11 2329 1 1 3 ALA HA H 3.703 -3.009 -7.390 1.00 . A A . 3 ALA HA 1 1
11 2330 1 1 3 ALA HB1 H 3.124 -4.443 -9.235 1.00 . A A . 3 ALA HB1 1 1
11 2331 1 1 3 ALA HB2 H 2.584 -5.192 -7.732 1.00 . A A . 3 ALA HB2 1 1
11 2332 1 1 3 ALA HB3 H 1.418 -4.393 -8.787 1.00 . A A . 3 ALA HB3 1 1
11 2333 1 1 3 ALA N N 1.860 -3.009 -6.458 1.00 . A A . 3 ALA N 1 1
11 2334 1 1 3 ALA O O 1.191 -1.467 -8.714 1.00 . A A . 3 ALA O 1 1
11 2335 1 1 4 SER C C 2.454 0.943 -9.417 1.00 . A A . 4 SER C 1 1
11 2336 1 1 4 SER CA C 3.215 -0.184 -10.108 1.00 . A A . 4 SER CA 1 1
11 2337 1 1 4 SER CB C 2.475 -0.610 -11.377 1.00 . A A . 4 SER CB 1 1
11 2338 1 1 4 SER H H 4.278 -1.691 -9.070 1.00 . A A . 4 SER H 1 1
11 2339 1 1 4 SER HA H 4.198 0.173 -10.377 1.00 . A A . 4 SER HA 1 1
11 2340 1 1 4 SER HB2 H 2.837 -1.575 -11.696 1.00 . A A . 4 SER HB2 1 1
11 2341 1 1 4 SER HB3 H 1.416 -0.672 -11.171 1.00 . A A . 4 SER HB3 1 1
11 2342 1 1 4 SER HG H 2.065 1.054 -12.328 1.00 . A A . 4 SER HG 1 1
11 2343 1 1 4 SER N N 3.381 -1.323 -9.213 1.00 . A A . 4 SER N 1 1
11 2344 1 1 4 SER O O 1.702 1.682 -10.052 1.00 . A A . 4 SER O 1 1
11 2345 1 1 4 SER OG O 2.681 0.323 -12.425 1.00 . A A . 4 SER OG 1 1
11 2346 1 1 5 GLY C C 0.472 2.000 -7.434 1.00 . A A . 5 GLY C 1 1
11 2347 1 1 5 GLY CA C 1.982 2.108 -7.351 1.00 . A A . 5 GLY CA 1 1
11 2348 1 1 5 GLY H H 3.265 0.452 -7.654 1.00 . A A . 5 GLY H 1 1
11 2349 1 1 5 GLY HA2 H 2.282 2.036 -6.316 1.00 . A A . 5 GLY HA2 1 1
11 2350 1 1 5 GLY HA3 H 2.284 3.072 -7.736 1.00 . A A . 5 GLY HA3 1 1
11 2351 1 1 5 GLY N N 2.655 1.070 -8.109 1.00 . A A . 5 GLY N 1 1
11 2352 1 1 5 GLY O O -0.241 2.985 -7.235 1.00 . A A . 5 GLY O 1 1
11 2353 1 1 6 CYS C C -2.168 0.949 -6.546 1.00 . A A . 6 CYS C 1 1
11 2354 1 1 6 CYS CA C -1.453 0.567 -7.839 1.00 . A A . 6 CYS CA 1 1
11 2355 1 1 6 CYS CB C -1.727 -0.901 -8.172 1.00 . A A . 6 CYS CB 1 1
11 2356 1 1 6 CYS H H 0.600 0.054 -7.875 1.00 . A A . 6 CYS H 1 1
11 2357 1 1 6 CYS HA H -1.829 1.184 -8.640 1.00 . A A . 6 CYS HA 1 1
11 2358 1 1 6 CYS HB2 H -0.973 -1.516 -7.703 1.00 . A A . 6 CYS HB2 1 1
11 2359 1 1 6 CYS HB3 H -2.699 -1.174 -7.785 1.00 . A A . 6 CYS HB3 1 1
11 2360 1 1 6 CYS N N -0.018 0.801 -7.728 1.00 . A A . 6 CYS N 1 1
11 2361 1 1 6 CYS O O -1.533 1.337 -5.565 1.00 . A A . 6 CYS O 1 1
11 2362 1 1 6 CYS SG S -1.713 -1.275 -9.955 1.00 . A A . 6 CYS SG 1 1
11 2363 1 1 7 ARG C C -4.660 -0.086 -4.597 1.00 . A A . 7 ARG C 1 1
11 2364 1 1 7 ARG CA C -4.293 1.170 -5.382 1.00 . A A . 7 ARG CA 1 1
11 2365 1 1 7 ARG CB C -5.565 1.911 -5.802 1.00 . A A . 7 ARG CB 1 1
11 2366 1 1 7 ARG CD C -6.703 4.143 -5.609 1.00 . A A . 7 ARG CD 1 1
11 2367 1 1 7 ARG CG C -5.394 3.418 -5.881 1.00 . A A . 7 ARG CG 1 1
11 2368 1 1 7 ARG CZ C -7.677 6.372 -5.963 1.00 . A A . 7 ARG CZ 1 1
11 2369 1 1 7 ARG H H -3.941 0.521 -7.366 1.00 . A A . 7 ARG H 1 1
11 2370 1 1 7 ARG HA H -3.704 1.816 -4.750 1.00 . A A . 7 ARG HA 1 1
11 2371 1 1 7 ARG HB2 H -5.870 1.554 -6.776 1.00 . A A . 7 ARG HB2 1 1
11 2372 1 1 7 ARG HB3 H -6.345 1.695 -5.088 1.00 . A A . 7 ARG HB3 1 1
11 2373 1 1 7 ARG HD2 H -7.513 3.563 -6.026 1.00 . A A . 7 ARG HD2 1 1
11 2374 1 1 7 ARG HD3 H -6.835 4.229 -4.541 1.00 . A A . 7 ARG HD3 1 1
11 2375 1 1 7 ARG HE H -5.988 5.719 -6.801 1.00 . A A . 7 ARG HE 1 1
11 2376 1 1 7 ARG HG2 H -4.664 3.727 -5.146 1.00 . A A . 7 ARG HG2 1 1
11 2377 1 1 7 ARG HG3 H -5.046 3.681 -6.868 1.00 . A A . 7 ARG HG3 1 1
11 2378 1 1 7 ARG HH11 H -8.724 5.174 -4.718 1.00 . A A . 7 ARG HH11 1 1
11 2379 1 1 7 ARG HH12 H -9.400 6.749 -4.976 1.00 . A A . 7 ARG HH12 1 1
11 2380 1 1 7 ARG HH21 H -6.868 7.795 -7.149 1.00 . A A . 7 ARG HH21 1 1
11 2381 1 1 7 ARG HH22 H -8.344 8.239 -6.360 1.00 . A A . 7 ARG HH22 1 1
11 2382 1 1 7 ARG N N -3.492 0.836 -6.553 1.00 . A A . 7 ARG N 1 1
11 2383 1 1 7 ARG NE N -6.723 5.478 -6.199 1.00 . A A . 7 ARG NE 1 1
11 2384 1 1 7 ARG NH1 N -8.684 6.074 -5.153 1.00 . A A . 7 ARG NH1 1 1
11 2385 1 1 7 ARG NH2 N -7.625 7.566 -6.538 1.00 . A A . 7 ARG NH2 1 1
11 2386 1 1 7 ARG O O -4.922 -1.140 -5.177 1.00 . A A . 7 ARG O 1 1
11 2387 1 1 8 LYS C C -6.516 -1.312 -2.360 1.00 . A A . 8 LYS C 1 1
11 2388 1 1 8 LYS CA C -5.008 -1.091 -2.408 1.00 . A A . 8 LYS CA 1 1
11 2389 1 1 8 LYS CB C -4.473 -0.850 -0.995 1.00 . A A . 8 LYS CB 1 1
11 2390 1 1 8 LYS CD C -2.537 -1.022 0.597 1.00 . A A . 8 LYS CD 1 1
11 2391 1 1 8 LYS CE C -1.521 -2.035 1.103 1.00 . A A . 8 LYS CE 1 1
11 2392 1 1 8 LYS CG C -3.080 -1.414 -0.767 1.00 . A A . 8 LYS CG 1 1
11 2393 1 1 8 LYS H H -4.455 0.899 -2.870 1.00 . A A . 8 LYS H 1 1
11 2394 1 1 8 LYS HA H -4.540 -1.974 -2.815 1.00 . A A . 8 LYS HA 1 1
11 2395 1 1 8 LYS HB2 H -4.443 0.214 -0.811 1.00 . A A . 8 LYS HB2 1 1
11 2396 1 1 8 LYS HB3 H -5.145 -1.310 -0.285 1.00 . A A . 8 LYS HB3 1 1
11 2397 1 1 8 LYS HD2 H -2.059 -0.057 0.521 1.00 . A A . 8 LYS HD2 1 1
11 2398 1 1 8 LYS HD3 H -3.357 -0.967 1.299 1.00 . A A . 8 LYS HD3 1 1
11 2399 1 1 8 LYS HE2 H -1.965 -3.018 1.071 1.00 . A A . 8 LYS HE2 1 1
11 2400 1 1 8 LYS HE3 H -0.656 -2.010 0.457 1.00 . A A . 8 LYS HE3 1 1
11 2401 1 1 8 LYS HG2 H -3.123 -2.491 -0.830 1.00 . A A . 8 LYS HG2 1 1
11 2402 1 1 8 LYS HG3 H -2.419 -1.032 -1.531 1.00 . A A . 8 LYS HG3 1 1
11 2403 1 1 8 LYS HZ1 H -1.756 -2.174 3.173 1.00 . A A . 8 LYS HZ1 1 1
11 2404 1 1 8 LYS HZ2 H -1.074 -0.714 2.658 1.00 . A A . 8 LYS HZ2 1 1
11 2405 1 1 8 LYS HZ3 H -0.142 -2.126 2.669 1.00 . A A . 8 LYS HZ3 1 1
11 2406 1 1 8 LYS N N -4.674 0.033 -3.274 1.00 . A A . 8 LYS N 1 1
11 2407 1 1 8 LYS NZ N -1.093 -1.742 2.498 1.00 . A A . 8 LYS NZ 1 1
11 2408 1 1 8 LYS O O -7.297 -0.384 -2.572 1.00 . A A . 8 LYS O 1 1
11 2409 1 1 9 LYS C C -8.665 -3.538 -0.660 1.00 . A A . 9 LYS C 1 1
11 2410 1 1 9 LYS CA C -8.336 -2.890 -2.002 1.00 . A A . 9 LYS CA 1 1
11 2411 1 1 9 LYS CB C -8.717 -3.834 -3.144 1.00 . A A . 9 LYS CB 1 1
11 2412 1 1 9 LYS CD C -8.540 -4.398 -5.585 1.00 . A A . 9 LYS CD 1 1
11 2413 1 1 9 LYS CE C -7.987 -5.787 -5.303 1.00 . A A . 9 LYS CE 1 1
11 2414 1 1 9 LYS CG C -8.158 -3.415 -4.493 1.00 . A A . 9 LYS CG 1 1
11 2415 1 1 9 LYS H H -6.250 -3.244 -1.921 1.00 . A A . 9 LYS H 1 1
11 2416 1 1 9 LYS HA H -8.904 -1.977 -2.096 1.00 . A A . 9 LYS HA 1 1
11 2417 1 1 9 LYS HB2 H -8.346 -4.824 -2.916 1.00 . A A . 9 LYS HB2 1 1
11 2418 1 1 9 LYS HB3 H -9.794 -3.872 -3.220 1.00 . A A . 9 LYS HB3 1 1
11 2419 1 1 9 LYS HD2 H -9.616 -4.458 -5.645 1.00 . A A . 9 LYS HD2 1 1
11 2420 1 1 9 LYS HD3 H -8.144 -4.048 -6.528 1.00 . A A . 9 LYS HD3 1 1
11 2421 1 1 9 LYS HE2 H -6.921 -5.713 -5.157 1.00 . A A . 9 LYS HE2 1 1
11 2422 1 1 9 LYS HE3 H -8.447 -6.167 -4.402 1.00 . A A . 9 LYS HE3 1 1
11 2423 1 1 9 LYS HG2 H -8.549 -2.441 -4.747 1.00 . A A . 9 LYS HG2 1 1
11 2424 1 1 9 LYS HG3 H -7.080 -3.366 -4.425 1.00 . A A . 9 LYS HG3 1 1
11 2425 1 1 9 LYS HZ1 H -8.723 -7.590 -6.060 1.00 . A A . 9 LYS HZ1 1 1
11 2426 1 1 9 LYS HZ2 H -7.370 -7.001 -6.887 1.00 . A A . 9 LYS HZ2 1 1
11 2427 1 1 9 LYS HZ3 H -8.884 -6.283 -7.123 1.00 . A A . 9 LYS HZ3 1 1
11 2428 1 1 9 LYS N N -6.921 -2.547 -2.080 1.00 . A A . 9 LYS N 1 1
11 2429 1 1 9 LYS NZ N -8.260 -6.731 -6.422 1.00 . A A . 9 LYS NZ 1 1
11 2430 1 1 9 LYS O O -7.769 -3.875 0.113 1.00 . A A . 9 LYS O 1 1
11 2431 1 1 10 ARG C C -9.773 -5.696 1.044 1.00 . A A . 10 ARG C 1 1
11 2432 1 1 10 ARG CA C -10.402 -4.319 0.855 1.00 . A A . 10 ARG CA 1 1
11 2433 1 1 10 ARG CB C -11.928 -4.437 0.872 1.00 . A A . 10 ARG CB 1 1
11 2434 1 1 10 ARG CD C -13.874 -4.933 2.382 1.00 . A A . 10 ARG CD 1 1
11 2435 1 1 10 ARG CG C -12.540 -4.216 2.245 1.00 . A A . 10 ARG CG 1 1
11 2436 1 1 10 ARG CZ C -15.547 -3.334 1.553 1.00 . A A . 10 ARG CZ 1 1
11 2437 1 1 10 ARG H H -10.623 -3.421 -1.050 1.00 . A A . 10 ARG H 1 1
11 2438 1 1 10 ARG HA H -10.091 -3.678 1.666 1.00 . A A . 10 ARG HA 1 1
11 2439 1 1 10 ARG HB2 H -12.342 -3.703 0.195 1.00 . A A . 10 ARG HB2 1 1
11 2440 1 1 10 ARG HB3 H -12.204 -5.423 0.532 1.00 . A A . 10 ARG HB3 1 1
11 2441 1 1 10 ARG HD2 H -14.045 -5.519 1.491 1.00 . A A . 10 ARG HD2 1 1
11 2442 1 1 10 ARG HD3 H -13.829 -5.587 3.240 1.00 . A A . 10 ARG HD3 1 1
11 2443 1 1 10 ARG HE H -15.321 -3.860 3.463 1.00 . A A . 10 ARG HE 1 1
11 2444 1 1 10 ARG HG2 H -11.862 -4.593 2.996 1.00 . A A . 10 ARG HG2 1 1
11 2445 1 1 10 ARG HG3 H -12.693 -3.157 2.394 1.00 . A A . 10 ARG HG3 1 1
11 2446 1 1 10 ARG HH11 H -14.353 -4.129 0.130 1.00 . A A . 10 ARG HH11 1 1
11 2447 1 1 10 ARG HH12 H -15.538 -3.002 -0.441 1.00 . A A . 10 ARG HH12 1 1
11 2448 1 1 10 ARG HH21 H -16.885 -2.373 2.724 1.00 . A A . 10 ARG HH21 1 1
11 2449 1 1 10 ARG HH22 H -16.977 -2.002 1.036 1.00 . A A . 10 ARG HH22 1 1
11 2450 1 1 10 ARG N N -9.955 -3.711 -0.393 1.00 . A A . 10 ARG N 1 1
11 2451 1 1 10 ARG NE N -14.983 -3.998 2.555 1.00 . A A . 10 ARG NE 1 1
11 2452 1 1 10 ARG NH1 N -15.109 -3.501 0.312 1.00 . A A . 10 ARG NH1 1 1
11 2453 1 1 10 ARG NH2 N -16.552 -2.501 1.791 1.00 . A A . 10 ARG NH2 1 1
11 2454 1 1 10 ARG O O -9.293 -6.026 2.129 1.00 . A A . 10 ARG O 1 1
11 2455 1 1 11 HIS C C -7.705 -7.778 0.288 1.00 . A A . 11 HIS C 1 1
11 2456 1 1 11 HIS CA C -9.208 -7.836 0.031 1.00 . A A . 11 HIS CA 1 1
11 2457 1 1 11 HIS CB C -9.486 -8.580 -1.276 1.00 . A A . 11 HIS CB 1 1
11 2458 1 1 11 HIS CD2 C -12.049 -8.287 -1.018 1.00 . A A . 11 HIS CD2 1 1
11 2459 1 1 11 HIS CE1 C -12.691 -9.961 -2.280 1.00 . A A . 11 HIS CE1 1 1
11 2460 1 1 11 HIS CG C -10.934 -8.890 -1.492 1.00 . A A . 11 HIS CG 1 1
11 2461 1 1 11 HIS H H -10.175 -6.174 -0.855 1.00 . A A . 11 HIS H 1 1
11 2462 1 1 11 HIS HA H -9.679 -8.367 0.844 1.00 . A A . 11 HIS HA 1 1
11 2463 1 1 11 HIS HB2 H -9.149 -7.974 -2.105 1.00 . A A . 11 HIS HB2 1 1
11 2464 1 1 11 HIS HB3 H -8.941 -9.513 -1.274 1.00 . A A . 11 HIS HB3 1 1
11 2465 1 1 11 HIS HD1 H -10.797 -10.565 -2.763 1.00 . A A . 11 HIS HD1 1 1
11 2466 1 1 11 HIS HD2 H -12.085 -7.427 -0.365 1.00 . A A . 11 HIS HD2 1 1
11 2467 1 1 11 HIS HE1 H -13.309 -10.670 -2.809 1.00 . A A . 11 HIS HE1 1 1
11 2468 1 1 11 HIS N N -9.778 -6.494 -0.018 1.00 . A A . 11 HIS N 1 1
11 2469 1 1 11 HIS ND1 N -11.370 -9.936 -2.278 1.00 . A A . 11 HIS ND1 1 1
11 2470 1 1 11 HIS NE2 N -13.128 -8.972 -1.523 1.00 . A A . 11 HIS NE2 1 1
11 2471 1 1 11 HIS O O -7.096 -8.767 0.695 1.00 . A A . 11 HIS O 1 1
11 2472 1 1 12 GLY C C -4.908 -6.415 -1.043 1.00 . A A . 12 GLY C 1 1
11 2473 1 1 12 GLY CA C -5.686 -6.448 0.258 1.00 . A A . 12 GLY CA 1 1
11 2474 1 1 12 GLY H H -7.648 -5.857 -0.275 1.00 . A A . 12 GLY H 1 1
11 2475 1 1 12 GLY HA2 H -5.516 -5.524 0.790 1.00 . A A . 12 GLY HA2 1 1
11 2476 1 1 12 GLY HA3 H -5.326 -7.269 0.859 1.00 . A A . 12 GLY HA3 1 1
11 2477 1 1 12 GLY N N -7.113 -6.612 0.047 1.00 . A A . 12 GLY N 1 1
11 2478 1 1 12 GLY O O -3.765 -5.961 -1.080 1.00 . A A . 12 GLY O 1 1
11 2479 1 1 13 GLY C C -4.619 -5.521 -3.948 1.00 . A A . 13 GLY C 1 1
11 2480 1 1 13 GLY CA C -4.872 -6.916 -3.408 1.00 . A A . 13 GLY CA 1 1
11 2481 1 1 13 GLY H H -6.441 -7.247 -2.026 1.00 . A A . 13 GLY H 1 1
11 2482 1 1 13 GLY HA2 H -3.928 -7.430 -3.313 1.00 . A A . 13 GLY HA2 1 1
11 2483 1 1 13 GLY HA3 H -5.495 -7.452 -4.109 1.00 . A A . 13 GLY HA3 1 1
11 2484 1 1 13 GLY N N -5.530 -6.899 -2.115 1.00 . A A . 13 GLY N 1 1
11 2485 1 1 13 GLY O O -4.753 -4.534 -3.225 1.00 . A A . 13 GLY O 1 1
11 2486 1 1 14 CYS C C -4.808 -3.991 -7.129 1.00 . A A . 14 CYS C 1 1
11 2487 1 1 14 CYS CA C -3.977 -4.158 -5.859 1.00 . A A . 14 CYS CA 1 1
11 2488 1 1 14 CYS CB C -2.488 -4.037 -6.191 1.00 . A A . 14 CYS CB 1 1
11 2489 1 1 14 CYS H H -4.162 -6.263 -5.749 1.00 . A A . 14 CYS H 1 1
11 2490 1 1 14 CYS HA H -4.245 -3.377 -5.164 1.00 . A A . 14 CYS HA 1 1
11 2491 1 1 14 CYS HB2 H -2.255 -4.703 -7.009 1.00 . A A . 14 CYS HB2 1 1
11 2492 1 1 14 CYS HB3 H -2.274 -3.022 -6.487 1.00 . A A . 14 CYS HB3 1 1
11 2493 1 1 14 CYS N N -4.251 -5.440 -5.222 1.00 . A A . 14 CYS N 1 1
11 2494 1 1 14 CYS O O -4.783 -4.845 -8.015 1.00 . A A . 14 CYS O 1 1
11 2495 1 1 14 CYS SG S -1.382 -4.457 -4.807 1.00 . A A . 14 CYS SG 1 1
11 2496 1 1 15 SER C C -5.583 -1.917 -9.466 1.00 . A A . 15 SER C 1 1
11 2497 1 1 15 SER CA C -6.382 -2.609 -8.367 1.00 . A A . 15 SER CA 1 1
11 2498 1 1 15 SER CB C -7.574 -1.739 -7.962 1.00 . A A . 15 SER CB 1 1
11 2499 1 1 15 SER H H -5.520 -2.244 -6.468 1.00 . A A . 15 SER H 1 1
11 2500 1 1 15 SER HA H -6.748 -3.552 -8.744 1.00 . A A . 15 SER HA 1 1
11 2501 1 1 15 SER HB2 H -8.004 -2.124 -7.050 1.00 . A A . 15 SER HB2 1 1
11 2502 1 1 15 SER HB3 H -7.237 -0.725 -7.802 1.00 . A A . 15 SER HB3 1 1
11 2503 1 1 15 SER HG H -9.221 -1.057 -8.777 1.00 . A A . 15 SER HG 1 1
11 2504 1 1 15 SER N N -5.541 -2.886 -7.208 1.00 . A A . 15 SER N 1 1
11 2505 1 1 15 SER O O -5.214 -0.749 -9.339 1.00 . A A . 15 SER O 1 1
11 2506 1 1 15 SER OG O -8.570 -1.736 -8.971 1.00 . A A . 15 SER OG 1 1
11 2507 1 1 16 CYS C C -5.411 -2.075 -12.932 1.00 . A A . 16 CYS C 1 1
11 2508 1 1 16 CYS CA C -4.560 -2.105 -11.666 1.00 . A A . 16 CYS CA 1 1
11 2509 1 1 16 CYS CB C -3.298 -2.936 -11.906 1.00 . A A . 16 CYS CB 1 1
11 2510 1 1 16 CYS H H -5.637 -3.573 -10.586 1.00 . A A . 16 CYS H 1 1
11 2511 1 1 16 CYS HA H -4.272 -1.095 -11.417 1.00 . A A . 16 CYS HA 1 1
11 2512 1 1 16 CYS HB2 H -3.583 -3.903 -12.297 1.00 . A A . 16 CYS HB2 1 1
11 2513 1 1 16 CYS HB3 H -2.675 -2.432 -12.630 1.00 . A A . 16 CYS HB3 1 1
11 2514 1 1 16 CYS N N -5.316 -2.646 -10.544 1.00 . A A . 16 CYS N 1 1
11 2515 1 1 16 CYS O O -6.548 -2.545 -12.939 1.00 . A A . 16 CYS O 1 1
11 2516 1 1 16 CYS SG S -2.297 -3.217 -10.410 1.00 . A A . 16 CYS SG 1 1
11 2517 1 1 17 NH2 HN1 H -5.336 -1.458 -14.874 1.00 . A A . 17 NH2 HN1 1 1
11 2518 1 1 17 NH2 HN2 H -3.941 -1.163 -13.936 1.00 . A A . 17 NH2 HN2 1 1
11 2519 1 1 17 NH2 N N -4.851 -1.520 -14.002 1.00 . A A . 17 NH2 N 1 1
12 2520 1 1 1 TRP C C 2.288 -1.046 -2.303 1.00 . A A . 1 TRP C 1 1
12 2521 1 1 1 TRP CA C 2.829 0.132 -1.500 1.00 . A A . 1 TRP CA 1 1
12 2522 1 1 1 TRP CB C 4.356 0.155 -1.571 1.00 . A A . 1 TRP CB 1 1
12 2523 1 1 1 TRP CD1 C 5.348 1.429 -3.561 1.00 . A A . 1 TRP CD1 1 1
12 2524 1 1 1 TRP CD2 C 5.003 -0.751 -3.942 1.00 . A A . 1 TRP CD2 1 1
12 2525 1 1 1 TRP CE2 C 5.546 -0.171 -5.106 1.00 . A A . 1 TRP CE2 1 1
12 2526 1 1 1 TRP CE3 C 4.705 -2.116 -3.947 1.00 . A A . 1 TRP CE3 1 1
12 2527 1 1 1 TRP CG C 4.884 0.290 -2.966 1.00 . A A . 1 TRP CG 1 1
12 2528 1 1 1 TRP CH2 C 5.493 -2.246 -6.235 1.00 . A A . 1 TRP CH2 1 1
12 2529 1 1 1 TRP CZ2 C 5.795 -0.911 -6.259 1.00 . A A . 1 TRP CZ2 1 1
12 2530 1 1 1 TRP CZ3 C 4.952 -2.848 -5.092 1.00 . A A . 1 TRP CZ3 1 1
12 2531 1 1 1 TRP H1 H 2.072 -0.792 0.248 1.00 . A A . 1 TRP H1 1 1
12 2532 1 1 1 TRP HA H 2.444 1.049 -1.925 1.00 . A A . 1 TRP HA 1 1
12 2533 1 1 1 TRP HB2 H 4.725 0.989 -0.992 1.00 . A A . 1 TRP HB2 1 1
12 2534 1 1 1 TRP HB3 H 4.742 -0.765 -1.155 1.00 . A A . 1 TRP HB3 1 1
12 2535 1 1 1 TRP HD1 H 5.386 2.394 -3.079 1.00 . A A . 1 TRP HD1 1 1
12 2536 1 1 1 TRP HE1 H 6.115 1.813 -5.478 1.00 . A A . 1 TRP HE1 1 1
12 2537 1 1 1 TRP HE3 H 4.288 -2.599 -3.075 1.00 . A A . 1 TRP HE3 1 1
12 2538 1 1 1 TRP HH2 H 5.669 -2.856 -7.107 1.00 . A A . 1 TRP HH2 1 1
12 2539 1 1 1 TRP HZ2 H 6.212 -0.461 -7.149 1.00 . A A . 1 TRP HZ2 1 1
12 2540 1 1 1 TRP HZ3 H 4.728 -3.904 -5.114 1.00 . A A . 1 TRP HZ3 1 1
12 2541 1 1 1 TRP N N 2.386 0.065 -0.112 1.00 . A A . 1 TRP N 1 1
12 2542 1 1 1 TRP NE1 N 5.746 1.159 -4.848 1.00 . A A . 1 TRP NE1 1 1
12 2543 1 1 1 TRP O O 2.362 -2.194 -1.864 1.00 . A A . 1 TRP O 1 1
12 2544 1 1 2 CYS C C 1.983 -1.898 -5.642 1.00 . A A . 2 CYS C 1 1
12 2545 1 1 2 CYS CA C 1.190 -1.791 -4.343 1.00 . A A . 2 CYS CA 1 1
12 2546 1 1 2 CYS CB C -0.279 -1.494 -4.654 1.00 . A A . 2 CYS CB 1 1
12 2547 1 1 2 CYS H H 1.713 0.180 -3.775 1.00 . A A . 2 CYS H 1 1
12 2548 1 1 2 CYS HA H 1.255 -2.731 -3.817 1.00 . A A . 2 CYS HA 1 1
12 2549 1 1 2 CYS HB2 H -0.453 -0.433 -4.550 1.00 . A A . 2 CYS HB2 1 1
12 2550 1 1 2 CYS HB3 H -0.491 -1.791 -5.670 1.00 . A A . 2 CYS HB3 1 1
12 2551 1 1 2 CYS N N 1.744 -0.755 -3.479 1.00 . A A . 2 CYS N 1 1
12 2552 1 1 2 CYS O O 2.832 -1.056 -5.934 1.00 . A A . 2 CYS O 1 1
12 2553 1 1 2 CYS SG S -1.458 -2.356 -3.565 1.00 . A A . 2 CYS SG 1 1
12 2554 1 1 3 ALA C C 2.243 -1.947 -8.601 1.00 . A A . 3 ALA C 1 1
12 2555 1 1 3 ALA CA C 2.387 -3.157 -7.685 1.00 . A A . 3 ALA CA 1 1
12 2556 1 1 3 ALA CB C 1.850 -4.406 -8.368 1.00 . A A . 3 ALA CB 1 1
12 2557 1 1 3 ALA H H 1.015 -3.577 -6.130 1.00 . A A . 3 ALA H 1 1
12 2558 1 1 3 ALA HA H 3.435 -3.313 -7.475 1.00 . A A . 3 ALA HA 1 1
12 2559 1 1 3 ALA HB1 H 0.846 -4.601 -8.022 1.00 . A A . 3 ALA HB1 1 1
12 2560 1 1 3 ALA HB2 H 1.841 -4.255 -9.437 1.00 . A A . 3 ALA HB2 1 1
12 2561 1 1 3 ALA HB3 H 2.482 -5.247 -8.129 1.00 . A A . 3 ALA HB3 1 1
12 2562 1 1 3 ALA N N 1.701 -2.940 -6.417 1.00 . A A . 3 ALA N 1 1
12 2563 1 1 3 ALA O O 1.132 -1.485 -8.865 1.00 . A A . 3 ALA O 1 1
12 2564 1 1 4 SER C C 2.612 0.888 -9.333 1.00 . A A . 4 SER C 1 1
12 2565 1 1 4 SER CA C 3.370 -0.276 -9.965 1.00 . A A . 4 SER CA 1 1
12 2566 1 1 4 SER CB C 2.744 -0.635 -11.314 1.00 . A A . 4 SER CB 1 1
12 2567 1 1 4 SER H H 4.225 -1.848 -8.834 1.00 . A A . 4 SER H 1 1
12 2568 1 1 4 SER HA H 4.397 0.022 -10.123 1.00 . A A . 4 SER HA 1 1
12 2569 1 1 4 SER HB2 H 2.928 -1.677 -11.527 1.00 . A A . 4 SER HB2 1 1
12 2570 1 1 4 SER HB3 H 1.679 -0.458 -11.272 1.00 . A A . 4 SER HB3 1 1
12 2571 1 1 4 SER HG H 2.728 0.904 -12.526 1.00 . A A . 4 SER HG 1 1
12 2572 1 1 4 SER N N 3.372 -1.435 -9.082 1.00 . A A . 4 SER N 1 1
12 2573 1 1 4 SER O O 2.052 1.732 -10.032 1.00 . A A . 4 SER O 1 1
12 2574 1 1 4 SER OG O 3.296 0.148 -12.358 1.00 . A A . 4 SER OG 1 1
12 2575 1 1 5 GLY C C 0.404 1.939 -7.508 1.00 . A A . 5 GLY C 1 1
12 2576 1 1 5 GLY CA C 1.905 1.987 -7.299 1.00 . A A . 5 GLY CA 1 1
12 2577 1 1 5 GLY H H 3.061 0.224 -7.499 1.00 . A A . 5 GLY H 1 1
12 2578 1 1 5 GLY HA2 H 2.114 1.899 -6.243 1.00 . A A . 5 GLY HA2 1 1
12 2579 1 1 5 GLY HA3 H 2.276 2.938 -7.651 1.00 . A A . 5 GLY HA3 1 1
12 2580 1 1 5 GLY N N 2.597 0.924 -8.004 1.00 . A A . 5 GLY N 1 1
12 2581 1 1 5 GLY O O -0.251 2.977 -7.602 1.00 . A A . 5 GLY O 1 1
12 2582 1 1 6 CYS C C -2.354 0.939 -6.530 1.00 . A A . 6 CYS C 1 1
12 2583 1 1 6 CYS CA C -1.576 0.550 -7.783 1.00 . A A . 6 CYS CA 1 1
12 2584 1 1 6 CYS CB C -1.881 -0.902 -8.156 1.00 . A A . 6 CYS CB 1 1
12 2585 1 1 6 CYS H H 0.431 -0.060 -7.499 1.00 . A A . 6 CYS H 1 1
12 2586 1 1 6 CYS HA H -1.880 1.194 -8.595 1.00 . A A . 6 CYS HA 1 1
12 2587 1 1 6 CYS HB2 H -1.181 -1.550 -7.649 1.00 . A A . 6 CYS HB2 1 1
12 2588 1 1 6 CYS HB3 H -2.883 -1.144 -7.837 1.00 . A A . 6 CYS HB3 1 1
12 2589 1 1 6 CYS N N -0.143 0.731 -7.581 1.00 . A A . 6 CYS N 1 1
12 2590 1 1 6 CYS O O -1.767 1.282 -5.503 1.00 . A A . 6 CYS O 1 1
12 2591 1 1 6 CYS SG S -1.766 -1.250 -9.940 1.00 . A A . 6 CYS SG 1 1
12 2592 1 1 7 ARG C C -4.857 -0.002 -4.655 1.00 . A A . 7 ARG C 1 1
12 2593 1 1 7 ARG CA C -4.539 1.230 -5.495 1.00 . A A . 7 ARG CA 1 1
12 2594 1 1 7 ARG CB C -5.835 1.870 -5.994 1.00 . A A . 7 ARG CB 1 1
12 2595 1 1 7 ARG CD C -7.152 3.994 -6.255 1.00 . A A . 7 ARG CD 1 1
12 2596 1 1 7 ARG CG C -5.769 3.385 -6.091 1.00 . A A . 7 ARG CG 1 1
12 2597 1 1 7 ARG CZ C -9.087 3.737 -7.751 1.00 . A A . 7 ARG CZ 1 1
12 2598 1 1 7 ARG H H -4.088 0.602 -7.466 1.00 . A A . 7 ARG H 1 1
12 2599 1 1 7 ARG HA H -4.008 1.943 -4.881 1.00 . A A . 7 ARG HA 1 1
12 2600 1 1 7 ARG HB2 H -6.062 1.479 -6.975 1.00 . A A . 7 ARG HB2 1 1
12 2601 1 1 7 ARG HB3 H -6.635 1.608 -5.318 1.00 . A A . 7 ARG HB3 1 1
12 2602 1 1 7 ARG HD2 H -7.767 3.689 -5.421 1.00 . A A . 7 ARG HD2 1 1
12 2603 1 1 7 ARG HD3 H -7.059 5.069 -6.259 1.00 . A A . 7 ARG HD3 1 1
12 2604 1 1 7 ARG HE H -7.233 3.135 -8.172 1.00 . A A . 7 ARG HE 1 1
12 2605 1 1 7 ARG HG2 H -5.322 3.774 -5.188 1.00 . A A . 7 ARG HG2 1 1
12 2606 1 1 7 ARG HG3 H -5.162 3.656 -6.941 1.00 . A A . 7 ARG HG3 1 1
12 2607 1 1 7 ARG HH11 H -9.490 4.634 -5.987 1.00 . A A . 7 ARG HH11 1 1
12 2608 1 1 7 ARG HH12 H -10.844 4.447 -7.050 1.00 . A A . 7 ARG HH12 1 1
12 2609 1 1 7 ARG HH21 H -9.008 2.883 -9.581 1.00 . A A . 7 ARG HH21 1 1
12 2610 1 1 7 ARG HH22 H -10.570 3.450 -9.095 1.00 . A A . 7 ARG HH22 1 1
12 2611 1 1 7 ARG N N -3.679 0.882 -6.621 1.00 . A A . 7 ARG N 1 1
12 2612 1 1 7 ARG NE N -7.794 3.568 -7.496 1.00 . A A . 7 ARG NE 1 1
12 2613 1 1 7 ARG NH1 N -9.872 4.320 -6.855 1.00 . A A . 7 ARG NH1 1 1
12 2614 1 1 7 ARG NH2 N -9.597 3.323 -8.904 1.00 . A A . 7 ARG NH2 1 1
12 2615 1 1 7 ARG O O -5.170 -1.068 -5.188 1.00 . A A . 7 ARG O 1 1
12 2616 1 1 8 LYS C C -6.554 -1.227 -2.345 1.00 . A A . 8 LYS C 1 1
12 2617 1 1 8 LYS CA C -5.056 -0.951 -2.421 1.00 . A A . 8 LYS CA 1 1
12 2618 1 1 8 LYS CB C -4.513 -0.631 -1.026 1.00 . A A . 8 LYS CB 1 1
12 2619 1 1 8 LYS CD C -2.617 -0.810 0.611 1.00 . A A . 8 LYS CD 1 1
12 2620 1 1 8 LYS CE C -1.590 -1.816 1.107 1.00 . A A . 8 LYS CE 1 1
12 2621 1 1 8 LYS CG C -3.110 -1.159 -0.783 1.00 . A A . 8 LYS CG 1 1
12 2622 1 1 8 LYS H H -4.520 1.022 -2.972 1.00 . A A . 8 LYS H 1 1
12 2623 1 1 8 LYS HA H -4.558 -1.831 -2.799 1.00 . A A . 8 LYS HA 1 1
12 2624 1 1 8 LYS HB2 H -4.500 0.442 -0.896 1.00 . A A . 8 LYS HB2 1 1
12 2625 1 1 8 LYS HB3 H -5.173 -1.066 -0.289 1.00 . A A . 8 LYS HB3 1 1
12 2626 1 1 8 LYS HD2 H -2.162 0.170 0.587 1.00 . A A . 8 LYS HD2 1 1
12 2627 1 1 8 LYS HD3 H -3.458 -0.802 1.290 1.00 . A A . 8 LYS HD3 1 1
12 2628 1 1 8 LYS HE2 H -1.540 -1.759 2.183 1.00 . A A . 8 LYS HE2 1 1
12 2629 1 1 8 LYS HE3 H -1.906 -2.807 0.814 1.00 . A A . 8 LYS HE3 1 1
12 2630 1 1 8 LYS HG2 H -3.116 -2.234 -0.892 1.00 . A A . 8 LYS HG2 1 1
12 2631 1 1 8 LYS HG3 H -2.441 -0.724 -1.511 1.00 . A A . 8 LYS HG3 1 1
12 2632 1 1 8 LYS HZ1 H 0.194 -0.734 1.020 1.00 . A A . 8 LYS HZ1 1 1
12 2633 1 1 8 LYS HZ2 H -0.307 -1.349 -0.474 1.00 . A A . 8 LYS HZ2 1 1
12 2634 1 1 8 LYS HZ3 H 0.375 -2.382 0.680 1.00 . A A . 8 LYS HZ3 1 1
12 2635 1 1 8 LYS N N -4.775 0.149 -3.337 1.00 . A A . 8 LYS N 1 1
12 2636 1 1 8 LYS NZ N -0.237 -1.552 0.544 1.00 . A A . 8 LYS NZ 1 1
12 2637 1 1 8 LYS O O -7.373 -0.345 -2.607 1.00 . A A . 8 LYS O 1 1
12 2638 1 1 9 LYS C C -8.577 -3.512 -0.522 1.00 . A A . 9 LYS C 1 1
12 2639 1 1 9 LYS CA C -8.306 -2.848 -1.868 1.00 . A A . 9 LYS CA 1 1
12 2640 1 1 9 LYS CB C -8.685 -3.800 -3.005 1.00 . A A . 9 LYS CB 1 1
12 2641 1 1 9 LYS CD C -8.560 -4.345 -5.454 1.00 . A A . 9 LYS CD 1 1
12 2642 1 1 9 LYS CE C -7.749 -5.626 -5.349 1.00 . A A . 9 LYS CE 1 1
12 2643 1 1 9 LYS CG C -8.180 -3.354 -4.366 1.00 . A A . 9 LYS CG 1 1
12 2644 1 1 9 LYS H H -6.208 -3.115 -1.786 1.00 . A A . 9 LYS H 1 1
12 2645 1 1 9 LYS HA H -8.908 -1.955 -1.943 1.00 . A A . 9 LYS HA 1 1
12 2646 1 1 9 LYS HB2 H -8.272 -4.775 -2.793 1.00 . A A . 9 LYS HB2 1 1
12 2647 1 1 9 LYS HB3 H -9.761 -3.877 -3.051 1.00 . A A . 9 LYS HB3 1 1
12 2648 1 1 9 LYS HD2 H -9.609 -4.586 -5.358 1.00 . A A . 9 LYS HD2 1 1
12 2649 1 1 9 LYS HD3 H -8.380 -3.892 -6.419 1.00 . A A . 9 LYS HD3 1 1
12 2650 1 1 9 LYS HE2 H -6.734 -5.421 -5.655 1.00 . A A . 9 LYS HE2 1 1
12 2651 1 1 9 LYS HE3 H -7.755 -5.958 -4.321 1.00 . A A . 9 LYS HE3 1 1
12 2652 1 1 9 LYS HG2 H -8.611 -2.392 -4.602 1.00 . A A . 9 LYS HG2 1 1
12 2653 1 1 9 LYS HG3 H -7.104 -3.269 -4.331 1.00 . A A . 9 LYS HG3 1 1
12 2654 1 1 9 LYS HZ1 H -8.511 -6.336 -7.160 1.00 . A A . 9 LYS HZ1 1 1
12 2655 1 1 9 LYS HZ2 H -9.185 -7.076 -5.796 1.00 . A A . 9 LYS HZ2 1 1
12 2656 1 1 9 LYS HZ3 H -7.621 -7.485 -6.294 1.00 . A A . 9 LYS HZ3 1 1
12 2657 1 1 9 LYS N N -6.906 -2.456 -1.982 1.00 . A A . 9 LYS N 1 1
12 2658 1 1 9 LYS NZ N -8.305 -6.707 -6.210 1.00 . A A . 9 LYS NZ 1 1
12 2659 1 1 9 LYS O O -7.650 -3.933 0.171 1.00 . A A . 9 LYS O 1 1
12 2660 1 1 10 ARG C C -9.800 -5.678 1.160 1.00 . A A . 10 ARG C 1 1
12 2661 1 1 10 ARG CA C -10.244 -4.219 1.104 1.00 . A A . 10 ARG CA 1 1
12 2662 1 1 10 ARG CB C -11.760 -4.129 1.291 1.00 . A A . 10 ARG CB 1 1
12 2663 1 1 10 ARG CD C -13.107 -3.638 -0.774 1.00 . A A . 10 ARG CD 1 1
12 2664 1 1 10 ARG CG C -12.552 -4.722 0.136 1.00 . A A . 10 ARG CG 1 1
12 2665 1 1 10 ARG CZ C -15.228 -2.440 -1.108 1.00 . A A . 10 ARG CZ 1 1
12 2666 1 1 10 ARG H H -10.546 -3.252 -0.754 1.00 . A A . 10 ARG H 1 1
12 2667 1 1 10 ARG HA H -9.760 -3.676 1.901 1.00 . A A . 10 ARG HA 1 1
12 2668 1 1 10 ARG HB2 H -12.031 -4.656 2.193 1.00 . A A . 10 ARG HB2 1 1
12 2669 1 1 10 ARG HB3 H -12.036 -3.091 1.393 1.00 . A A . 10 ARG HB3 1 1
12 2670 1 1 10 ARG HD2 H -12.443 -2.787 -0.745 1.00 . A A . 10 ARG HD2 1 1
12 2671 1 1 10 ARG HD3 H -13.157 -4.023 -1.781 1.00 . A A . 10 ARG HD3 1 1
12 2672 1 1 10 ARG HE H -14.766 -3.509 0.511 1.00 . A A . 10 ARG HE 1 1
12 2673 1 1 10 ARG HG2 H -11.903 -5.364 -0.441 1.00 . A A . 10 ARG HG2 1 1
12 2674 1 1 10 ARG HG3 H -13.371 -5.300 0.535 1.00 . A A . 10 ARG HG3 1 1
12 2675 1 1 10 ARG HH11 H -13.911 -2.279 -2.632 1.00 . A A . 10 ARG HH11 1 1
12 2676 1 1 10 ARG HH12 H -15.410 -1.440 -2.856 1.00 . A A . 10 ARG HH12 1 1
12 2677 1 1 10 ARG HH21 H -16.744 -2.409 0.228 1.00 . A A . 10 ARG HH21 1 1
12 2678 1 1 10 ARG HH22 H -17.020 -1.514 -1.228 1.00 . A A . 10 ARG HH22 1 1
12 2679 1 1 10 ARG N N -9.853 -3.605 -0.159 1.00 . A A . 10 ARG N 1 1
12 2680 1 1 10 ARG NE N -14.441 -3.209 -0.363 1.00 . A A . 10 ARG NE 1 1
12 2681 1 1 10 ARG NH1 N -14.816 -2.018 -2.296 1.00 . A A . 10 ARG NH1 1 1
12 2682 1 1 10 ARG NH2 N -16.429 -2.092 -0.666 1.00 . A A . 10 ARG NH2 1 1
12 2683 1 1 10 ARG O O -9.570 -6.226 2.238 1.00 . A A . 10 ARG O 1 1
12 2684 1 1 11 HIS C C -7.765 -7.830 0.157 1.00 . A A . 11 HIS C 1 1
12 2685 1 1 11 HIS CA C -9.264 -7.696 -0.092 1.00 . A A . 11 HIS CA 1 1
12 2686 1 1 11 HIS CB C -9.619 -8.275 -1.461 1.00 . A A . 11 HIS CB 1 1
12 2687 1 1 11 HIS CD2 C -12.126 -8.434 -0.818 1.00 . A A . 11 HIS CD2 1 1
12 2688 1 1 11 HIS CE1 C -12.771 -9.831 -2.380 1.00 . A A . 11 HIS CE1 1 1
12 2689 1 1 11 HIS CG C -11.041 -8.734 -1.568 1.00 . A A . 11 HIS CG 1 1
12 2690 1 1 11 HIS H H -9.878 -5.810 -0.833 1.00 . A A . 11 HIS H 1 1
12 2691 1 1 11 HIS HA H -9.794 -8.246 0.670 1.00 . A A . 11 HIS HA 1 1
12 2692 1 1 11 HIS HB2 H -9.458 -7.519 -2.217 1.00 . A A . 11 HIS HB2 1 1
12 2693 1 1 11 HIS HB3 H -8.979 -9.122 -1.664 1.00 . A A . 11 HIS HB3 1 1
12 2694 1 1 11 HIS HD1 H -10.922 -10.013 -3.238 1.00 . A A . 11 HIS HD1 1 1
12 2695 1 1 11 HIS HD2 H -12.153 -7.771 0.036 1.00 . A A . 11 HIS HD2 1 1
12 2696 1 1 11 HIS HE1 H -13.382 -10.475 -2.994 1.00 . A A . 11 HIS HE1 1 1
12 2697 1 1 11 HIS N N -9.681 -6.300 -0.008 1.00 . A A . 11 HIS N 1 1
12 2698 1 1 11 HIS ND1 N -11.478 -9.612 -2.538 1.00 . A A . 11 HIS ND1 1 1
12 2699 1 1 11 HIS NE2 N -13.188 -9.128 -1.343 1.00 . A A . 11 HIS NE2 1 1
12 2700 1 1 11 HIS O O -7.270 -8.916 0.458 1.00 . A A . 11 HIS O 1 1
12 2701 1 1 12 GLY C C -4.830 -6.660 -1.054 1.00 . A A . 12 GLY C 1 1
12 2702 1 1 12 GLY CA C -5.610 -6.736 0.243 1.00 . A A . 12 GLY CA 1 1
12 2703 1 1 12 GLY H H -7.493 -5.882 -0.213 1.00 . A A . 12 GLY H 1 1
12 2704 1 1 12 GLY HA2 H -5.341 -5.894 0.863 1.00 . A A . 12 GLY HA2 1 1
12 2705 1 1 12 GLY HA3 H -5.346 -7.648 0.757 1.00 . A A . 12 GLY HA3 1 1
12 2706 1 1 12 GLY N N -7.046 -6.719 0.030 1.00 . A A . 12 GLY N 1 1
12 2707 1 1 12 GLY O O -3.643 -6.339 -1.054 1.00 . A A . 12 GLY O 1 1
12 2708 1 1 13 GLY C C -4.616 -5.505 -3.950 1.00 . A A . 13 GLY C 1 1
12 2709 1 1 13 GLY CA C -4.844 -6.920 -3.457 1.00 . A A . 13 GLY CA 1 1
12 2710 1 1 13 GLY H H -6.445 -7.210 -2.103 1.00 . A A . 13 GLY H 1 1
12 2711 1 1 13 GLY HA2 H -3.890 -7.421 -3.382 1.00 . A A . 13 GLY HA2 1 1
12 2712 1 1 13 GLY HA3 H -5.458 -7.444 -4.176 1.00 . A A . 13 GLY HA3 1 1
12 2713 1 1 13 GLY N N -5.499 -6.960 -2.163 1.00 . A A . 13 GLY N 1 1
12 2714 1 1 13 GLY O O -4.765 -4.544 -3.192 1.00 . A A . 13 GLY O 1 1
12 2715 1 1 14 CYS C C -4.738 -3.918 -7.140 1.00 . A A . 14 CYS C 1 1
12 2716 1 1 14 CYS CA C -4.001 -4.064 -5.813 1.00 . A A . 14 CYS CA 1 1
12 2717 1 1 14 CYS CB C -2.500 -3.857 -6.025 1.00 . A A . 14 CYS CB 1 1
12 2718 1 1 14 CYS H H -4.149 -6.176 -5.774 1.00 . A A . 14 CYS H 1 1
12 2719 1 1 14 CYS HA H -4.366 -3.314 -5.128 1.00 . A A . 14 CYS HA 1 1
12 2720 1 1 14 CYS HB2 H -2.165 -4.498 -6.826 1.00 . A A . 14 CYS HB2 1 1
12 2721 1 1 14 CYS HB3 H -2.321 -2.827 -6.295 1.00 . A A . 14 CYS HB3 1 1
12 2722 1 1 14 CYS N N -4.252 -5.372 -5.220 1.00 . A A . 14 CYS N 1 1
12 2723 1 1 14 CYS O O -4.610 -4.760 -8.030 1.00 . A A . 14 CYS O 1 1
12 2724 1 1 14 CYS SG S -1.484 -4.228 -4.559 1.00 . A A . 14 CYS SG 1 1
12 2725 1 1 15 SER C C -5.397 -1.916 -9.541 1.00 . A A . 15 SER C 1 1
12 2726 1 1 15 SER CA C -6.270 -2.588 -8.486 1.00 . A A . 15 SER CA 1 1
12 2727 1 1 15 SER CB C -7.485 -1.710 -8.179 1.00 . A A . 15 SER CB 1 1
12 2728 1 1 15 SER H H -5.570 -2.208 -6.524 1.00 . A A . 15 SER H 1 1
12 2729 1 1 15 SER HA H -6.611 -3.538 -8.869 1.00 . A A . 15 SER HA 1 1
12 2730 1 1 15 SER HB2 H -8.170 -2.255 -7.549 1.00 . A A . 15 SER HB2 1 1
12 2731 1 1 15 SER HB3 H -7.159 -0.815 -7.667 1.00 . A A . 15 SER HB3 1 1
12 2732 1 1 15 SER HG H -8.500 -0.444 -9.276 1.00 . A A . 15 SER HG 1 1
12 2733 1 1 15 SER N N -5.509 -2.843 -7.268 1.00 . A A . 15 SER N 1 1
12 2734 1 1 15 SER O O -4.774 -0.886 -9.284 1.00 . A A . 15 SER O 1 1
12 2735 1 1 15 SER OG O -8.157 -1.336 -9.369 1.00 . A A . 15 SER OG 1 1
12 2736 1 1 16 CYS C C -5.369 -1.928 -13.118 1.00 . A A . 16 CYS C 1 1
12 2737 1 1 16 CYS CA C -4.558 -1.971 -11.826 1.00 . A A . 16 CYS CA 1 1
12 2738 1 1 16 CYS CB C -3.298 -2.814 -12.029 1.00 . A A . 16 CYS CB 1 1
12 2739 1 1 16 CYS H H -5.874 -3.329 -10.874 1.00 . A A . 16 CYS H 1 1
12 2740 1 1 16 CYS HA H -4.269 -0.965 -11.563 1.00 . A A . 16 CYS HA 1 1
12 2741 1 1 16 CYS HB2 H -3.575 -3.759 -12.473 1.00 . A A . 16 CYS HB2 1 1
12 2742 1 1 16 CYS HB3 H -2.628 -2.291 -12.696 1.00 . A A . 16 CYS HB3 1 1
12 2743 1 1 16 CYS N N -5.355 -2.509 -10.730 1.00 . A A . 16 CYS N 1 1
12 2744 1 1 16 CYS O O -6.427 -2.549 -13.220 1.00 . A A . 16 CYS O 1 1
12 2745 1 1 16 CYS SG S -2.385 -3.169 -10.494 1.00 . A A . 16 CYS SG 1 1
12 2746 1 1 17 NH2 HN1 H -5.329 -1.107 -14.984 1.00 . A A . 17 NH2 HN1 1 1
12 2747 1 1 17 NH2 HN2 H -4.018 -0.719 -13.961 1.00 . A A . 17 NH2 HN2 1 1
12 2748 1 1 17 NH2 N N -4.865 -1.190 -14.102 1.00 . A A . 17 NH2 N 1 1
13 2749 1 1 1 TRP C C 1.696 -1.367 -2.043 1.00 . A A . 1 TRP C 1 1
13 2750 1 1 1 TRP CA C 2.249 -0.302 -1.102 1.00 . A A . 1 TRP CA 1 1
13 2751 1 1 1 TRP CB C 3.743 -0.532 -0.873 1.00 . A A . 1 TRP CB 1 1
13 2752 1 1 1 TRP CD1 C 5.312 0.609 -2.547 1.00 . A A . 1 TRP CD1 1 1
13 2753 1 1 1 TRP CD2 C 4.694 -1.463 -3.129 1.00 . A A . 1 TRP CD2 1 1
13 2754 1 1 1 TRP CE2 C 5.549 -0.952 -4.126 1.00 . A A . 1 TRP CE2 1 1
13 2755 1 1 1 TRP CE3 C 4.180 -2.754 -3.279 1.00 . A A . 1 TRP CE3 1 1
13 2756 1 1 1 TRP CG C 4.557 -0.448 -2.128 1.00 . A A . 1 TRP CG 1 1
13 2757 1 1 1 TRP CH2 C 5.381 -2.949 -5.376 1.00 . A A . 1 TRP CH2 1 1
13 2758 1 1 1 TRP CZ2 C 5.898 -1.688 -5.254 1.00 . A A . 1 TRP CZ2 1 1
13 2759 1 1 1 TRP CZ3 C 4.528 -3.483 -4.401 1.00 . A A . 1 TRP CZ3 1 1
13 2760 1 1 1 TRP H1 H 2.041 -0.412 1.003 1.00 . A A . 1 TRP H1 1 1
13 2761 1 1 1 TRP HA H 2.108 0.669 -1.554 1.00 . A A . 1 TRP HA 1 1
13 2762 1 1 1 TRP HB2 H 4.114 0.213 -0.185 1.00 . A A . 1 TRP HB2 1 1
13 2763 1 1 1 TRP HB3 H 3.887 -1.514 -0.445 1.00 . A A . 1 TRP HB3 1 1
13 2764 1 1 1 TRP HD1 H 5.413 1.537 -2.004 1.00 . A A . 1 TRP HD1 1 1
13 2765 1 1 1 TRP HE1 H 6.503 0.912 -4.250 1.00 . A A . 1 TRP HE1 1 1
13 2766 1 1 1 TRP HE3 H 3.522 -3.183 -2.539 1.00 . A A . 1 TRP HE3 1 1
13 2767 1 1 1 TRP HH2 H 5.625 -3.553 -6.236 1.00 . A A . 1 TRP HH2 1 1
13 2768 1 1 1 TRP HZ2 H 6.554 -1.290 -6.016 1.00 . A A . 1 TRP HZ2 1 1
13 2769 1 1 1 TRP HZ3 H 4.140 -4.482 -4.535 1.00 . A A . 1 TRP HZ3 1 1
13 2770 1 1 1 TRP N N 1.534 -0.311 0.169 1.00 . A A . 1 TRP N 1 1
13 2771 1 1 1 TRP NE1 N 5.911 0.314 -3.747 1.00 . A A . 1 TRP NE1 1 1
13 2772 1 1 1 TRP O O 1.345 -2.466 -1.616 1.00 . A A . 1 TRP O 1 1
13 2773 1 1 2 CYS C C 1.982 -1.935 -5.586 1.00 . A A . 2 CYS C 1 1
13 2774 1 1 2 CYS CA C 1.114 -1.960 -4.331 1.00 . A A . 2 CYS CA 1 1
13 2775 1 1 2 CYS CB C -0.332 -1.613 -4.691 1.00 . A A . 2 CYS CB 1 1
13 2776 1 1 2 CYS H H 1.919 -0.141 -3.609 1.00 . A A . 2 CYS H 1 1
13 2777 1 1 2 CYS HA H 1.141 -2.954 -3.909 1.00 . A A . 2 CYS HA 1 1
13 2778 1 1 2 CYS HB2 H -0.478 -0.548 -4.572 1.00 . A A . 2 CYS HB2 1 1
13 2779 1 1 2 CYS HB3 H -0.514 -1.883 -5.720 1.00 . A A . 2 CYS HB3 1 1
13 2780 1 1 2 CYS N N 1.623 -1.033 -3.328 1.00 . A A . 2 CYS N 1 1
13 2781 1 1 2 CYS O O 2.765 -1.010 -5.793 1.00 . A A . 2 CYS O 1 1
13 2782 1 1 2 CYS SG S -1.577 -2.457 -3.665 1.00 . A A . 2 CYS SG 1 1
13 2783 1 1 3 ALA C C 2.292 -1.885 -8.587 1.00 . A A . 3 ALA C 1 1
13 2784 1 1 3 ALA CA C 2.603 -3.053 -7.656 1.00 . A A . 3 ALA CA 1 1
13 2785 1 1 3 ALA CB C 2.321 -4.376 -8.354 1.00 . A A . 3 ALA CB 1 1
13 2786 1 1 3 ALA H H 1.194 -3.666 -6.202 1.00 . A A . 3 ALA H 1 1
13 2787 1 1 3 ALA HA H 3.652 -3.026 -7.400 1.00 . A A . 3 ALA HA 1 1
13 2788 1 1 3 ALA HB1 H 2.655 -4.319 -9.379 1.00 . A A . 3 ALA HB1 1 1
13 2789 1 1 3 ALA HB2 H 2.849 -5.169 -7.846 1.00 . A A . 3 ALA HB2 1 1
13 2790 1 1 3 ALA HB3 H 1.260 -4.575 -8.330 1.00 . A A . 3 ALA HB3 1 1
13 2791 1 1 3 ALA N N 1.835 -2.959 -6.421 1.00 . A A . 3 ALA N 1 1
13 2792 1 1 3 ALA O O 1.138 -1.476 -8.721 1.00 . A A . 3 ALA O 1 1
13 2793 1 1 4 SER C C 2.415 0.917 -9.467 1.00 . A A . 4 SER C 1 1
13 2794 1 1 4 SER CA C 3.165 -0.228 -10.142 1.00 . A A . 4 SER CA 1 1
13 2795 1 1 4 SER CB C 2.416 -0.672 -11.400 1.00 . A A . 4 SER CB 1 1
13 2796 1 1 4 SER H H 4.223 -1.723 -9.078 1.00 . A A . 4 SER H 1 1
13 2797 1 1 4 SER HA H 4.148 0.116 -10.421 1.00 . A A . 4 SER HA 1 1
13 2798 1 1 4 SER HB2 H 2.705 -1.682 -11.650 1.00 . A A . 4 SER HB2 1 1
13 2799 1 1 4 SER HB3 H 1.352 -0.637 -11.214 1.00 . A A . 4 SER HB3 1 1
13 2800 1 1 4 SER HG H 3.209 -0.319 -13.156 1.00 . A A . 4 SER HG 1 1
13 2801 1 1 4 SER N N 3.328 -1.353 -9.227 1.00 . A A . 4 SER N 1 1
13 2802 1 1 4 SER O O 1.664 1.647 -10.112 1.00 . A A . 4 SER O 1 1
13 2803 1 1 4 SER OG O 2.717 0.174 -12.496 1.00 . A A . 4 SER OG 1 1
13 2804 1 1 5 GLY C C 0.450 2.029 -7.505 1.00 . A A . 5 GLY C 1 1
13 2805 1 1 5 GLY CA C 1.960 2.123 -7.421 1.00 . A A . 5 GLY CA 1 1
13 2806 1 1 5 GLY H H 3.233 0.452 -7.700 1.00 . A A . 5 GLY H 1 1
13 2807 1 1 5 GLY HA2 H 2.258 2.062 -6.385 1.00 . A A . 5 GLY HA2 1 1
13 2808 1 1 5 GLY HA3 H 2.274 3.077 -7.819 1.00 . A A . 5 GLY HA3 1 1
13 2809 1 1 5 GLY N N 2.624 1.065 -8.163 1.00 . A A . 5 GLY N 1 1
13 2810 1 1 5 GLY O O -0.253 3.016 -7.281 1.00 . A A . 5 GLY O 1 1
13 2811 1 1 6 CYS C C -2.203 1.015 -6.653 1.00 . A A . 6 CYS C 1 1
13 2812 1 1 6 CYS CA C -1.488 0.625 -7.944 1.00 . A A . 6 CYS CA 1 1
13 2813 1 1 6 CYS CB C -1.778 -0.840 -8.277 1.00 . A A . 6 CYS CB 1 1
13 2814 1 1 6 CYS H H 0.561 0.094 -7.995 1.00 . A A . 6 CYS H 1 1
13 2815 1 1 6 CYS HA H -1.855 1.247 -8.746 1.00 . A A . 6 CYS HA 1 1
13 2816 1 1 6 CYS HB2 H -1.016 -1.460 -7.828 1.00 . A A . 6 CYS HB2 1 1
13 2817 1 1 6 CYS HB3 H -2.741 -1.111 -7.869 1.00 . A A . 6 CYS HB3 1 1
13 2818 1 1 6 CYS N N -0.051 0.842 -7.828 1.00 . A A . 6 CYS N 1 1
13 2819 1 1 6 CYS O O -1.567 1.394 -5.670 1.00 . A A . 6 CYS O 1 1
13 2820 1 1 6 CYS SG S -1.807 -1.205 -10.061 1.00 . A A . 6 CYS SG 1 1
13 2821 1 1 7 ARG C C -4.608 0.030 -4.646 1.00 . A A . 7 ARG C 1 1
13 2822 1 1 7 ARG CA C -4.329 1.265 -5.498 1.00 . A A . 7 ARG CA 1 1
13 2823 1 1 7 ARG CB C -5.649 1.909 -5.929 1.00 . A A . 7 ARG CB 1 1
13 2824 1 1 7 ARG CD C -5.871 4.171 -4.855 1.00 . A A . 7 ARG CD 1 1
13 2825 1 1 7 ARG CG C -5.554 3.412 -6.135 1.00 . A A . 7 ARG CG 1 1
13 2826 1 1 7 ARG CZ C -7.742 4.426 -3.281 1.00 . A A . 7 ARG CZ 1 1
13 2827 1 1 7 ARG H H -3.979 0.614 -7.480 1.00 . A A . 7 ARG H 1 1
13 2828 1 1 7 ARG HA H -3.769 1.975 -4.908 1.00 . A A . 7 ARG HA 1 1
13 2829 1 1 7 ARG HB2 H -5.968 1.461 -6.858 1.00 . A A . 7 ARG HB2 1 1
13 2830 1 1 7 ARG HB3 H -6.393 1.717 -5.171 1.00 . A A . 7 ARG HB3 1 1
13 2831 1 1 7 ARG HD2 H -5.214 3.819 -4.073 1.00 . A A . 7 ARG HD2 1 1
13 2832 1 1 7 ARG HD3 H -5.698 5.223 -5.024 1.00 . A A . 7 ARG HD3 1 1
13 2833 1 1 7 ARG HE H -7.852 3.493 -5.040 1.00 . A A . 7 ARG HE 1 1
13 2834 1 1 7 ARG HG2 H -4.551 3.661 -6.448 1.00 . A A . 7 ARG HG2 1 1
13 2835 1 1 7 ARG HG3 H -6.257 3.706 -6.901 1.00 . A A . 7 ARG HG3 1 1
13 2836 1 1 7 ARG HH11 H -6.001 5.250 -2.673 1.00 . A A . 7 ARG HH11 1 1
13 2837 1 1 7 ARG HH12 H -7.328 5.423 -1.572 1.00 . A A . 7 ARG HH12 1 1
13 2838 1 1 7 ARG HH21 H -9.607 3.713 -3.599 1.00 . A A . 7 ARG HH21 1 1
13 2839 1 1 7 ARG HH22 H -9.378 4.548 -2.101 1.00 . A A . 7 ARG HH22 1 1
13 2840 1 1 7 ARG N N -3.528 0.922 -6.665 1.00 . A A . 7 ARG N 1 1
13 2841 1 1 7 ARG NE N -7.256 3.978 -4.434 1.00 . A A . 7 ARG NE 1 1
13 2842 1 1 7 ARG NH1 N -6.959 5.087 -2.439 1.00 . A A . 7 ARG NH1 1 1
13 2843 1 1 7 ARG NH2 N -9.014 4.211 -2.967 1.00 . A A . 7 ARG NH2 1 1
13 2844 1 1 7 ARG O O -4.645 -1.092 -5.153 1.00 . A A . 7 ARG O 1 1
13 2845 1 1 8 LYS C C -6.561 -1.218 -2.445 1.00 . A A . 8 LYS C 1 1
13 2846 1 1 8 LYS CA C -5.080 -0.851 -2.427 1.00 . A A . 8 LYS CA 1 1
13 2847 1 1 8 LYS CB C -4.656 -0.469 -1.007 1.00 . A A . 8 LYS CB 1 1
13 2848 1 1 8 LYS CD C -2.681 -0.086 0.497 1.00 . A A . 8 LYS CD 1 1
13 2849 1 1 8 LYS CE C -3.104 -0.660 1.841 1.00 . A A . 8 LYS CE 1 1
13 2850 1 1 8 LYS CG C -3.243 -0.899 -0.657 1.00 . A A . 8 LYS CG 1 1
13 2851 1 1 8 LYS H H -4.762 1.161 -3.004 1.00 . A A . 8 LYS H 1 1
13 2852 1 1 8 LYS HA H -4.506 -1.708 -2.746 1.00 . A A . 8 LYS HA 1 1
13 2853 1 1 8 LYS HB2 H -4.719 0.605 -0.903 1.00 . A A . 8 LYS HB2 1 1
13 2854 1 1 8 LYS HB3 H -5.335 -0.930 -0.304 1.00 . A A . 8 LYS HB3 1 1
13 2855 1 1 8 LYS HD2 H -1.602 -0.092 0.439 1.00 . A A . 8 LYS HD2 1 1
13 2856 1 1 8 LYS HD3 H -3.042 0.929 0.420 1.00 . A A . 8 LYS HD3 1 1
13 2857 1 1 8 LYS HE2 H -4.181 -0.713 1.872 1.00 . A A . 8 LYS HE2 1 1
13 2858 1 1 8 LYS HE3 H -2.692 -1.654 1.938 1.00 . A A . 8 LYS HE3 1 1
13 2859 1 1 8 LYS HG2 H -3.253 -1.942 -0.377 1.00 . A A . 8 LYS HG2 1 1
13 2860 1 1 8 LYS HG3 H -2.609 -0.763 -1.523 1.00 . A A . 8 LYS HG3 1 1
13 2861 1 1 8 LYS HZ1 H -1.588 0.128 3.042 1.00 . A A . 8 LYS HZ1 1 1
13 2862 1 1 8 LYS HZ2 H -3.033 -0.168 3.869 1.00 . A A . 8 LYS HZ2 1 1
13 2863 1 1 8 LYS HZ3 H -2.908 1.165 2.836 1.00 . A A . 8 LYS HZ3 1 1
13 2864 1 1 8 LYS N N -4.804 0.243 -3.349 1.00 . A A . 8 LYS N 1 1
13 2865 1 1 8 LYS NZ N -2.624 0.175 2.977 1.00 . A A . 8 LYS NZ 1 1
13 2866 1 1 8 LYS O O -7.404 -0.418 -2.851 1.00 . A A . 8 LYS O 1 1
13 2867 1 1 9 LYS C C -8.557 -3.579 -0.630 1.00 . A A . 9 LYS C 1 1
13 2868 1 1 9 LYS CA C -8.250 -2.904 -1.963 1.00 . A A . 9 LYS CA 1 1
13 2869 1 1 9 LYS CB C -8.508 -3.880 -3.113 1.00 . A A . 9 LYS CB 1 1
13 2870 1 1 9 LYS CD C -8.345 -4.348 -5.576 1.00 . A A . 9 LYS CD 1 1
13 2871 1 1 9 LYS CE C -7.783 -5.745 -5.358 1.00 . A A . 9 LYS CE 1 1
13 2872 1 1 9 LYS CG C -7.953 -3.409 -4.447 1.00 . A A . 9 LYS CG 1 1
13 2873 1 1 9 LYS H H -6.154 -3.023 -1.690 1.00 . A A . 9 LYS H 1 1
13 2874 1 1 9 LYS HA H -8.897 -2.047 -2.077 1.00 . A A . 9 LYS HA 1 1
13 2875 1 1 9 LYS HB2 H -8.052 -4.829 -2.872 1.00 . A A . 9 LYS HB2 1 1
13 2876 1 1 9 LYS HB3 H -9.574 -4.018 -3.219 1.00 . A A . 9 LYS HB3 1 1
13 2877 1 1 9 LYS HD2 H -9.421 -4.408 -5.626 1.00 . A A . 9 LYS HD2 1 1
13 2878 1 1 9 LYS HD3 H -7.961 -3.956 -6.507 1.00 . A A . 9 LYS HD3 1 1
13 2879 1 1 9 LYS HE2 H -6.705 -5.689 -5.354 1.00 . A A . 9 LYS HE2 1 1
13 2880 1 1 9 LYS HE3 H -8.129 -6.113 -4.403 1.00 . A A . 9 LYS HE3 1 1
13 2881 1 1 9 LYS HG2 H -8.342 -2.425 -4.660 1.00 . A A . 9 LYS HG2 1 1
13 2882 1 1 9 LYS HG3 H -6.875 -3.367 -4.382 1.00 . A A . 9 LYS HG3 1 1
13 2883 1 1 9 LYS HZ1 H -9.250 -6.662 -6.528 1.00 . A A . 9 LYS HZ1 1 1
13 2884 1 1 9 LYS HZ2 H -7.927 -7.658 -6.186 1.00 . A A . 9 LYS HZ2 1 1
13 2885 1 1 9 LYS HZ3 H -7.782 -6.424 -7.334 1.00 . A A . 9 LYS HZ3 1 1
13 2886 1 1 9 LYS N N -6.871 -2.431 -2.001 1.00 . A A . 9 LYS N 1 1
13 2887 1 1 9 LYS NZ N -8.215 -6.688 -6.426 1.00 . A A . 9 LYS NZ 1 1
13 2888 1 1 9 LYS O O -7.653 -4.038 0.066 1.00 . A A . 9 LYS O 1 1
13 2889 1 1 10 ARG C C -9.769 -5.695 1.056 1.00 . A A . 10 ARG C 1 1
13 2890 1 1 10 ARG CA C -10.265 -4.254 0.966 1.00 . A A . 10 ARG CA 1 1
13 2891 1 1 10 ARG CB C -11.790 -4.221 1.082 1.00 . A A . 10 ARG CB 1 1
13 2892 1 1 10 ARG CD C -11.825 -4.249 3.596 1.00 . A A . 10 ARG CD 1 1
13 2893 1 1 10 ARG CG C -12.322 -4.919 2.323 1.00 . A A . 10 ARG CG 1 1
13 2894 1 1 10 ARG CZ C -13.722 -2.822 4.234 1.00 . A A . 10 ARG CZ 1 1
13 2895 1 1 10 ARG H H -10.514 -3.250 -0.880 1.00 . A A . 10 ARG H 1 1
13 2896 1 1 10 ARG HA H -9.838 -3.687 1.780 1.00 . A A . 10 ARG HA 1 1
13 2897 1 1 10 ARG HB2 H -12.115 -3.191 1.109 1.00 . A A . 10 ARG HB2 1 1
13 2898 1 1 10 ARG HB3 H -12.216 -4.703 0.215 1.00 . A A . 10 ARG HB3 1 1
13 2899 1 1 10 ARG HD2 H -12.036 -4.896 4.434 1.00 . A A . 10 ARG HD2 1 1
13 2900 1 1 10 ARG HD3 H -10.758 -4.102 3.515 1.00 . A A . 10 ARG HD3 1 1
13 2901 1 1 10 ARG HE H -11.936 -2.150 3.654 1.00 . A A . 10 ARG HE 1 1
13 2902 1 1 10 ARG HG2 H -13.401 -4.884 2.310 1.00 . A A . 10 ARG HG2 1 1
13 2903 1 1 10 ARG HG3 H -11.993 -5.946 2.316 1.00 . A A . 10 ARG HG3 1 1
13 2904 1 1 10 ARG HH11 H -14.080 -4.808 4.333 1.00 . A A . 10 ARG HH11 1 1
13 2905 1 1 10 ARG HH12 H -15.409 -3.790 4.780 1.00 . A A . 10 ARG HH12 1 1
13 2906 1 1 10 ARG HH21 H -13.678 -0.801 4.242 1.00 . A A . 10 ARG HH21 1 1
13 2907 1 1 10 ARG HH22 H -15.179 -1.512 4.728 1.00 . A A . 10 ARG HH22 1 1
13 2908 1 1 10 ARG N N -9.839 -3.635 -0.283 1.00 . A A . 10 ARG N 1 1
13 2909 1 1 10 ARG NE N -12.466 -2.957 3.821 1.00 . A A . 10 ARG NE 1 1
13 2910 1 1 10 ARG NH1 N -14.465 -3.895 4.468 1.00 . A A . 10 ARG NH1 1 1
13 2911 1 1 10 ARG NH2 N -14.236 -1.612 4.416 1.00 . A A . 10 ARG NH2 1 1
13 2912 1 1 10 ARG O O -9.369 -6.159 2.124 1.00 . A A . 10 ARG O 1 1
13 2913 1 1 11 HIS C C -7.860 -7.885 0.181 1.00 . A A . 11 HIS C 1 1
13 2914 1 1 11 HIS CA C -9.352 -7.784 -0.120 1.00 . A A . 11 HIS CA 1 1
13 2915 1 1 11 HIS CB C -9.648 -8.389 -1.493 1.00 . A A . 11 HIS CB 1 1
13 2916 1 1 11 HIS CD2 C -12.198 -8.032 -1.177 1.00 . A A . 11 HIS CD2 1 1
13 2917 1 1 11 HIS CE1 C -12.909 -9.424 -2.715 1.00 . A A . 11 HIS CE1 1 1
13 2918 1 1 11 HIS CG C -11.109 -8.591 -1.756 1.00 . A A . 11 HIS CG 1 1
13 2919 1 1 11 HIS H H -10.128 -5.972 -0.890 1.00 . A A . 11 HIS H 1 1
13 2920 1 1 11 HIS HA H -9.896 -8.334 0.631 1.00 . A A . 11 HIS HA 1 1
13 2921 1 1 11 HIS HB2 H -9.261 -7.735 -2.259 1.00 . A A . 11 HIS HB2 1 1
13 2922 1 1 11 HIS HB3 H -9.161 -9.352 -1.568 1.00 . A A . 11 HIS HB3 1 1
13 2923 1 1 11 HIS HD1 H -11.042 -10.016 -3.306 1.00 . A A . 11 HIS HD1 1 1
13 2924 1 1 11 HIS HD2 H -12.197 -7.301 -0.381 1.00 . A A . 11 HIS HD2 1 1
13 2925 1 1 11 HIS HE1 H -13.557 -9.998 -3.360 1.00 . A A . 11 HIS HE1 1 1
13 2926 1 1 11 HIS N N -9.799 -6.396 -0.072 1.00 . A A . 11 HIS N 1 1
13 2927 1 1 11 HIS ND1 N -11.588 -9.459 -2.714 1.00 . A A . 11 HIS ND1 1 1
13 2928 1 1 11 HIS NE2 N -13.304 -8.566 -1.791 1.00 . A A . 11 HIS NE2 1 1
13 2929 1 1 11 HIS O O -7.354 -8.957 0.512 1.00 . A A . 11 HIS O 1 1
13 2930 1 1 12 GLY C C -4.909 -6.668 -0.945 1.00 . A A . 12 GLY C 1 1
13 2931 1 1 12 GLY CA C -5.731 -6.745 0.327 1.00 . A A . 12 GLY CA 1 1
13 2932 1 1 12 GLY H H -7.615 -5.936 -0.204 1.00 . A A . 12 GLY H 1 1
13 2933 1 1 12 GLY HA2 H -5.500 -5.891 0.945 1.00 . A A . 12 GLY HA2 1 1
13 2934 1 1 12 GLY HA3 H -5.466 -7.646 0.859 1.00 . A A . 12 GLY HA3 1 1
13 2935 1 1 12 GLY N N -7.159 -6.760 0.064 1.00 . A A . 12 GLY N 1 1
13 2936 1 1 12 GLY O O -3.729 -6.321 -0.909 1.00 . A A . 12 GLY O 1 1
13 2937 1 1 13 GLY C C -4.638 -5.543 -3.855 1.00 . A A . 13 GLY C 1 1
13 2938 1 1 13 GLY CA C -4.834 -6.957 -3.344 1.00 . A A . 13 GLY CA 1 1
13 2939 1 1 13 GLY H H -6.474 -7.265 -2.040 1.00 . A A . 13 GLY H 1 1
13 2940 1 1 13 GLY HA2 H -3.868 -7.423 -3.225 1.00 . A A . 13 GLY HA2 1 1
13 2941 1 1 13 GLY HA3 H -5.406 -7.514 -4.072 1.00 . A A . 13 GLY HA3 1 1
13 2942 1 1 13 GLY N N -5.533 -6.995 -2.072 1.00 . A A . 13 GLY N 1 1
13 2943 1 1 13 GLY O O -4.846 -4.575 -3.122 1.00 . A A . 13 GLY O 1 1
13 2944 1 1 14 CYS C C -4.834 -3.959 -6.996 1.00 . A A . 14 CYS C 1 1
13 2945 1 1 14 CYS CA C -4.006 -4.116 -5.724 1.00 . A A . 14 CYS CA 1 1
13 2946 1 1 14 CYS CB C -2.521 -3.930 -6.041 1.00 . A A . 14 CYS CB 1 1
13 2947 1 1 14 CYS H H -4.085 -6.231 -5.650 1.00 . A A . 14 CYS H 1 1
13 2948 1 1 14 CYS HA H -4.312 -3.362 -5.015 1.00 . A A . 14 CYS HA 1 1
13 2949 1 1 14 CYS HB2 H -2.254 -4.573 -6.867 1.00 . A A . 14 CYS HB2 1 1
13 2950 1 1 14 CYS HB3 H -2.347 -2.903 -6.320 1.00 . A A . 14 CYS HB3 1 1
13 2951 1 1 14 CYS N N -4.234 -5.422 -5.115 1.00 . A A . 14 CYS N 1 1
13 2952 1 1 14 CYS O O -4.888 -4.863 -7.830 1.00 . A A . 14 CYS O 1 1
13 2953 1 1 14 CYS SG S -1.410 -4.326 -4.653 1.00 . A A . 14 CYS SG 1 1
13 2954 1 1 15 SER C C -5.480 -1.866 -9.410 1.00 . A A . 15 SER C 1 1
13 2955 1 1 15 SER CA C -6.302 -2.527 -8.307 1.00 . A A . 15 SER CA 1 1
13 2956 1 1 15 SER CB C -7.479 -1.629 -7.925 1.00 . A A . 15 SER CB 1 1
13 2957 1 1 15 SER H H -5.392 -2.121 -6.439 1.00 . A A . 15 SER H 1 1
13 2958 1 1 15 SER HA H -6.682 -3.469 -8.674 1.00 . A A . 15 SER HA 1 1
13 2959 1 1 15 SER HB2 H -7.967 -2.032 -7.050 1.00 . A A . 15 SER HB2 1 1
13 2960 1 1 15 SER HB3 H -7.115 -0.635 -7.708 1.00 . A A . 15 SER HB3 1 1
13 2961 1 1 15 SER HG H -8.881 -0.707 -8.935 1.00 . A A . 15 SER HG 1 1
13 2962 1 1 15 SER N N -5.475 -2.803 -7.139 1.00 . A A . 15 SER N 1 1
13 2963 1 1 15 SER O O -4.760 -0.896 -9.167 1.00 . A A . 15 SER O 1 1
13 2964 1 1 15 SER OG O -8.424 -1.550 -8.978 1.00 . A A . 15 SER OG 1 1
13 2965 1 1 16 CYS C C -5.759 -1.781 -12.997 1.00 . A A . 16 CYS C 1 1
13 2966 1 1 16 CYS CA C -4.862 -1.860 -11.765 1.00 . A A . 16 CYS CA 1 1
13 2967 1 1 16 CYS CB C -3.638 -2.727 -12.065 1.00 . A A . 16 CYS CB 1 1
13 2968 1 1 16 CYS H H -6.184 -3.169 -10.754 1.00 . A A . 16 CYS H 1 1
13 2969 1 1 16 CYS HA H -4.534 -0.864 -11.510 1.00 . A A . 16 CYS HA 1 1
13 2970 1 1 16 CYS HB2 H -3.967 -3.669 -12.479 1.00 . A A . 16 CYS HB2 1 1
13 2971 1 1 16 CYS HB3 H -3.017 -2.219 -12.788 1.00 . A A . 16 CYS HB3 1 1
13 2972 1 1 16 CYS N N -5.594 -2.396 -10.623 1.00 . A A . 16 CYS N 1 1
13 2973 1 1 16 CYS O O -6.609 -2.645 -13.215 1.00 . A A . 16 CYS O 1 1
13 2974 1 1 16 CYS SG S -2.609 -3.091 -10.607 1.00 . A A . 16 CYS SG 1 1
13 2975 1 1 17 NH2 HN1 H -6.105 -0.611 -14.630 1.00 . A A . 17 NH2 HN1 1 1
13 2976 1 1 17 NH2 HN2 H -4.870 -0.085 -13.572 1.00 . A A . 17 NH2 HN2 1 1
13 2977 1 1 17 NH2 N N -5.563 -0.741 -13.800 1.00 . A A . 17 NH2 N 1 1
14 2978 1 1 1 TRP C C 1.308 -1.054 -2.226 1.00 . A A . 1 TRP C 1 1
14 2979 1 1 1 TRP CA C 1.607 0.146 -1.332 1.00 . A A . 1 TRP CA 1 1
14 2980 1 1 1 TRP CB C 3.076 0.125 -0.905 1.00 . A A . 1 TRP CB 1 1
14 2981 1 1 1 TRP CD1 C 4.686 1.349 -2.479 1.00 . A A . 1 TRP CD1 1 1
14 2982 1 1 1 TRP CD2 C 4.433 -0.829 -2.933 1.00 . A A . 1 TRP CD2 1 1
14 2983 1 1 1 TRP CE2 C 5.336 -0.278 -3.863 1.00 . A A . 1 TRP CE2 1 1
14 2984 1 1 1 TRP CE3 C 4.120 -2.188 -3.022 1.00 . A A . 1 TRP CE3 1 1
14 2985 1 1 1 TRP CG C 4.030 0.229 -2.056 1.00 . A A . 1 TRP CG 1 1
14 2986 1 1 1 TRP CH2 C 5.602 -2.367 -4.932 1.00 . A A . 1 TRP CH2 1 1
14 2987 1 1 1 TRP CZ2 C 5.925 -1.040 -4.868 1.00 . A A . 1 TRP CZ2 1 1
14 2988 1 1 1 TRP CZ3 C 4.706 -2.943 -4.020 1.00 . A A . 1 TRP CZ3 1 1
14 2989 1 1 1 TRP H1 H 1.112 0.412 0.710 1.00 . A A . 1 TRP H1 1 1
14 2990 1 1 1 TRP HA H 1.415 1.052 -1.888 1.00 . A A . 1 TRP HA 1 1
14 2991 1 1 1 TRP HB2 H 3.263 0.956 -0.242 1.00 . A A . 1 TRP HB2 1 1
14 2992 1 1 1 TRP HB3 H 3.279 -0.799 -0.384 1.00 . A A . 1 TRP HB3 1 1
14 2993 1 1 1 TRP HD1 H 4.590 2.321 -2.018 1.00 . A A . 1 TRP HD1 1 1
14 2994 1 1 1 TRP HE1 H 6.042 1.689 -4.047 1.00 . A A . 1 TRP HE1 1 1
14 2995 1 1 1 TRP HE3 H 3.432 -2.650 -2.329 1.00 . A A . 1 TRP HE3 1 1
14 2996 1 1 1 TRP HH2 H 6.036 -2.995 -5.695 1.00 . A A . 1 TRP HH2 1 1
14 2997 1 1 1 TRP HZ2 H 6.618 -0.611 -5.578 1.00 . A A . 1 TRP HZ2 1 1
14 2998 1 1 1 TRP HZ3 H 4.476 -3.995 -4.105 1.00 . A A . 1 TRP HZ3 1 1
14 2999 1 1 1 TRP N N 0.740 0.150 -0.159 1.00 . A A . 1 TRP N 1 1
14 3000 1 1 1 TRP NE1 N 5.473 1.051 -3.566 1.00 . A A . 1 TRP NE1 1 1
14 3001 1 1 1 TRP O O 1.102 -2.166 -1.740 1.00 . A A . 1 TRP O 1 1
14 3002 1 1 2 CYS C C 1.940 -1.773 -5.702 1.00 . A A . 2 CYS C 1 1
14 3003 1 1 2 CYS CA C 1.013 -1.879 -4.496 1.00 . A A . 2 CYS CA 1 1
14 3004 1 1 2 CYS CB C -0.446 -1.817 -4.954 1.00 . A A . 2 CYS CB 1 1
14 3005 1 1 2 CYS H H 1.459 0.090 -3.860 1.00 . A A . 2 CYS H 1 1
14 3006 1 1 2 CYS HA H 1.186 -2.826 -4.005 1.00 . A A . 2 CYS HA 1 1
14 3007 1 1 2 CYS HB2 H -0.795 -0.797 -4.879 1.00 . A A . 2 CYS HB2 1 1
14 3008 1 1 2 CYS HB3 H -0.507 -2.138 -5.983 1.00 . A A . 2 CYS HB3 1 1
14 3009 1 1 2 CYS N N 1.286 -0.820 -3.534 1.00 . A A . 2 CYS N 1 1
14 3010 1 1 2 CYS O O 2.555 -0.733 -5.935 1.00 . A A . 2 CYS O 1 1
14 3011 1 1 2 CYS SG S -1.578 -2.861 -3.979 1.00 . A A . 2 CYS SG 1 1
14 3012 1 1 3 ALA C C 2.557 -1.730 -8.590 1.00 . A A . 3 ALA C 1 1
14 3013 1 1 3 ALA CA C 2.887 -2.884 -7.649 1.00 . A A . 3 ALA CA 1 1
14 3014 1 1 3 ALA CB C 2.742 -4.215 -8.372 1.00 . A A . 3 ALA CB 1 1
14 3015 1 1 3 ALA H H 1.521 -3.655 -6.228 1.00 . A A . 3 ALA H 1 1
14 3016 1 1 3 ALA HA H 3.914 -2.788 -7.324 1.00 . A A . 3 ALA HA 1 1
14 3017 1 1 3 ALA HB1 H 2.938 -5.022 -7.680 1.00 . A A . 3 ALA HB1 1 1
14 3018 1 1 3 ALA HB2 H 1.738 -4.307 -8.758 1.00 . A A . 3 ALA HB2 1 1
14 3019 1 1 3 ALA HB3 H 3.448 -4.260 -9.187 1.00 . A A . 3 ALA HB3 1 1
14 3020 1 1 3 ALA N N 2.036 -2.857 -6.465 1.00 . A A . 3 ALA N 1 1
14 3021 1 1 3 ALA O O 1.394 -1.359 -8.747 1.00 . A A . 3 ALA O 1 1
14 3022 1 1 4 SER C C 2.621 1.078 -9.473 1.00 . A A . 4 SER C 1 1
14 3023 1 1 4 SER CA C 3.406 -0.051 -10.135 1.00 . A A . 4 SER CA 1 1
14 3024 1 1 4 SER CB C 2.682 -0.519 -11.399 1.00 . A A . 4 SER CB 1 1
14 3025 1 1 4 SER H H 4.491 -1.507 -9.045 1.00 . A A . 4 SER H 1 1
14 3026 1 1 4 SER HA H 4.385 0.316 -10.406 1.00 . A A . 4 SER HA 1 1
14 3027 1 1 4 SER HB2 H 2.951 -1.544 -11.605 1.00 . A A . 4 SER HB2 1 1
14 3028 1 1 4 SER HB3 H 1.615 -0.451 -11.245 1.00 . A A . 4 SER HB3 1 1
14 3029 1 1 4 SER HG H 3.605 -0.223 -13.100 1.00 . A A . 4 SER HG 1 1
14 3030 1 1 4 SER N N 3.587 -1.167 -9.212 1.00 . A A . 4 SER N 1 1
14 3031 1 1 4 SER O O 1.861 1.788 -10.131 1.00 . A A . 4 SER O 1 1
14 3032 1 1 4 SER OG O 3.035 0.280 -12.514 1.00 . A A . 4 SER OG 1 1
14 3033 1 1 5 GLY C C 0.610 2.128 -7.502 1.00 . A A . 5 GLY C 1 1
14 3034 1 1 5 GLY CA C 2.117 2.282 -7.439 1.00 . A A . 5 GLY CA 1 1
14 3035 1 1 5 GLY H H 3.432 0.642 -7.695 1.00 . A A . 5 GLY H 1 1
14 3036 1 1 5 GLY HA2 H 2.427 2.253 -6.405 1.00 . A A . 5 GLY HA2 1 1
14 3037 1 1 5 GLY HA3 H 2.387 3.240 -7.859 1.00 . A A . 5 GLY HA3 1 1
14 3038 1 1 5 GLY N N 2.813 1.238 -8.168 1.00 . A A . 5 GLY N 1 1
14 3039 1 1 5 GLY O O -0.130 3.083 -7.264 1.00 . A A . 5 GLY O 1 1
14 3040 1 1 6 CYS C C -1.986 0.993 -6.619 1.00 . A A . 6 CYS C 1 1
14 3041 1 1 6 CYS CA C -1.275 0.647 -7.924 1.00 . A A . 6 CYS CA 1 1
14 3042 1 1 6 CYS CB C -1.509 -0.824 -8.272 1.00 . A A . 6 CYS CB 1 1
14 3043 1 1 6 CYS H H 0.793 0.201 -8.006 1.00 . A A . 6 CYS H 1 1
14 3044 1 1 6 CYS HA H -1.679 1.263 -8.713 1.00 . A A . 6 CYS HA 1 1
14 3045 1 1 6 CYS HB2 H -0.717 -1.418 -7.836 1.00 . A A . 6 CYS HB2 1 1
14 3046 1 1 6 CYS HB3 H -2.456 -1.138 -7.858 1.00 . A A . 6 CYS HB3 1 1
14 3047 1 1 6 CYS N N 0.154 0.923 -7.827 1.00 . A A . 6 CYS N 1 1
14 3048 1 1 6 CYS O O -1.352 1.389 -5.641 1.00 . A A . 6 CYS O 1 1
14 3049 1 1 6 CYS SG S -1.542 -1.170 -10.059 1.00 . A A . 6 CYS SG 1 1
14 3050 1 1 7 ARG C C -4.453 -0.144 -4.673 1.00 . A A . 7 ARG C 1 1
14 3051 1 1 7 ARG CA C -4.103 1.136 -5.428 1.00 . A A . 7 ARG CA 1 1
14 3052 1 1 7 ARG CB C -5.384 1.873 -5.821 1.00 . A A . 7 ARG CB 1 1
14 3053 1 1 7 ARG CD C -6.484 4.125 -5.631 1.00 . A A . 7 ARG CD 1 1
14 3054 1 1 7 ARG CG C -5.202 3.376 -5.961 1.00 . A A . 7 ARG CG 1 1
14 3055 1 1 7 ARG CZ C -7.531 5.093 -3.628 1.00 . A A . 7 ARG CZ 1 1
14 3056 1 1 7 ARG H H -3.754 0.520 -7.423 1.00 . A A . 7 ARG H 1 1
14 3057 1 1 7 ARG HA H -3.515 1.771 -4.783 1.00 . A A . 7 ARG HA 1 1
14 3058 1 1 7 ARG HB2 H -5.733 1.487 -6.768 1.00 . A A . 7 ARG HB2 1 1
14 3059 1 1 7 ARG HB3 H -6.135 1.692 -5.068 1.00 . A A . 7 ARG HB3 1 1
14 3060 1 1 7 ARG HD2 H -6.414 5.126 -6.033 1.00 . A A . 7 ARG HD2 1 1
14 3061 1 1 7 ARG HD3 H -7.314 3.610 -6.091 1.00 . A A . 7 ARG HD3 1 1
14 3062 1 1 7 ARG HE H -6.238 3.574 -3.619 1.00 . A A . 7 ARG HE 1 1
14 3063 1 1 7 ARG HG2 H -4.426 3.700 -5.284 1.00 . A A . 7 ARG HG2 1 1
14 3064 1 1 7 ARG HG3 H -4.915 3.602 -6.977 1.00 . A A . 7 ARG HG3 1 1
14 3065 1 1 7 ARG HH11 H -8.074 5.956 -5.372 1.00 . A A . 7 ARG HH11 1 1
14 3066 1 1 7 ARG HH12 H -8.805 6.628 -3.952 1.00 . A A . 7 ARG HH12 1 1
14 3067 1 1 7 ARG HH21 H -7.193 4.451 -1.741 1.00 . A A . 7 ARG HH21 1 1
14 3068 1 1 7 ARG HH22 H -8.302 5.771 -1.888 1.00 . A A . 7 ARG HH22 1 1
14 3069 1 1 7 ARG N N -3.306 0.839 -6.612 1.00 . A A . 7 ARG N 1 1
14 3070 1 1 7 ARG NE N -6.715 4.208 -4.192 1.00 . A A . 7 ARG NE 1 1
14 3071 1 1 7 ARG NH1 N -8.189 5.964 -4.379 1.00 . A A . 7 ARG NH1 1 1
14 3072 1 1 7 ARG NH2 N -7.688 5.105 -2.311 1.00 . A A . 7 ARG NH2 1 1
14 3073 1 1 7 ARG O O -4.586 -1.214 -5.270 1.00 . A A . 7 ARG O 1 1
14 3074 1 1 8 LYS C C -6.439 -1.417 -2.509 1.00 . A A . 8 LYS C 1 1
14 3075 1 1 8 LYS CA C -4.934 -1.174 -2.521 1.00 . A A . 8 LYS CA 1 1
14 3076 1 1 8 LYS CB C -4.431 -0.951 -1.093 1.00 . A A . 8 LYS CB 1 1
14 3077 1 1 8 LYS CD C -3.296 -3.105 -0.471 1.00 . A A . 8 LYS CD 1 1
14 3078 1 1 8 LYS CE C -1.963 -3.833 -0.382 1.00 . A A . 8 LYS CE 1 1
14 3079 1 1 8 LYS CG C -3.105 -1.634 -0.802 1.00 . A A . 8 LYS CG 1 1
14 3080 1 1 8 LYS H H -4.481 0.851 -2.941 1.00 . A A . 8 LYS H 1 1
14 3081 1 1 8 LYS HA H -4.444 -2.042 -2.935 1.00 . A A . 8 LYS HA 1 1
14 3082 1 1 8 LYS HB2 H -4.310 0.108 -0.927 1.00 . A A . 8 LYS HB2 1 1
14 3083 1 1 8 LYS HB3 H -5.168 -1.334 -0.400 1.00 . A A . 8 LYS HB3 1 1
14 3084 1 1 8 LYS HD2 H -3.804 -3.189 0.478 1.00 . A A . 8 LYS HD2 1 1
14 3085 1 1 8 LYS HD3 H -3.896 -3.564 -1.245 1.00 . A A . 8 LYS HD3 1 1
14 3086 1 1 8 LYS HE2 H -2.138 -4.832 -0.011 1.00 . A A . 8 LYS HE2 1 1
14 3087 1 1 8 LYS HE3 H -1.531 -3.888 -1.371 1.00 . A A . 8 LYS HE3 1 1
14 3088 1 1 8 LYS HG2 H -2.470 -1.551 -1.670 1.00 . A A . 8 LYS HG2 1 1
14 3089 1 1 8 LYS HG3 H -2.635 -1.144 0.039 1.00 . A A . 8 LYS HG3 1 1
14 3090 1 1 8 LYS HZ1 H -1.505 -2.812 1.381 1.00 . A A . 8 LYS HZ1 1 1
14 3091 1 1 8 LYS HZ2 H -0.596 -2.313 0.045 1.00 . A A . 8 LYS HZ2 1 1
14 3092 1 1 8 LYS HZ3 H -0.246 -3.784 0.805 1.00 . A A . 8 LYS HZ3 1 1
14 3093 1 1 8 LYS N N -4.599 -0.028 -3.358 1.00 . A A . 8 LYS N 1 1
14 3094 1 1 8 LYS NZ N -1.011 -3.138 0.526 1.00 . A A . 8 LYS NZ 1 1
14 3095 1 1 8 LYS O O -7.222 -0.559 -2.916 1.00 . A A . 8 LYS O 1 1
14 3096 1 1 9 LYS C C -8.589 -3.581 -0.622 1.00 . A A . 9 LYS C 1 1
14 3097 1 1 9 LYS CA C -8.252 -2.951 -1.969 1.00 . A A . 9 LYS CA 1 1
14 3098 1 1 9 LYS CB C -8.611 -3.916 -3.100 1.00 . A A . 9 LYS CB 1 1
14 3099 1 1 9 LYS CD C -8.546 -4.417 -5.561 1.00 . A A . 9 LYS CD 1 1
14 3100 1 1 9 LYS CE C -7.961 -5.815 -5.450 1.00 . A A . 9 LYS CE 1 1
14 3101 1 1 9 LYS CG C -8.042 -3.512 -4.449 1.00 . A A . 9 LYS CG 1 1
14 3102 1 1 9 LYS H H -6.168 -3.238 -1.727 1.00 . A A . 9 LYS H 1 1
14 3103 1 1 9 LYS HA H -8.828 -2.045 -2.083 1.00 . A A . 9 LYS HA 1 1
14 3104 1 1 9 LYS HB2 H -8.231 -4.897 -2.853 1.00 . A A . 9 LYS HB2 1 1
14 3105 1 1 9 LYS HB3 H -9.686 -3.967 -3.187 1.00 . A A . 9 LYS HB3 1 1
14 3106 1 1 9 LYS HD2 H -9.622 -4.482 -5.499 1.00 . A A . 9 LYS HD2 1 1
14 3107 1 1 9 LYS HD3 H -8.263 -3.992 -6.514 1.00 . A A . 9 LYS HD3 1 1
14 3108 1 1 9 LYS HE2 H -6.935 -5.791 -5.785 1.00 . A A . 9 LYS HE2 1 1
14 3109 1 1 9 LYS HE3 H -7.993 -6.124 -4.414 1.00 . A A . 9 LYS HE3 1 1
14 3110 1 1 9 LYS HG2 H -8.339 -2.496 -4.664 1.00 . A A . 9 LYS HG2 1 1
14 3111 1 1 9 LYS HG3 H -6.964 -3.573 -4.408 1.00 . A A . 9 LYS HG3 1 1
14 3112 1 1 9 LYS HZ1 H -9.737 -6.710 -6.089 1.00 . A A . 9 LYS HZ1 1 1
14 3113 1 1 9 LYS HZ2 H -8.418 -7.767 -6.035 1.00 . A A . 9 LYS HZ2 1 1
14 3114 1 1 9 LYS HZ3 H -8.540 -6.632 -7.283 1.00 . A A . 9 LYS HZ3 1 1
14 3115 1 1 9 LYS N N -6.840 -2.593 -2.037 1.00 . A A . 9 LYS N 1 1
14 3116 1 1 9 LYS NZ N -8.717 -6.800 -6.272 1.00 . A A . 9 LYS NZ 1 1
14 3117 1 1 9 LYS O O -7.702 -4.039 0.099 1.00 . A A . 9 LYS O 1 1
14 3118 1 1 10 ARG C C -9.866 -5.624 1.108 1.00 . A A . 10 ARG C 1 1
14 3119 1 1 10 ARG CA C -10.329 -4.176 0.972 1.00 . A A . 10 ARG CA 1 1
14 3120 1 1 10 ARG CB C -11.854 -4.106 1.070 1.00 . A A . 10 ARG CB 1 1
14 3121 1 1 10 ARG CD C -13.861 -2.600 1.214 1.00 . A A . 10 ARG CD 1 1
14 3122 1 1 10 ARG CG C -12.422 -2.735 0.741 1.00 . A A . 10 ARG CG 1 1
14 3123 1 1 10 ARG CZ C -15.361 -0.798 1.952 1.00 . A A . 10 ARG CZ 1 1
14 3124 1 1 10 ARG H H -10.536 -3.220 -0.905 1.00 . A A . 10 ARG H 1 1
14 3125 1 1 10 ARG HA H -9.898 -3.597 1.776 1.00 . A A . 10 ARG HA 1 1
14 3126 1 1 10 ARG HB2 H -12.281 -4.823 0.385 1.00 . A A . 10 ARG HB2 1 1
14 3127 1 1 10 ARG HB3 H -12.149 -4.361 2.077 1.00 . A A . 10 ARG HB3 1 1
14 3128 1 1 10 ARG HD2 H -14.504 -3.125 0.524 1.00 . A A . 10 ARG HD2 1 1
14 3129 1 1 10 ARG HD3 H -13.946 -3.046 2.195 1.00 . A A . 10 ARG HD3 1 1
14 3130 1 1 10 ARG HE H -13.738 -0.540 0.821 1.00 . A A . 10 ARG HE 1 1
14 3131 1 1 10 ARG HG2 H -11.823 -1.980 1.228 1.00 . A A . 10 ARG HG2 1 1
14 3132 1 1 10 ARG HG3 H -12.389 -2.590 -0.329 1.00 . A A . 10 ARG HG3 1 1
14 3133 1 1 10 ARG HH11 H -15.879 -2.647 2.581 1.00 . A A . 10 ARG HH11 1 1
14 3134 1 1 10 ARG HH12 H -16.929 -1.366 3.094 1.00 . A A . 10 ARG HH12 1 1
14 3135 1 1 10 ARG HH21 H -15.112 1.154 1.490 1.00 . A A . 10 ARG HH21 1 1
14 3136 1 1 10 ARG HH22 H -16.491 0.794 2.473 1.00 . A A . 10 ARG HH22 1 1
14 3137 1 1 10 ARG N N -9.875 -3.602 -0.288 1.00 . A A . 10 ARG N 1 1
14 3138 1 1 10 ARG NE N -14.284 -1.205 1.289 1.00 . A A . 10 ARG NE 1 1
14 3139 1 1 10 ARG NH1 N -16.119 -1.675 2.595 1.00 . A A . 10 ARG NH1 1 1
14 3140 1 1 10 ARG NH2 N -15.681 0.490 1.974 1.00 . A A . 10 ARG NH2 1 1
14 3141 1 1 10 ARG O O -9.536 -6.082 2.202 1.00 . A A . 10 ARG O 1 1
14 3142 1 1 11 HIS C C -7.932 -7.855 0.285 1.00 . A A . 11 HIS C 1 1
14 3143 1 1 11 HIS CA C -9.423 -7.737 -0.019 1.00 . A A . 11 HIS CA 1 1
14 3144 1 1 11 HIS CB C -9.732 -8.378 -1.372 1.00 . A A . 11 HIS CB 1 1
14 3145 1 1 11 HIS CD2 C -11.928 -7.209 -2.105 1.00 . A A . 11 HIS CD2 1 1
14 3146 1 1 11 HIS CE1 C -13.214 -8.981 -2.212 1.00 . A A . 11 HIS CE1 1 1
14 3147 1 1 11 HIS CG C -11.174 -8.281 -1.766 1.00 . A A . 11 HIS CG 1 1
14 3148 1 1 11 HIS H H -10.119 -5.919 -0.854 1.00 . A A . 11 HIS H 1 1
14 3149 1 1 11 HIS HA H -9.976 -8.254 0.750 1.00 . A A . 11 HIS HA 1 1
14 3150 1 1 11 HIS HB2 H -9.146 -7.890 -2.137 1.00 . A A . 11 HIS HB2 1 1
14 3151 1 1 11 HIS HB3 H -9.467 -9.425 -1.336 1.00 . A A . 11 HIS HB3 1 1
14 3152 1 1 11 HIS HD1 H -11.755 -10.303 -1.654 1.00 . A A . 11 HIS HD1 1 1
14 3153 1 1 11 HIS HD2 H -11.598 -6.181 -2.153 1.00 . A A . 11 HIS HD2 1 1
14 3154 1 1 11 HIS HE1 H -14.072 -9.621 -2.354 1.00 . A A . 11 HIS HE1 1 1
14 3155 1 1 11 HIS N N -9.845 -6.340 -0.012 1.00 . A A . 11 HIS N 1 1
14 3156 1 1 11 HIS ND1 N -12.009 -9.375 -1.841 1.00 . A A . 11 HIS ND1 1 1
14 3157 1 1 11 HIS NE2 N -13.192 -7.671 -2.378 1.00 . A A . 11 HIS NE2 1 1
14 3158 1 1 11 HIS O O -7.444 -8.926 0.642 1.00 . A A . 11 HIS O 1 1
14 3159 1 1 12 GLY C C -4.963 -6.715 -0.871 1.00 . A A . 12 GLY C 1 1
14 3160 1 1 12 GLY CA C -5.785 -6.747 0.402 1.00 . A A . 12 GLY CA 1 1
14 3161 1 1 12 GLY H H -7.656 -5.919 -0.148 1.00 . A A . 12 GLY H 1 1
14 3162 1 1 12 GLY HA2 H -5.539 -5.882 0.999 1.00 . A A . 12 GLY HA2 1 1
14 3163 1 1 12 GLY HA3 H -5.535 -7.639 0.956 1.00 . A A . 12 GLY HA3 1 1
14 3164 1 1 12 GLY N N -7.213 -6.745 0.139 1.00 . A A . 12 GLY N 1 1
14 3165 1 1 12 GLY O O -3.777 -6.390 -0.843 1.00 . A A . 12 GLY O 1 1
14 3166 1 1 13 GLY C C -4.744 -5.668 -3.846 1.00 . A A . 13 GLY C 1 1
14 3167 1 1 13 GLY CA C -4.896 -7.059 -3.263 1.00 . A A . 13 GLY CA 1 1
14 3168 1 1 13 GLY H H -6.541 -7.305 -1.952 1.00 . A A . 13 GLY H 1 1
14 3169 1 1 13 GLY HA2 H -3.916 -7.488 -3.123 1.00 . A A . 13 GLY HA2 1 1
14 3170 1 1 13 GLY HA3 H -5.449 -7.670 -3.962 1.00 . A A . 13 GLY HA3 1 1
14 3171 1 1 13 GLY N N -5.593 -7.055 -1.991 1.00 . A A . 13 GLY N 1 1
14 3172 1 1 13 GLY O O -4.983 -4.671 -3.163 1.00 . A A . 13 GLY O 1 1
14 3173 1 1 14 CYS C C -5.152 -4.157 -6.930 1.00 . A A . 14 CYS C 1 1
14 3174 1 1 14 CYS CA C -4.157 -4.318 -5.785 1.00 . A A . 14 CYS CA 1 1
14 3175 1 1 14 CYS CB C -2.727 -4.202 -6.317 1.00 . A A . 14 CYS CB 1 1
14 3176 1 1 14 CYS H H -4.168 -6.428 -5.604 1.00 . A A . 14 CYS H 1 1
14 3177 1 1 14 CYS HA H -4.328 -3.535 -5.063 1.00 . A A . 14 CYS HA 1 1
14 3178 1 1 14 CYS HB2 H -2.616 -4.855 -7.171 1.00 . A A . 14 CYS HB2 1 1
14 3179 1 1 14 CYS HB3 H -2.548 -3.183 -6.623 1.00 . A A . 14 CYS HB3 1 1
14 3180 1 1 14 CYS N N -4.343 -5.597 -5.110 1.00 . A A . 14 CYS N 1 1
14 3181 1 1 14 CYS O O -5.588 -5.139 -7.531 1.00 . A A . 14 CYS O 1 1
14 3182 1 1 14 CYS SG S -1.444 -4.652 -5.105 1.00 . A A . 14 CYS SG 1 1
14 3183 1 1 15 SER C C -5.773 -1.868 -9.435 1.00 . A A . 15 SER C 1 1
14 3184 1 1 15 SER CA C -6.455 -2.620 -8.297 1.00 . A A . 15 SER CA 1 1
14 3185 1 1 15 SER CB C -7.629 -1.800 -7.759 1.00 . A A . 15 SER CB 1 1
14 3186 1 1 15 SER H H -5.127 -2.170 -6.710 1.00 . A A . 15 SER H 1 1
14 3187 1 1 15 SER HA H -6.827 -3.561 -8.675 1.00 . A A . 15 SER HA 1 1
14 3188 1 1 15 SER HB2 H -7.802 -2.058 -6.725 1.00 . A A . 15 SER HB2 1 1
14 3189 1 1 15 SER HB3 H -7.392 -0.748 -7.833 1.00 . A A . 15 SER HB3 1 1
14 3190 1 1 15 SER HG H -9.574 -1.950 -7.926 1.00 . A A . 15 SER HG 1 1
14 3191 1 1 15 SER N N -5.509 -2.912 -7.226 1.00 . A A . 15 SER N 1 1
14 3192 1 1 15 SER O O -5.747 -0.637 -9.455 1.00 . A A . 15 SER O 1 1
14 3193 1 1 15 SER OG O -8.810 -2.055 -8.499 1.00 . A A . 15 SER OG 1 1
14 3194 1 1 16 CYS C C -5.459 -1.965 -12.741 1.00 . A A . 16 CYS C 1 1
14 3195 1 1 16 CYS CA C -4.536 -2.025 -11.526 1.00 . A A . 16 CYS CA 1 1
14 3196 1 1 16 CYS CB C -3.279 -2.826 -11.868 1.00 . A A . 16 CYS CB 1 1
14 3197 1 1 16 CYS H H -5.273 -3.594 -10.312 1.00 . A A . 16 CYS H 1 1
14 3198 1 1 16 CYS HA H -4.250 -1.020 -11.257 1.00 . A A . 16 CYS HA 1 1
14 3199 1 1 16 CYS HB2 H -3.570 -3.800 -12.234 1.00 . A A . 16 CYS HB2 1 1
14 3200 1 1 16 CYS HB3 H -2.729 -2.307 -12.638 1.00 . A A . 16 CYS HB3 1 1
14 3201 1 1 16 CYS N N -5.220 -2.618 -10.384 1.00 . A A . 16 CYS N 1 1
14 3202 1 1 16 CYS O O -6.593 -2.441 -12.696 1.00 . A A . 16 CYS O 1 1
14 3203 1 1 16 CYS SG S -2.155 -3.083 -10.457 1.00 . A A . 16 CYS SG 1 1
14 3204 1 1 17 NH2 HN1 H -5.500 -1.291 -14.665 1.00 . A A . 17 NH2 HN1 1 1
14 3205 1 1 17 NH2 HN2 H -4.054 -1.012 -13.798 1.00 . A A . 17 NH2 HN2 1 1
14 3206 1 1 17 NH2 N N -4.965 -1.374 -13.823 1.00 . A A . 17 NH2 N 1 1
15 3207 1 1 1 TRP C C 1.397 -0.943 -2.301 1.00 . A A . 1 TRP C 1 1
15 3208 1 1 1 TRP CA C 1.687 0.285 -1.444 1.00 . A A . 1 TRP CA 1 1
15 3209 1 1 1 TRP CB C 3.179 0.352 -1.116 1.00 . A A . 1 TRP CB 1 1
15 3210 1 1 1 TRP CD1 C 4.636 1.551 -2.852 1.00 . A A . 1 TRP CD1 1 1
15 3211 1 1 1 TRP CD2 C 4.436 -0.655 -3.183 1.00 . A A . 1 TRP CD2 1 1
15 3212 1 1 1 TRP CE2 C 5.255 -0.120 -4.197 1.00 . A A . 1 TRP CE2 1 1
15 3213 1 1 1 TRP CE3 C 4.171 -2.027 -3.186 1.00 . A A . 1 TRP CE3 1 1
15 3214 1 1 1 TRP CG C 4.052 0.431 -2.333 1.00 . A A . 1 TRP CG 1 1
15 3215 1 1 1 TRP CH2 C 5.531 -2.251 -5.180 1.00 . A A . 1 TRP CH2 1 1
15 3216 1 1 1 TRP CZ2 C 5.807 -0.911 -5.202 1.00 . A A . 1 TRP CZ2 1 1
15 3217 1 1 1 TRP CZ3 C 4.719 -2.811 -4.184 1.00 . A A . 1 TRP CZ3 1 1
15 3218 1 1 1 TRP H1 H 1.341 0.034 0.630 1.00 . A A . 1 TRP H1 1 1
15 3219 1 1 1 TRP HA H 1.409 1.170 -1.997 1.00 . A A . 1 TRP HA 1 1
15 3220 1 1 1 TRP HB2 H 3.370 1.227 -0.512 1.00 . A A . 1 TRP HB2 1 1
15 3221 1 1 1 TRP HB3 H 3.458 -0.532 -0.561 1.00 . A A . 1 TRP HB3 1 1
15 3222 1 1 1 TRP HD1 H 4.533 2.539 -2.432 1.00 . A A . 1 TRP HD1 1 1
15 3223 1 1 1 TRP HE1 H 5.871 1.858 -4.523 1.00 . A A . 1 TRP HE1 1 1
15 3224 1 1 1 TRP HE3 H 3.548 -2.477 -2.426 1.00 . A A . 1 TRP HE3 1 1
15 3225 1 1 1 TRP HH2 H 5.938 -2.900 -5.939 1.00 . A A . 1 TRP HH2 1 1
15 3226 1 1 1 TRP HZ2 H 6.435 -0.495 -5.977 1.00 . A A . 1 TRP HZ2 1 1
15 3227 1 1 1 TRP HZ3 H 4.525 -3.872 -4.202 1.00 . A A . 1 TRP HZ3 1 1
15 3228 1 1 1 TRP N N 0.901 0.260 -0.216 1.00 . A A . 1 TRP N 1 1
15 3229 1 1 1 TRP NE1 N 5.360 1.226 -3.974 1.00 . A A . 1 TRP NE1 1 1
15 3230 1 1 1 TRP O O 1.251 -2.052 -1.785 1.00 . A A . 1 TRP O 1 1
15 3231 1 1 2 CYS C C 1.942 -1.735 -5.769 1.00 . A A . 2 CYS C 1 1
15 3232 1 1 2 CYS CA C 1.042 -1.828 -4.540 1.00 . A A . 2 CYS CA 1 1
15 3233 1 1 2 CYS CB C -0.428 -1.806 -4.967 1.00 . A A . 2 CYS CB 1 1
15 3234 1 1 2 CYS H H 1.440 0.168 -3.963 1.00 . A A . 2 CYS H 1 1
15 3235 1 1 2 CYS HA H 1.245 -2.758 -4.030 1.00 . A A . 2 CYS HA 1 1
15 3236 1 1 2 CYS HB2 H -0.794 -0.792 -4.917 1.00 . A A . 2 CYS HB2 1 1
15 3237 1 1 2 CYS HB3 H -0.504 -2.162 -5.984 1.00 . A A . 2 CYS HB3 1 1
15 3238 1 1 2 CYS N N 1.314 -0.739 -3.612 1.00 . A A . 2 CYS N 1 1
15 3239 1 1 2 CYS O O 2.526 -0.687 -6.044 1.00 . A A . 2 CYS O 1 1
15 3240 1 1 2 CYS SG S -1.517 -2.839 -3.935 1.00 . A A . 2 CYS SG 1 1
15 3241 1 1 3 ALA C C 2.534 -1.729 -8.645 1.00 . A A . 3 ALA C 1 1
15 3242 1 1 3 ALA CA C 2.874 -2.879 -7.703 1.00 . A A . 3 ALA CA 1 1
15 3243 1 1 3 ALA CB C 2.705 -4.214 -8.414 1.00 . A A . 3 ALA CB 1 1
15 3244 1 1 3 ALA H H 1.557 -3.641 -6.233 1.00 . A A . 3 ALA H 1 1
15 3245 1 1 3 ALA HA H 3.908 -2.788 -7.400 1.00 . A A . 3 ALA HA 1 1
15 3246 1 1 3 ALA HB1 H 3.307 -4.221 -9.312 1.00 . A A . 3 ALA HB1 1 1
15 3247 1 1 3 ALA HB2 H 3.023 -5.012 -7.760 1.00 . A A . 3 ALA HB2 1 1
15 3248 1 1 3 ALA HB3 H 1.667 -4.353 -8.674 1.00 . A A . 3 ALA HB3 1 1
15 3249 1 1 3 ALA N N 2.048 -2.837 -6.503 1.00 . A A . 3 ALA N 1 1
15 3250 1 1 3 ALA O O 1.367 -1.371 -8.806 1.00 . A A . 3 ALA O 1 1
15 3251 1 1 4 SER C C 2.594 1.092 -9.519 1.00 . A A . 4 SER C 1 1
15 3252 1 1 4 SER CA C 3.368 -0.040 -10.186 1.00 . A A . 4 SER CA 1 1
15 3253 1 1 4 SER CB C 2.628 -0.510 -11.440 1.00 . A A . 4 SER CB 1 1
15 3254 1 1 4 SER H H 4.466 -1.484 -9.094 1.00 . A A . 4 SER H 1 1
15 3255 1 1 4 SER HA H 4.344 0.326 -10.471 1.00 . A A . 4 SER HA 1 1
15 3256 1 1 4 SER HB2 H 2.988 -1.489 -11.721 1.00 . A A . 4 SER HB2 1 1
15 3257 1 1 4 SER HB3 H 1.570 -0.562 -11.231 1.00 . A A . 4 SER HB3 1 1
15 3258 1 1 4 SER HG H 2.108 0.312 -13.141 1.00 . A A . 4 SER HG 1 1
15 3259 1 1 4 SER N N 3.559 -1.153 -9.264 1.00 . A A . 4 SER N 1 1
15 3260 1 1 4 SER O O 1.826 1.802 -10.168 1.00 . A A . 4 SER O 1 1
15 3261 1 1 4 SER OG O 2.838 0.381 -12.521 1.00 . A A . 4 SER OG 1 1
15 3262 1 1 5 GLY C C 0.606 2.142 -7.516 1.00 . A A . 5 GLY C 1 1
15 3263 1 1 5 GLY CA C 2.114 2.300 -7.480 1.00 . A A . 5 GLY CA 1 1
15 3264 1 1 5 GLY H H 3.422 0.657 -7.749 1.00 . A A . 5 GLY H 1 1
15 3265 1 1 5 GLY HA2 H 2.442 2.277 -6.452 1.00 . A A . 5 GLY HA2 1 1
15 3266 1 1 5 GLY HA3 H 2.373 3.256 -7.910 1.00 . A A . 5 GLY HA3 1 1
15 3267 1 1 5 GLY N N 2.799 1.253 -8.215 1.00 . A A . 5 GLY N 1 1
15 3268 1 1 5 GLY O O -0.132 3.095 -7.270 1.00 . A A . 5 GLY O 1 1
15 3269 1 1 6 CYS C C -1.971 1.001 -6.583 1.00 . A A . 6 CYS C 1 1
15 3270 1 1 6 CYS CA C -1.283 0.654 -7.899 1.00 . A A . 6 CYS CA 1 1
15 3271 1 1 6 CYS CB C -1.518 -0.819 -8.238 1.00 . A A . 6 CYS CB 1 1
15 3272 1 1 6 CYS H H 0.785 0.214 -8.015 1.00 . A A . 6 CYS H 1 1
15 3273 1 1 6 CYS HA H -1.702 1.266 -8.683 1.00 . A A . 6 CYS HA 1 1
15 3274 1 1 6 CYS HB2 H -0.713 -1.409 -7.825 1.00 . A A . 6 CYS HB2 1 1
15 3275 1 1 6 CYS HB3 H -2.452 -1.136 -7.799 1.00 . A A . 6 CYS HB3 1 1
15 3276 1 1 6 CYS N N 0.147 0.935 -7.828 1.00 . A A . 6 CYS N 1 1
15 3277 1 1 6 CYS O O -1.320 1.401 -5.616 1.00 . A A . 6 CYS O 1 1
15 3278 1 1 6 CYS SG S -1.598 -1.168 -10.024 1.00 . A A . 6 CYS SG 1 1
15 3279 1 1 7 ARG C C -4.445 -0.142 -4.620 1.00 . A A . 7 ARG C 1 1
15 3280 1 1 7 ARG CA C -4.067 1.141 -5.354 1.00 . A A . 7 ARG CA 1 1
15 3281 1 1 7 ARG CB C -5.329 1.923 -5.720 1.00 . A A . 7 ARG CB 1 1
15 3282 1 1 7 ARG CD C -5.112 4.086 -4.461 1.00 . A A . 7 ARG CD 1 1
15 3283 1 1 7 ARG CG C -5.107 3.423 -5.829 1.00 . A A . 7 ARG CG 1 1
15 3284 1 1 7 ARG CZ C -6.628 4.314 -2.539 1.00 . A A . 7 ARG CZ 1 1
15 3285 1 1 7 ARG H H -3.753 0.521 -7.353 1.00 . A A . 7 ARG H 1 1
15 3286 1 1 7 ARG HA H -3.455 1.747 -4.704 1.00 . A A . 7 ARG HA 1 1
15 3287 1 1 7 ARG HB2 H -5.697 1.566 -6.672 1.00 . A A . 7 ARG HB2 1 1
15 3288 1 1 7 ARG HB3 H -6.080 1.746 -4.966 1.00 . A A . 7 ARG HB3 1 1
15 3289 1 1 7 ARG HD2 H -4.371 3.605 -3.840 1.00 . A A . 7 ARG HD2 1 1
15 3290 1 1 7 ARG HD3 H -4.858 5.129 -4.581 1.00 . A A . 7 ARG HD3 1 1
15 3291 1 1 7 ARG HE H -7.167 3.661 -4.345 1.00 . A A . 7 ARG HE 1 1
15 3292 1 1 7 ARG HG2 H -4.152 3.603 -6.301 1.00 . A A . 7 ARG HG2 1 1
15 3293 1 1 7 ARG HG3 H -5.895 3.852 -6.431 1.00 . A A . 7 ARG HG3 1 1
15 3294 1 1 7 ARG HH11 H -4.713 4.849 -2.180 1.00 . A A . 7 ARG HH11 1 1
15 3295 1 1 7 ARG HH12 H -5.793 5.004 -0.833 1.00 . A A . 7 ARG HH12 1 1
15 3296 1 1 7 ARG HH21 H -8.598 3.861 -2.580 1.00 . A A . 7 ARG HH21 1 1
15 3297 1 1 7 ARG HH22 H -8.002 4.442 -1.061 1.00 . A A . 7 ARG HH22 1 1
15 3298 1 1 7 ARG N N -3.290 0.844 -6.552 1.00 . A A . 7 ARG N 1 1
15 3299 1 1 7 ARG NE N -6.415 3.987 -3.809 1.00 . A A . 7 ARG NE 1 1
15 3300 1 1 7 ARG NH1 N -5.629 4.758 -1.788 1.00 . A A . 7 ARG NH1 1 1
15 3301 1 1 7 ARG NH2 N -7.843 4.196 -2.017 1.00 . A A . 7 ARG NH2 1 1
15 3302 1 1 7 ARG O O -4.645 -1.189 -5.237 1.00 . A A . 7 ARG O 1 1
15 3303 1 1 8 LYS C C -6.405 -1.440 -2.492 1.00 . A A . 8 LYS C 1 1
15 3304 1 1 8 LYS CA C -4.899 -1.205 -2.478 1.00 . A A . 8 LYS CA 1 1
15 3305 1 1 8 LYS CB C -4.418 -1.000 -1.039 1.00 . A A . 8 LYS CB 1 1
15 3306 1 1 8 LYS CD C -3.277 -3.145 -0.398 1.00 . A A . 8 LYS CD 1 1
15 3307 1 1 8 LYS CE C -1.962 -3.797 -0.001 1.00 . A A . 8 LYS CE 1 1
15 3308 1 1 8 LYS CG C -3.091 -1.676 -0.739 1.00 . A A . 8 LYS CG 1 1
15 3309 1 1 8 LYS H H -4.373 0.809 -2.863 1.00 . A A . 8 LYS H 1 1
15 3310 1 1 8 LYS HA H -4.408 -2.072 -2.892 1.00 . A A . 8 LYS HA 1 1
15 3311 1 1 8 LYS HB2 H -4.308 0.058 -0.856 1.00 . A A . 8 LYS HB2 1 1
15 3312 1 1 8 LYS HB3 H -5.162 -1.399 -0.363 1.00 . A A . 8 LYS HB3 1 1
15 3313 1 1 8 LYS HD2 H -3.971 -3.230 0.425 1.00 . A A . 8 LYS HD2 1 1
15 3314 1 1 8 LYS HD3 H -3.676 -3.658 -1.262 1.00 . A A . 8 LYS HD3 1 1
15 3315 1 1 8 LYS HE2 H -2.113 -4.862 0.080 1.00 . A A . 8 LYS HE2 1 1
15 3316 1 1 8 LYS HE3 H -1.229 -3.594 -0.768 1.00 . A A . 8 LYS HE3 1 1
15 3317 1 1 8 LYS HG2 H -2.453 -1.597 -1.606 1.00 . A A . 8 LYS HG2 1 1
15 3318 1 1 8 LYS HG3 H -2.625 -1.177 0.100 1.00 . A A . 8 LYS HG3 1 1
15 3319 1 1 8 LYS HZ1 H -2.012 -2.449 1.594 1.00 . A A . 8 LYS HZ1 1 1
15 3320 1 1 8 LYS HZ2 H -0.459 -2.999 1.211 1.00 . A A . 8 LYS HZ2 1 1
15 3321 1 1 8 LYS HZ3 H -1.536 -4.012 2.032 1.00 . A A . 8 LYS HZ3 1 1
15 3322 1 1 8 LYS N N -4.543 -0.053 -3.297 1.00 . A A . 8 LYS N 1 1
15 3323 1 1 8 LYS NZ N -1.457 -3.279 1.300 1.00 . A A . 8 LYS NZ 1 1
15 3324 1 1 8 LYS O O -7.174 -0.581 -2.926 1.00 . A A . 8 LYS O 1 1
15 3325 1 1 9 LYS C C -8.602 -3.585 -0.630 1.00 . A A . 9 LYS C 1 1
15 3326 1 1 9 LYS CA C -8.239 -2.955 -1.970 1.00 . A A . 9 LYS CA 1 1
15 3327 1 1 9 LYS CB C -8.584 -3.916 -3.109 1.00 . A A . 9 LYS CB 1 1
15 3328 1 1 9 LYS CD C -8.471 -4.423 -5.567 1.00 . A A . 9 LYS CD 1 1
15 3329 1 1 9 LYS CE C -7.921 -5.832 -5.409 1.00 . A A . 9 LYS CE 1 1
15 3330 1 1 9 LYS CG C -7.995 -3.511 -4.449 1.00 . A A . 9 LYS CG 1 1
15 3331 1 1 9 LYS H H -6.162 -3.251 -1.683 1.00 . A A . 9 LYS H 1 1
15 3332 1 1 9 LYS HA H -8.807 -2.045 -2.093 1.00 . A A . 9 LYS HA 1 1
15 3333 1 1 9 LYS HB2 H -8.213 -4.900 -2.859 1.00 . A A . 9 LYS HB2 1 1
15 3334 1 1 9 LYS HB3 H -9.659 -3.962 -3.211 1.00 . A A . 9 LYS HB3 1 1
15 3335 1 1 9 LYS HD2 H -9.550 -4.466 -5.550 1.00 . A A . 9 LYS HD2 1 1
15 3336 1 1 9 LYS HD3 H -8.139 -4.021 -6.513 1.00 . A A . 9 LYS HD3 1 1
15 3337 1 1 9 LYS HE2 H -7.859 -6.293 -6.382 1.00 . A A . 9 LYS HE2 1 1
15 3338 1 1 9 LYS HE3 H -6.933 -5.772 -4.976 1.00 . A A . 9 LYS HE3 1 1
15 3339 1 1 9 LYS HG2 H -8.297 -2.498 -4.673 1.00 . A A . 9 LYS HG2 1 1
15 3340 1 1 9 LYS HG3 H -6.918 -3.562 -4.388 1.00 . A A . 9 LYS HG3 1 1
15 3341 1 1 9 LYS HZ1 H -9.542 -6.089 -4.117 1.00 . A A . 9 LYS HZ1 1 1
15 3342 1 1 9 LYS HZ2 H -8.219 -7.079 -3.760 1.00 . A A . 9 LYS HZ2 1 1
15 3343 1 1 9 LYS HZ3 H -9.212 -7.441 -5.080 1.00 . A A . 9 LYS HZ3 1 1
15 3344 1 1 9 LYS N N -6.823 -2.607 -2.015 1.00 . A A . 9 LYS N 1 1
15 3345 1 1 9 LYS NZ N -8.784 -6.669 -4.530 1.00 . A A . 9 LYS NZ 1 1
15 3346 1 1 9 LYS O O -7.731 -4.054 0.103 1.00 . A A . 9 LYS O 1 1
15 3347 1 1 10 ARG C C -9.935 -5.622 1.069 1.00 . A A . 10 ARG C 1 1
15 3348 1 1 10 ARG CA C -10.372 -4.166 0.936 1.00 . A A . 10 ARG CA 1 1
15 3349 1 1 10 ARG CB C -11.897 -4.071 1.016 1.00 . A A . 10 ARG CB 1 1
15 3350 1 1 10 ARG CD C -13.826 -3.969 2.624 1.00 . A A . 10 ARG CD 1 1
15 3351 1 1 10 ARG CG C -12.471 -4.593 2.322 1.00 . A A . 10 ARG CG 1 1
15 3352 1 1 10 ARG CZ C -15.370 -5.744 1.910 1.00 . A A . 10 ARG CZ 1 1
15 3353 1 1 10 ARG H H -10.540 -3.204 -0.941 1.00 . A A . 10 ARG H 1 1
15 3354 1 1 10 ARG HA H -9.942 -3.598 1.748 1.00 . A A . 10 ARG HA 1 1
15 3355 1 1 10 ARG HB2 H -12.187 -3.036 0.909 1.00 . A A . 10 ARG HB2 1 1
15 3356 1 1 10 ARG HB3 H -12.324 -4.642 0.206 1.00 . A A . 10 ARG HB3 1 1
15 3357 1 1 10 ARG HD2 H -13.734 -3.347 3.501 1.00 . A A . 10 ARG HD2 1 1
15 3358 1 1 10 ARG HD3 H -14.123 -3.362 1.781 1.00 . A A . 10 ARG HD3 1 1
15 3359 1 1 10 ARG HE H -15.169 -5.094 3.784 1.00 . A A . 10 ARG HE 1 1
15 3360 1 1 10 ARG HG2 H -12.589 -5.663 2.251 1.00 . A A . 10 ARG HG2 1 1
15 3361 1 1 10 ARG HG3 H -11.790 -4.356 3.126 1.00 . A A . 10 ARG HG3 1 1
15 3362 1 1 10 ARG HH11 H -14.259 -4.938 0.428 1.00 . A A . 10 ARG HH11 1 1
15 3363 1 1 10 ARG HH12 H -15.352 -6.190 -0.062 1.00 . A A . 10 ARG HH12 1 1
15 3364 1 1 10 ARG HH21 H -16.613 -6.744 3.152 1.00 . A A . 10 ARG HH21 1 1
15 3365 1 1 10 ARG HH22 H -16.691 -7.215 1.488 1.00 . A A . 10 ARG HH22 1 1
15 3366 1 1 10 ARG N N -9.893 -3.593 -0.316 1.00 . A A . 10 ARG N 1 1
15 3367 1 1 10 ARG NE N -14.852 -4.980 2.865 1.00 . A A . 10 ARG NE 1 1
15 3368 1 1 10 ARG NH1 N -14.961 -5.612 0.655 1.00 . A A . 10 ARG NH1 1 1
15 3369 1 1 10 ARG NH2 N -16.301 -6.641 2.207 1.00 . A A . 10 ARG NH2 1 1
15 3370 1 1 10 ARG O O -9.661 -6.101 2.171 1.00 . A A . 10 ARG O 1 1
15 3371 1 1 11 HIS C C -7.987 -7.865 0.264 1.00 . A A . 11 HIS C 1 1
15 3372 1 1 11 HIS CA C -9.470 -7.723 -0.069 1.00 . A A . 11 HIS CA 1 1
15 3373 1 1 11 HIS CB C -9.761 -8.351 -1.432 1.00 . A A . 11 HIS CB 1 1
15 3374 1 1 11 HIS CD2 C -12.283 -7.746 -1.428 1.00 . A A . 11 HIS CD2 1 1
15 3375 1 1 11 HIS CE1 C -13.044 -9.540 -2.435 1.00 . A A . 11 HIS CE1 1 1
15 3376 1 1 11 HIS CG C -11.221 -8.540 -1.705 1.00 . A A . 11 HIS CG 1 1
15 3377 1 1 11 HIS H H -10.103 -5.885 -0.905 1.00 . A A . 11 HIS H 1 1
15 3378 1 1 11 HIS HA H -10.045 -8.239 0.685 1.00 . A A . 11 HIS HA 1 1
15 3379 1 1 11 HIS HB2 H -9.359 -7.715 -2.207 1.00 . A A . 11 HIS HB2 1 1
15 3380 1 1 11 HIS HB3 H -9.286 -9.320 -1.484 1.00 . A A . 11 HIS HB3 1 1
15 3381 1 1 11 HIS HD1 H -11.210 -10.417 -2.659 1.00 . A A . 11 HIS HD1 1 1
15 3382 1 1 11 HIS HD2 H -12.255 -6.785 -0.936 1.00 . A A . 11 HIS HD2 1 1
15 3383 1 1 11 HIS HE1 H -13.709 -10.262 -2.883 1.00 . A A . 11 HIS HE1 1 1
15 3384 1 1 11 HIS N N -9.873 -6.322 -0.059 1.00 . A A . 11 HIS N 1 1
15 3385 1 1 11 HIS ND1 N -11.732 -9.655 -2.334 1.00 . A A . 11 HIS ND1 1 1
15 3386 1 1 11 HIS NE2 N -13.404 -8.390 -1.893 1.00 . A A . 11 HIS NE2 1 1
15 3387 1 1 11 HIS O O -7.520 -8.947 0.616 1.00 . A A . 11 HIS O 1 1
15 3388 1 1 12 GLY C C -4.982 -6.748 -0.818 1.00 . A A . 12 GLY C 1 1
15 3389 1 1 12 GLY CA C -5.830 -6.786 0.437 1.00 . A A . 12 GLY CA 1 1
15 3390 1 1 12 GLY H H -7.678 -5.928 -0.139 1.00 . A A . 12 GLY H 1 1
15 3391 1 1 12 GLY HA2 H -5.586 -5.931 1.051 1.00 . A A . 12 GLY HA2 1 1
15 3392 1 1 12 GLY HA3 H -5.601 -7.688 0.985 1.00 . A A . 12 GLY HA3 1 1
15 3393 1 1 12 GLY N N -7.252 -6.763 0.147 1.00 . A A . 12 GLY N 1 1
15 3394 1 1 12 GLY O O -3.793 -6.437 -0.764 1.00 . A A . 12 GLY O 1 1
15 3395 1 1 13 GLY C C -4.729 -5.672 -3.797 1.00 . A A . 13 GLY C 1 1
15 3396 1 1 13 GLY CA C -4.871 -7.064 -3.213 1.00 . A A . 13 GLY CA 1 1
15 3397 1 1 13 GLY H H -6.544 -7.308 -1.938 1.00 . A A . 13 GLY H 1 1
15 3398 1 1 13 GLY HA2 H -3.887 -7.478 -3.051 1.00 . A A . 13 GLY HA2 1 1
15 3399 1 1 13 GLY HA3 H -5.400 -7.687 -3.920 1.00 . A A . 13 GLY HA3 1 1
15 3400 1 1 13 GLY N N -5.593 -7.067 -1.954 1.00 . A A . 13 GLY N 1 1
15 3401 1 1 13 GLY O O -4.998 -4.678 -3.123 1.00 . A A . 13 GLY O 1 1
15 3402 1 1 14 CYS C C -5.123 -4.167 -6.875 1.00 . A A . 14 CYS C 1 1
15 3403 1 1 14 CYS CA C -4.126 -4.322 -5.729 1.00 . A A . 14 CYS CA 1 1
15 3404 1 1 14 CYS CB C -2.697 -4.197 -6.262 1.00 . A A . 14 CYS CB 1 1
15 3405 1 1 14 CYS H H -4.107 -6.429 -5.541 1.00 . A A . 14 CYS H 1 1
15 3406 1 1 14 CYS HA H -4.302 -3.538 -5.009 1.00 . A A . 14 CYS HA 1 1
15 3407 1 1 14 CYS HB2 H -2.582 -4.849 -7.115 1.00 . A A . 14 CYS HB2 1 1
15 3408 1 1 14 CYS HB3 H -2.523 -3.176 -6.569 1.00 . A A . 14 CYS HB3 1 1
15 3409 1 1 14 CYS N N -4.306 -5.601 -5.055 1.00 . A A . 14 CYS N 1 1
15 3410 1 1 14 CYS O O -5.603 -5.154 -7.431 1.00 . A A . 14 CYS O 1 1
15 3411 1 1 14 CYS SG S -1.412 -4.639 -5.049 1.00 . A A . 14 CYS SG 1 1
15 3412 1 1 15 SER C C -5.679 -1.896 -9.442 1.00 . A A . 15 SER C 1 1
15 3413 1 1 15 SER CA C -6.369 -2.635 -8.299 1.00 . A A . 15 SER CA 1 1
15 3414 1 1 15 SER CB C -7.541 -1.804 -7.773 1.00 . A A . 15 SER CB 1 1
15 3415 1 1 15 SER H H -5.011 -2.174 -6.741 1.00 . A A . 15 SER H 1 1
15 3416 1 1 15 SER HA H -6.744 -3.578 -8.669 1.00 . A A . 15 SER HA 1 1
15 3417 1 1 15 SER HB2 H -7.740 -2.075 -6.747 1.00 . A A . 15 SER HB2 1 1
15 3418 1 1 15 SER HB3 H -7.287 -0.755 -7.825 1.00 . A A . 15 SER HB3 1 1
15 3419 1 1 15 SER HG H -9.229 -2.731 -8.137 1.00 . A A . 15 SER HG 1 1
15 3420 1 1 15 SER N N -5.427 -2.920 -7.223 1.00 . A A . 15 SER N 1 1
15 3421 1 1 15 SER O O -5.554 -0.671 -9.419 1.00 . A A . 15 SER O 1 1
15 3422 1 1 15 SER OG O -8.711 -2.031 -8.540 1.00 . A A . 15 SER OG 1 1
15 3423 1 1 16 CYS C C -5.475 -2.055 -12.815 1.00 . A A . 16 CYS C 1 1
15 3424 1 1 16 CYS CA C -4.557 -2.069 -11.595 1.00 . A A . 16 CYS CA 1 1
15 3425 1 1 16 CYS CB C -3.282 -2.853 -11.911 1.00 . A A . 16 CYS CB 1 1
15 3426 1 1 16 CYS H H -5.365 -3.621 -10.403 1.00 . A A . 16 CYS H 1 1
15 3427 1 1 16 CYS HA H -4.292 -1.053 -11.348 1.00 . A A . 16 CYS HA 1 1
15 3428 1 1 16 CYS HB2 H -3.552 -3.821 -12.306 1.00 . A A . 16 CYS HB2 1 1
15 3429 1 1 16 CYS HB3 H -2.712 -2.315 -12.654 1.00 . A A . 16 CYS HB3 1 1
15 3430 1 1 16 CYS N N -5.235 -2.650 -10.442 1.00 . A A . 16 CYS N 1 1
15 3431 1 1 16 CYS O O -6.450 -2.802 -12.878 1.00 . A A . 16 CYS O 1 1
15 3432 1 1 16 CYS SG S -2.199 -3.125 -10.471 1.00 . A A . 16 CYS SG 1 1
15 3433 1 1 17 NH2 HN1 H -5.697 -1.126 -14.615 1.00 . A A . 17 NH2 HN1 1 1
15 3434 1 1 17 NH2 HN2 H -4.362 -0.632 -13.672 1.00 . A A . 17 NH2 HN2 1 1
15 3435 1 1 17 NH2 N N -5.153 -1.201 -13.780 1.00 . A A . 17 NH2 N 1 1
16 3436 1 1 1 TRP C C 1.689 -0.392 -2.218 1.00 . A A . 1 TRP C 1 1
16 3437 1 1 1 TRP CA C 1.979 0.937 -1.528 1.00 . A A . 1 TRP CA 1 1
16 3438 1 1 1 TRP CB C 3.471 1.044 -1.209 1.00 . A A . 1 TRP CB 1 1
16 3439 1 1 1 TRP CD1 C 4.918 2.070 -3.058 1.00 . A A . 1 TRP CD1 1 1
16 3440 1 1 1 TRP CD2 C 4.736 -0.159 -3.163 1.00 . A A . 1 TRP CD2 1 1
16 3441 1 1 1 TRP CE2 C 5.551 0.275 -4.226 1.00 . A A . 1 TRP CE2 1 1
16 3442 1 1 1 TRP CE3 C 4.481 -1.526 -3.025 1.00 . A A . 1 TRP CE3 1 1
16 3443 1 1 1 TRP CG C 4.343 1.005 -2.428 1.00 . A A . 1 TRP CG 1 1
16 3444 1 1 1 TRP CH2 C 5.843 -1.942 -4.986 1.00 . A A . 1 TRP CH2 1 1
16 3445 1 1 1 TRP CZ2 C 6.110 -0.609 -5.145 1.00 . A A . 1 TRP CZ2 1 1
16 3446 1 1 1 TRP CZ3 C 5.036 -2.403 -3.938 1.00 . A A . 1 TRP CZ3 1 1
16 3447 1 1 1 TRP H1 H 1.607 1.459 0.490 1.00 . A A . 1 TRP H1 1 1
16 3448 1 1 1 TRP HA H 1.702 1.742 -2.193 1.00 . A A . 1 TRP HA 1 1
16 3449 1 1 1 TRP HB2 H 3.656 1.977 -0.697 1.00 . A A . 1 TRP HB2 1 1
16 3450 1 1 1 TRP HB3 H 3.754 0.222 -0.569 1.00 . A A . 1 TRP HB3 1 1
16 3451 1 1 1 TRP HD1 H 4.808 3.097 -2.742 1.00 . A A . 1 TRP HD1 1 1
16 3452 1 1 1 TRP HE1 H 6.153 2.215 -4.752 1.00 . A A . 1 TRP HE1 1 1
16 3453 1 1 1 TRP HE3 H 3.861 -1.901 -2.223 1.00 . A A . 1 TRP HE3 1 1
16 3454 1 1 1 TRP HH2 H 6.255 -2.662 -5.676 1.00 . A A . 1 TRP HH2 1 1
16 3455 1 1 1 TRP HZ2 H 6.735 -0.270 -5.959 1.00 . A A . 1 TRP HZ2 1 1
16 3456 1 1 1 TRP HZ3 H 4.849 -3.463 -3.847 1.00 . A A . 1 TRP HZ3 1 1
16 3457 1 1 1 TRP N N 1.189 1.075 -0.310 1.00 . A A . 1 TRP N 1 1
16 3458 1 1 1 TRP NE1 N 5.647 1.640 -4.141 1.00 . A A . 1 TRP NE1 1 1
16 3459 1 1 1 TRP O O 1.492 -1.414 -1.560 1.00 . A A . 1 TRP O 1 1
16 3460 1 1 2 CYS C C 2.190 -1.565 -5.629 1.00 . A A . 2 CYS C 1 1
16 3461 1 1 2 CYS CA C 1.397 -1.575 -4.325 1.00 . A A . 2 CYS CA 1 1
16 3462 1 1 2 CYS CB C -0.099 -1.692 -4.627 1.00 . A A . 2 CYS CB 1 1
16 3463 1 1 2 CYS H H 1.828 0.474 -4.015 1.00 . A A . 2 CYS H 1 1
16 3464 1 1 2 CYS HA H 1.704 -2.426 -3.738 1.00 . A A . 2 CYS HA 1 1
16 3465 1 1 2 CYS HB2 H -0.528 -0.701 -4.667 1.00 . A A . 2 CYS HB2 1 1
16 3466 1 1 2 CYS HB3 H -0.229 -2.174 -5.583 1.00 . A A . 2 CYS HB3 1 1
16 3467 1 1 2 CYS N N 1.664 -0.371 -3.546 1.00 . A A . 2 CYS N 1 1
16 3468 1 1 2 CYS O O 2.730 -0.536 -6.031 1.00 . A A . 2 CYS O 1 1
16 3469 1 1 2 CYS SG S -1.034 -2.649 -3.390 1.00 . A A . 2 CYS SG 1 1
16 3470 1 1 3 ALA C C 2.496 -1.815 -8.558 1.00 . A A . 3 ALA C 1 1
16 3471 1 1 3 ALA CA C 2.979 -2.844 -7.542 1.00 . A A . 3 ALA CA 1 1
16 3472 1 1 3 ALA CB C 2.827 -4.251 -8.102 1.00 . A A . 3 ALA CB 1 1
16 3473 1 1 3 ALA H H 1.803 -3.506 -5.912 1.00 . A A . 3 ALA H 1 1
16 3474 1 1 3 ALA HA H 4.027 -2.674 -7.343 1.00 . A A . 3 ALA HA 1 1
16 3475 1 1 3 ALA HB1 H 3.480 -4.371 -8.954 1.00 . A A . 3 ALA HB1 1 1
16 3476 1 1 3 ALA HB2 H 3.092 -4.970 -7.341 1.00 . A A . 3 ALA HB2 1 1
16 3477 1 1 3 ALA HB3 H 1.804 -4.409 -8.407 1.00 . A A . 3 ALA HB3 1 1
16 3478 1 1 3 ALA N N 2.254 -2.720 -6.284 1.00 . A A . 3 ALA N 1 1
16 3479 1 1 3 ALA O O 1.300 -1.539 -8.656 1.00 . A A . 3 ALA O 1 1
16 3480 1 1 4 SER C C 2.282 0.887 -9.707 1.00 . A A . 4 SER C 1 1
16 3481 1 1 4 SER CA C 3.102 -0.245 -10.317 1.00 . A A . 4 SER CA 1 1
16 3482 1 1 4 SER CB C 2.329 -0.886 -11.472 1.00 . A A . 4 SER CB 1 1
16 3483 1 1 4 SER H H 4.369 -1.511 -9.186 1.00 . A A . 4 SER H 1 1
16 3484 1 1 4 SER HA H 4.028 0.161 -10.697 1.00 . A A . 4 SER HA 1 1
16 3485 1 1 4 SER HB2 H 2.692 -1.889 -11.633 1.00 . A A . 4 SER HB2 1 1
16 3486 1 1 4 SER HB3 H 1.278 -0.919 -11.223 1.00 . A A . 4 SER HB3 1 1
16 3487 1 1 4 SER HG H 1.649 -0.085 -13.126 1.00 . A A . 4 SER HG 1 1
16 3488 1 1 4 SER N N 3.432 -1.248 -9.312 1.00 . A A . 4 SER N 1 1
16 3489 1 1 4 SER O O 1.427 1.474 -10.367 1.00 . A A . 4 SER O 1 1
16 3490 1 1 4 SER OG O 2.492 -0.144 -12.668 1.00 . A A . 4 SER OG 1 1
16 3491 1 1 5 GLY C C 0.336 1.997 -7.717 1.00 . A A . 5 GLY C 1 1
16 3492 1 1 5 GLY CA C 1.831 2.247 -7.759 1.00 . A A . 5 GLY CA 1 1
16 3493 1 1 5 GLY H H 3.244 0.684 -7.962 1.00 . A A . 5 GLY H 1 1
16 3494 1 1 5 GLY HA2 H 2.200 2.327 -6.749 1.00 . A A . 5 GLY HA2 1 1
16 3495 1 1 5 GLY HA3 H 2.013 3.179 -8.275 1.00 . A A . 5 GLY HA3 1 1
16 3496 1 1 5 GLY N N 2.551 1.187 -8.439 1.00 . A A . 5 GLY N 1 1
16 3497 1 1 5 GLY O O -0.454 2.934 -7.591 1.00 . A A . 5 GLY O 1 1
16 3498 1 1 6 CYS C C -2.140 0.877 -6.532 1.00 . A A . 6 CYS C 1 1
16 3499 1 1 6 CYS CA C -1.464 0.360 -7.798 1.00 . A A . 6 CYS CA 1 1
16 3500 1 1 6 CYS CB C -1.615 -1.160 -7.886 1.00 . A A . 6 CYS CB 1 1
16 3501 1 1 6 CYS H H 0.623 0.028 -7.920 1.00 . A A . 6 CYS H 1 1
16 3502 1 1 6 CYS HA H -1.941 0.811 -8.655 1.00 . A A . 6 CYS HA 1 1
16 3503 1 1 6 CYS HB2 H -0.751 -1.626 -7.434 1.00 . A A . 6 CYS HB2 1 1
16 3504 1 1 6 CYS HB3 H -2.500 -1.458 -7.346 1.00 . A A . 6 CYS HB3 1 1
16 3505 1 1 6 CYS N N -0.054 0.731 -7.823 1.00 . A A . 6 CYS N 1 1
16 3506 1 1 6 CYS O O -1.492 1.463 -5.664 1.00 . A A . 6 CYS O 1 1
16 3507 1 1 6 CYS SG S -1.759 -1.796 -9.587 1.00 . A A . 6 CYS SG 1 1
16 3508 1 1 7 ARG C C -4.743 -0.093 -4.484 1.00 . A A . 7 ARG C 1 1
16 3509 1 1 7 ARG CA C -4.212 1.099 -5.273 1.00 . A A . 7 ARG CA 1 1
16 3510 1 1 7 ARG CB C -5.373 1.993 -5.713 1.00 . A A . 7 ARG CB 1 1
16 3511 1 1 7 ARG CD C -6.174 4.303 -6.289 1.00 . A A . 7 ARG CD 1 1
16 3512 1 1 7 ARG CG C -4.967 3.432 -5.978 1.00 . A A . 7 ARG CG 1 1
16 3513 1 1 7 ARG CZ C -6.852 5.234 -4.116 1.00 . A A . 7 ARG CZ 1 1
16 3514 1 1 7 ARG H H -3.908 0.183 -7.157 1.00 . A A . 7 ARG H 1 1
16 3515 1 1 7 ARG HA H -3.550 1.670 -4.638 1.00 . A A . 7 ARG HA 1 1
16 3516 1 1 7 ARG HB2 H -5.799 1.589 -6.620 1.00 . A A . 7 ARG HB2 1 1
16 3517 1 1 7 ARG HB3 H -6.125 1.990 -4.939 1.00 . A A . 7 ARG HB3 1 1
16 3518 1 1 7 ARG HD2 H -5.829 5.288 -6.566 1.00 . A A . 7 ARG HD2 1 1
16 3519 1 1 7 ARG HD3 H -6.714 3.865 -7.116 1.00 . A A . 7 ARG HD3 1 1
16 3520 1 1 7 ARG HE H -7.880 3.866 -5.142 1.00 . A A . 7 ARG HE 1 1
16 3521 1 1 7 ARG HG2 H -4.470 3.825 -5.103 1.00 . A A . 7 ARG HG2 1 1
16 3522 1 1 7 ARG HG3 H -4.290 3.457 -6.820 1.00 . A A . 7 ARG HG3 1 1
16 3523 1 1 7 ARG HH11 H -5.116 5.961 -4.848 1.00 . A A . 7 ARG HH11 1 1
16 3524 1 1 7 ARG HH12 H -5.605 6.609 -3.318 1.00 . A A . 7 ARG HH12 1 1
16 3525 1 1 7 ARG HH21 H -8.536 4.711 -3.127 1.00 . A A . 7 ARG HH21 1 1
16 3526 1 1 7 ARG HH22 H -7.551 5.896 -2.340 1.00 . A A . 7 ARG HH22 1 1
16 3527 1 1 7 ARG N N -3.447 0.655 -6.432 1.00 . A A . 7 ARG N 1 1
16 3528 1 1 7 ARG NE N -7.073 4.421 -5.144 1.00 . A A . 7 ARG NE 1 1
16 3529 1 1 7 ARG NH1 N -5.768 5.997 -4.092 1.00 . A A . 7 ARG NH1 1 1
16 3530 1 1 7 ARG NH2 N -7.718 5.285 -3.112 1.00 . A A . 7 ARG NH2 1 1
16 3531 1 1 7 ARG O O -5.541 -0.882 -4.991 1.00 . A A . 7 ARG O 1 1
16 3532 1 1 8 LYS C C -6.247 -1.390 -2.311 1.00 . A A . 8 LYS C 1 1
16 3533 1 1 8 LYS CA C -4.724 -1.316 -2.379 1.00 . A A . 8 LYS CA 1 1
16 3534 1 1 8 LYS CB C -4.149 -1.143 -0.971 1.00 . A A . 8 LYS CB 1 1
16 3535 1 1 8 LYS CD C -3.300 -2.463 0.989 1.00 . A A . 8 LYS CD 1 1
16 3536 1 1 8 LYS CE C -2.765 -3.822 1.414 1.00 . A A . 8 LYS CE 1 1
16 3537 1 1 8 LYS CG C -3.281 -2.305 -0.521 1.00 . A A . 8 LYS CG 1 1
16 3538 1 1 8 LYS H H -3.659 0.440 -2.892 1.00 . A A . 8 LYS H 1 1
16 3539 1 1 8 LYS HA H -4.350 -2.236 -2.801 1.00 . A A . 8 LYS HA 1 1
16 3540 1 1 8 LYS HB2 H -3.550 -0.244 -0.948 1.00 . A A . 8 LYS HB2 1 1
16 3541 1 1 8 LYS HB3 H -4.965 -1.039 -0.271 1.00 . A A . 8 LYS HB3 1 1
16 3542 1 1 8 LYS HD2 H -2.686 -1.693 1.431 1.00 . A A . 8 LYS HD2 1 1
16 3543 1 1 8 LYS HD3 H -4.318 -2.361 1.340 1.00 . A A . 8 LYS HD3 1 1
16 3544 1 1 8 LYS HE2 H -3.192 -4.579 0.775 1.00 . A A . 8 LYS HE2 1 1
16 3545 1 1 8 LYS HE3 H -1.691 -3.821 1.303 1.00 . A A . 8 LYS HE3 1 1
16 3546 1 1 8 LYS HG2 H -3.650 -3.214 -0.972 1.00 . A A . 8 LYS HG2 1 1
16 3547 1 1 8 LYS HG3 H -2.264 -2.129 -0.843 1.00 . A A . 8 LYS HG3 1 1
16 3548 1 1 8 LYS HZ1 H -3.983 -4.694 2.870 1.00 . A A . 8 LYS HZ1 1 1
16 3549 1 1 8 LYS HZ2 H -3.244 -3.255 3.367 1.00 . A A . 8 LYS HZ2 1 1
16 3550 1 1 8 LYS HZ3 H -2.339 -4.680 3.271 1.00 . A A . 8 LYS HZ3 1 1
16 3551 1 1 8 LYS N N -4.294 -0.221 -3.240 1.00 . A A . 8 LYS N 1 1
16 3552 1 1 8 LYS NZ N -3.106 -4.135 2.829 1.00 . A A . 8 LYS NZ 1 1
16 3553 1 1 8 LYS O O -6.938 -0.395 -2.535 1.00 . A A . 8 LYS O 1 1
16 3554 1 1 9 LYS C C -8.571 -3.419 -0.565 1.00 . A A . 9 LYS C 1 1
16 3555 1 1 9 LYS CA C -8.204 -2.776 -1.898 1.00 . A A . 9 LYS CA 1 1
16 3556 1 1 9 LYS CB C -8.698 -3.651 -3.052 1.00 . A A . 9 LYS CB 1 1
16 3557 1 1 9 LYS CD C -8.670 -4.137 -5.517 1.00 . A A . 9 LYS CD 1 1
16 3558 1 1 9 LYS CE C -8.213 -5.573 -5.304 1.00 . A A . 9 LYS CE 1 1
16 3559 1 1 9 LYS CG C -8.169 -3.224 -4.410 1.00 . A A . 9 LYS CG 1 1
16 3560 1 1 9 LYS H H -6.162 -3.328 -1.831 1.00 . A A . 9 LYS H 1 1
16 3561 1 1 9 LYS HA H -8.681 -1.810 -1.961 1.00 . A A . 9 LYS HA 1 1
16 3562 1 1 9 LYS HB2 H -8.389 -4.671 -2.873 1.00 . A A . 9 LYS HB2 1 1
16 3563 1 1 9 LYS HB3 H -9.778 -3.612 -3.082 1.00 . A A . 9 LYS HB3 1 1
16 3564 1 1 9 LYS HD2 H -9.749 -4.114 -5.530 1.00 . A A . 9 LYS HD2 1 1
16 3565 1 1 9 LYS HD3 H -8.287 -3.784 -6.464 1.00 . A A . 9 LYS HD3 1 1
16 3566 1 1 9 LYS HE2 H -7.140 -5.582 -5.189 1.00 . A A . 9 LYS HE2 1 1
16 3567 1 1 9 LYS HE3 H -8.675 -5.954 -4.404 1.00 . A A . 9 LYS HE3 1 1
16 3568 1 1 9 LYS HG2 H -8.497 -2.216 -4.613 1.00 . A A . 9 LYS HG2 1 1
16 3569 1 1 9 LYS HG3 H -7.088 -3.255 -4.391 1.00 . A A . 9 LYS HG3 1 1
16 3570 1 1 9 LYS HZ1 H -7.745 -6.940 -6.811 1.00 . A A . 9 LYS HZ1 1 1
16 3571 1 1 9 LYS HZ2 H -8.998 -5.879 -7.215 1.00 . A A . 9 LYS HZ2 1 1
16 3572 1 1 9 LYS HZ3 H -9.285 -7.157 -6.144 1.00 . A A . 9 LYS HZ3 1 1
16 3573 1 1 9 LYS N N -6.764 -2.573 -1.999 1.00 . A A . 9 LYS N 1 1
16 3574 1 1 9 LYS NZ N -8.587 -6.448 -6.449 1.00 . A A . 9 LYS NZ 1 1
16 3575 1 1 9 LYS O O -7.696 -3.806 0.211 1.00 . A A . 9 LYS O 1 1
16 3576 1 1 10 ARG C C -9.967 -5.604 1.013 1.00 . A A . 10 ARG C 1 1
16 3577 1 1 10 ARG CA C -10.352 -4.129 0.935 1.00 . A A . 10 ARG CA 1 1
16 3578 1 1 10 ARG CB C -11.870 -3.980 1.041 1.00 . A A . 10 ARG CB 1 1
16 3579 1 1 10 ARG CD C -13.918 -4.030 2.498 1.00 . A A . 10 ARG CD 1 1
16 3580 1 1 10 ARG CG C -12.404 -4.168 2.452 1.00 . A A . 10 ARG CG 1 1
16 3581 1 1 10 ARG CZ C -15.889 -5.278 1.722 1.00 . A A . 10 ARG CZ 1 1
16 3582 1 1 10 ARG H H -10.519 -3.205 -0.961 1.00 . A A . 10 ARG H 1 1
16 3583 1 1 10 ARG HA H -9.890 -3.604 1.757 1.00 . A A . 10 ARG HA 1 1
16 3584 1 1 10 ARG HB2 H -12.148 -2.993 0.703 1.00 . A A . 10 ARG HB2 1 1
16 3585 1 1 10 ARG HB3 H -12.338 -4.715 0.402 1.00 . A A . 10 ARG HB3 1 1
16 3586 1 1 10 ARG HD2 H -14.219 -3.854 3.520 1.00 . A A . 10 ARG HD2 1 1
16 3587 1 1 10 ARG HD3 H -14.208 -3.188 1.888 1.00 . A A . 10 ARG HD3 1 1
16 3588 1 1 10 ARG HE H -14.050 -6.034 1.879 1.00 . A A . 10 ARG HE 1 1
16 3589 1 1 10 ARG HG2 H -12.132 -5.152 2.801 1.00 . A A . 10 ARG HG2 1 1
16 3590 1 1 10 ARG HG3 H -11.963 -3.421 3.095 1.00 . A A . 10 ARG HG3 1 1
16 3591 1 1 10 ARG HH11 H -16.242 -3.351 2.217 1.00 . A A . 10 ARG HH11 1 1
16 3592 1 1 10 ARG HH12 H -17.623 -4.243 1.668 1.00 . A A . 10 ARG HH12 1 1
16 3593 1 1 10 ARG HH21 H -15.860 -7.218 1.155 1.00 . A A . 10 ARG HH21 1 1
16 3594 1 1 10 ARG HH22 H -17.404 -6.442 1.065 1.00 . A A . 10 ARG HH22 1 1
16 3595 1 1 10 ARG N N -9.870 -3.532 -0.305 1.00 . A A . 10 ARG N 1 1
16 3596 1 1 10 ARG NE N -14.591 -5.228 2.005 1.00 . A A . 10 ARG NE 1 1
16 3597 1 1 10 ARG NH1 N -16.648 -4.202 1.882 1.00 . A A . 10 ARG NH1 1 1
16 3598 1 1 10 ARG NH2 N -16.428 -6.405 1.277 1.00 . A A . 10 ARG NH2 1 1
16 3599 1 1 10 ARG O O -9.691 -6.128 2.093 1.00 . A A . 10 ARG O 1 1
16 3600 1 1 11 HIS C C -8.120 -7.889 0.092 1.00 . A A . 11 HIS C 1 1
16 3601 1 1 11 HIS CA C -9.603 -7.683 -0.199 1.00 . A A . 11 HIS CA 1 1
16 3602 1 1 11 HIS CB C -9.949 -8.257 -1.574 1.00 . A A . 11 HIS CB 1 1
16 3603 1 1 11 HIS CD2 C -12.478 -7.955 -1.081 1.00 . A A . 11 HIS CD2 1 1
16 3604 1 1 11 HIS CE1 C -13.271 -8.826 -2.929 1.00 . A A . 11 HIS CE1 1 1
16 3605 1 1 11 HIS CG C -11.421 -8.343 -1.833 1.00 . A A . 11 HIS CG 1 1
16 3606 1 1 11 HIS H H -10.183 -5.796 -0.965 1.00 . A A . 11 HIS H 1 1
16 3607 1 1 11 HIS HA H -10.180 -8.200 0.552 1.00 . A A . 11 HIS HA 1 1
16 3608 1 1 11 HIS HB2 H -9.516 -7.628 -2.338 1.00 . A A . 11 HIS HB2 1 1
16 3609 1 1 11 HIS HB3 H -9.537 -9.252 -1.656 1.00 . A A . 11 HIS HB3 1 1
16 3610 1 1 11 HIS HD1 H -11.439 -9.258 -3.731 1.00 . A A . 11 HIS HD1 1 1
16 3611 1 1 11 HIS HD2 H -12.435 -7.487 -0.107 1.00 . A A . 11 HIS HD2 1 1
16 3612 1 1 11 HIS HE1 H -13.952 -9.175 -3.691 1.00 . A A . 11 HIS HE1 1 1
16 3613 1 1 11 HIS N N -9.954 -6.268 -0.137 1.00 . A A . 11 HIS N 1 1
16 3614 1 1 11 HIS ND1 N -11.952 -8.886 -2.984 1.00 . A A . 11 HIS ND1 1 1
16 3615 1 1 11 HIS NE2 N -13.615 -8.265 -1.784 1.00 . A A . 11 HIS NE2 1 1
16 3616 1 1 11 HIS O O -7.685 -8.998 0.400 1.00 . A A . 11 HIS O 1 1
16 3617 1 1 12 GLY C C -5.100 -6.849 -1.026 1.00 . A A . 12 GLY C 1 1
16 3618 1 1 12 GLY CA C -5.921 -6.895 0.247 1.00 . A A . 12 GLY CA 1 1
16 3619 1 1 12 GLY H H -7.748 -5.952 -0.257 1.00 . A A . 12 GLY H 1 1
16 3620 1 1 12 GLY HA2 H -5.630 -6.071 0.880 1.00 . A A . 12 GLY HA2 1 1
16 3621 1 1 12 GLY HA3 H -5.713 -7.822 0.761 1.00 . A A . 12 GLY HA3 1 1
16 3622 1 1 12 GLY N N -7.347 -6.812 -0.008 1.00 . A A . 12 GLY N 1 1
16 3623 1 1 12 GLY O O -3.897 -6.595 -0.989 1.00 . A A . 12 GLY O 1 1
16 3624 1 1 13 GLY C C -4.683 -5.678 -3.870 1.00 . A A . 13 GLY C 1 1
16 3625 1 1 13 GLY CA C -5.059 -7.080 -3.434 1.00 . A A . 13 GLY CA 1 1
16 3626 1 1 13 GLY H H -6.712 -7.295 -2.128 1.00 . A A . 13 GLY H 1 1
16 3627 1 1 13 GLY HA2 H -4.161 -7.674 -3.351 1.00 . A A . 13 GLY HA2 1 1
16 3628 1 1 13 GLY HA3 H -5.700 -7.518 -4.184 1.00 . A A . 13 GLY HA3 1 1
16 3629 1 1 13 GLY N N -5.753 -7.098 -2.158 1.00 . A A . 13 GLY N 1 1
16 3630 1 1 13 GLY O O -4.761 -4.733 -3.083 1.00 . A A . 13 GLY O 1 1
16 3631 1 1 14 CYS C C -4.634 -3.942 -6.955 1.00 . A A . 14 CYS C 1 1
16 3632 1 1 14 CYS CA C -3.879 -4.245 -5.665 1.00 . A A . 14 CYS CA 1 1
16 3633 1 1 14 CYS CB C -2.371 -4.212 -5.923 1.00 . A A . 14 CYS CB 1 1
16 3634 1 1 14 CYS H H -4.230 -6.332 -5.704 1.00 . A A . 14 CYS H 1 1
16 3635 1 1 14 CYS HA H -4.126 -3.492 -4.932 1.00 . A A . 14 CYS HA 1 1
16 3636 1 1 14 CYS HB2 H -2.118 -4.991 -6.629 1.00 . A A . 14 CYS HB2 1 1
16 3637 1 1 14 CYS HB3 H -2.106 -3.254 -6.344 1.00 . A A . 14 CYS HB3 1 1
16 3638 1 1 14 CYS N N -4.271 -5.542 -5.125 1.00 . A A . 14 CYS N 1 1
16 3639 1 1 14 CYS O O -4.432 -4.602 -7.974 1.00 . A A . 14 CYS O 1 1
16 3640 1 1 14 CYS SG S -1.355 -4.465 -4.433 1.00 . A A . 14 CYS SG 1 1
16 3641 1 1 15 SER C C -5.411 -1.898 -9.128 1.00 . A A . 15 SER C 1 1
16 3642 1 1 15 SER CA C -6.293 -2.549 -8.067 1.00 . A A . 15 SER CA 1 1
16 3643 1 1 15 SER CB C -7.408 -1.587 -7.654 1.00 . A A . 15 SER CB 1 1
16 3644 1 1 15 SER H H -5.620 -2.450 -6.062 1.00 . A A . 15 SER H 1 1
16 3645 1 1 15 SER HA H -6.734 -3.443 -8.481 1.00 . A A . 15 SER HA 1 1
16 3646 1 1 15 SER HB2 H -7.774 -1.862 -6.677 1.00 . A A . 15 SER HB2 1 1
16 3647 1 1 15 SER HB3 H -7.018 -0.580 -7.623 1.00 . A A . 15 SER HB3 1 1
16 3648 1 1 15 SER HG H -8.145 -1.773 -9.460 1.00 . A A . 15 SER HG 1 1
16 3649 1 1 15 SER N N -5.504 -2.938 -6.903 1.00 . A A . 15 SER N 1 1
16 3650 1 1 15 SER O O -4.658 -0.967 -8.840 1.00 . A A . 15 SER O 1 1
16 3651 1 1 15 SER OG O -8.486 -1.631 -8.573 1.00 . A A . 15 SER OG 1 1
16 3652 1 1 16 CYS C C -5.599 -1.619 -12.687 1.00 . A A . 16 CYS C 1 1
16 3653 1 1 16 CYS CA C -4.722 -1.864 -11.462 1.00 . A A . 16 CYS CA 1 1
16 3654 1 1 16 CYS CB C -3.588 -2.828 -11.818 1.00 . A A . 16 CYS CB 1 1
16 3655 1 1 16 CYS H H -6.127 -3.138 -10.524 1.00 . A A . 16 CYS H 1 1
16 3656 1 1 16 CYS HA H -4.296 -0.923 -11.145 1.00 . A A . 16 CYS HA 1 1
16 3657 1 1 16 CYS HB2 H -4.006 -3.702 -12.295 1.00 . A A . 16 CYS HB2 1 1
16 3658 1 1 16 CYS HB3 H -2.911 -2.339 -12.503 1.00 . A A . 16 CYS HB3 1 1
16 3659 1 1 16 CYS N N -5.509 -2.395 -10.356 1.00 . A A . 16 CYS N 1 1
16 3660 1 1 16 CYS O O -6.662 -2.222 -12.831 1.00 . A A . 16 CYS O 1 1
16 3661 1 1 16 CYS SG S -2.616 -3.392 -10.384 1.00 . A A . 16 CYS SG 1 1
16 3662 1 1 17 NH2 HN1 H -5.654 -0.509 -14.396 1.00 . A A . 17 NH2 HN1 1 1
16 3663 1 1 17 NH2 HN2 H -4.289 -0.283 -13.394 1.00 . A A . 17 NH2 HN2 1 1
16 3664 1 1 17 NH2 N N -5.144 -0.731 -13.565 1.00 . A A . 17 NH2 N 1 1
17 3665 1 1 1 TRP C C 1.639 -0.521 -2.006 1.00 . A A . 1 TRP C 1 1
17 3666 1 1 1 TRP CA C 2.005 0.748 -1.245 1.00 . A A . 1 TRP CA 1 1
17 3667 1 1 1 TRP CB C 3.495 0.741 -0.901 1.00 . A A . 1 TRP CB 1 1
17 3668 1 1 1 TRP CD1 C 5.026 1.820 -2.651 1.00 . A A . 1 TRP CD1 1 1
17 3669 1 1 1 TRP CD2 C 4.723 -0.382 -2.926 1.00 . A A . 1 TRP CD2 1 1
17 3670 1 1 1 TRP CE2 C 5.577 0.085 -3.944 1.00 . A A . 1 TRP CE2 1 1
17 3671 1 1 1 TRP CE3 C 4.391 -1.739 -2.895 1.00 . A A . 1 TRP CE3 1 1
17 3672 1 1 1 TRP CG C 4.382 0.744 -2.109 1.00 . A A . 1 TRP CG 1 1
17 3673 1 1 1 TRP CH2 C 5.758 -2.082 -4.866 1.00 . A A . 1 TRP CH2 1 1
17 3674 1 1 1 TRP CZ2 C 6.100 -0.758 -4.921 1.00 . A A . 1 TRP CZ2 1 1
17 3675 1 1 1 TRP CZ3 C 4.910 -2.574 -3.865 1.00 . A A . 1 TRP CZ3 1 1
17 3676 1 1 1 TRP H1 H 1.642 1.160 0.800 1.00 . A A . 1 TRP H1 1 1
17 3677 1 1 1 TRP HA H 1.793 1.603 -1.870 1.00 . A A . 1 TRP HA 1 1
17 3678 1 1 1 TRP HB2 H 3.727 1.617 -0.315 1.00 . A A . 1 TRP HB2 1 1
17 3679 1 1 1 TRP HB3 H 3.720 -0.144 -0.324 1.00 . A A . 1 TRP HB3 1 1
17 3680 1 1 1 TRP HD1 H 4.967 2.824 -2.259 1.00 . A A . 1 TRP HD1 1 1
17 3681 1 1 1 TRP HE1 H 6.292 2.022 -4.315 1.00 . A A . 1 TRP HE1 1 1
17 3682 1 1 1 TRP HE3 H 3.739 -2.137 -2.131 1.00 . A A . 1 TRP HE3 1 1
17 3683 1 1 1 TRP HH2 H 6.141 -2.770 -5.604 1.00 . A A . 1 TRP HH2 1 1
17 3684 1 1 1 TRP HZ2 H 6.755 -0.394 -5.699 1.00 . A A . 1 TRP HZ2 1 1
17 3685 1 1 1 TRP HZ3 H 4.664 -3.626 -3.857 1.00 . A A . 1 TRP HZ3 1 1
17 3686 1 1 1 TRP N N 1.206 0.874 -0.030 1.00 . A A . 1 TRP N 1 1
17 3687 1 1 1 TRP NE1 N 5.745 1.431 -3.755 1.00 . A A . 1 TRP NE1 1 1
17 3688 1 1 1 TRP O O 1.358 -1.558 -1.405 1.00 . A A . 1 TRP O 1 1
17 3689 1 1 2 CYS C C 2.182 -1.591 -5.433 1.00 . A A . 2 CYS C 1 1
17 3690 1 1 2 CYS CA C 1.315 -1.574 -4.177 1.00 . A A . 2 CYS CA 1 1
17 3691 1 1 2 CYS CB C -0.165 -1.536 -4.564 1.00 . A A . 2 CYS CB 1 1
17 3692 1 1 2 CYS H H 1.879 0.421 -3.754 1.00 . A A . 2 CYS H 1 1
17 3693 1 1 2 CYS HA H 1.507 -2.473 -3.610 1.00 . A A . 2 CYS HA 1 1
17 3694 1 1 2 CYS HB2 H -0.505 -0.511 -4.555 1.00 . A A . 2 CYS HB2 1 1
17 3695 1 1 2 CYS HB3 H -0.278 -1.939 -5.560 1.00 . A A . 2 CYS HB3 1 1
17 3696 1 1 2 CYS N N 1.646 -0.433 -3.332 1.00 . A A . 2 CYS N 1 1
17 3697 1 1 2 CYS O O 2.890 -0.627 -5.724 1.00 . A A . 2 CYS O 1 1
17 3698 1 1 2 CYS SG S -1.249 -2.490 -3.454 1.00 . A A . 2 CYS SG 1 1
17 3699 1 1 3 ALA C C 2.457 -1.815 -8.447 1.00 . A A . 3 ALA C 1 1
17 3700 1 1 3 ALA CA C 2.894 -2.833 -7.400 1.00 . A A . 3 ALA CA 1 1
17 3701 1 1 3 ALA CB C 2.762 -4.247 -7.948 1.00 . A A . 3 ALA CB 1 1
17 3702 1 1 3 ALA H H 1.535 -3.427 -5.890 1.00 . A A . 3 ALA H 1 1
17 3703 1 1 3 ALA HA H 3.934 -2.663 -7.158 1.00 . A A . 3 ALA HA 1 1
17 3704 1 1 3 ALA HB1 H 1.782 -4.373 -8.384 1.00 . A A . 3 ALA HB1 1 1
17 3705 1 1 3 ALA HB2 H 3.517 -4.412 -8.702 1.00 . A A . 3 ALA HB2 1 1
17 3706 1 1 3 ALA HB3 H 2.893 -4.957 -7.145 1.00 . A A . 3 ALA HB3 1 1
17 3707 1 1 3 ALA N N 2.118 -2.692 -6.174 1.00 . A A . 3 ALA N 1 1
17 3708 1 1 3 ALA O O 1.269 -1.531 -8.592 1.00 . A A . 3 ALA O 1 1
17 3709 1 1 4 SER C C 2.300 0.864 -9.643 1.00 . A A . 4 SER C 1 1
17 3710 1 1 4 SER CA C 3.141 -0.277 -10.206 1.00 . A A . 4 SER CA 1 1
17 3711 1 1 4 SER CB C 2.414 -0.929 -11.383 1.00 . A A . 4 SER CB 1 1
17 3712 1 1 4 SER H H 4.355 -1.536 -9.011 1.00 . A A . 4 SER H 1 1
17 3713 1 1 4 SER HA H 4.082 0.122 -10.552 1.00 . A A . 4 SER HA 1 1
17 3714 1 1 4 SER HB2 H 2.770 -1.941 -11.506 1.00 . A A . 4 SER HB2 1 1
17 3715 1 1 4 SER HB3 H 1.352 -0.943 -11.184 1.00 . A A . 4 SER HB3 1 1
17 3716 1 1 4 SER HG H 2.503 -0.796 -13.335 1.00 . A A . 4 SER HG 1 1
17 3717 1 1 4 SER N N 3.426 -1.268 -9.174 1.00 . A A . 4 SER N 1 1
17 3718 1 1 4 SER O O 1.480 1.452 -10.349 1.00 . A A . 4 SER O 1 1
17 3719 1 1 4 SER OG O 2.645 -0.215 -12.584 1.00 . A A . 4 SER OG 1 1
17 3720 1 1 5 GLY C C 0.266 1.999 -7.751 1.00 . A A . 5 GLY C 1 1
17 3721 1 1 5 GLY CA C 1.762 2.244 -7.731 1.00 . A A . 5 GLY CA 1 1
17 3722 1 1 5 GLY H H 3.175 0.672 -7.854 1.00 . A A . 5 GLY H 1 1
17 3723 1 1 5 GLY HA2 H 2.089 2.336 -6.706 1.00 . A A . 5 GLY HA2 1 1
17 3724 1 1 5 GLY HA3 H 1.970 3.169 -8.249 1.00 . A A . 5 GLY HA3 1 1
17 3725 1 1 5 GLY N N 2.508 1.175 -8.368 1.00 . A A . 5 GLY N 1 1
17 3726 1 1 5 GLY O O -0.525 2.939 -7.683 1.00 . A A . 5 GLY O 1 1
17 3727 1 1 6 CYS C C -2.263 0.910 -6.650 1.00 . A A . 6 CYS C 1 1
17 3728 1 1 6 CYS CA C -1.532 0.364 -7.873 1.00 . A A . 6 CYS CA 1 1
17 3729 1 1 6 CYS CB C -1.684 -1.157 -7.935 1.00 . A A . 6 CYS CB 1 1
17 3730 1 1 6 CYS H H 0.557 0.025 -7.894 1.00 . A A . 6 CYS H 1 1
17 3731 1 1 6 CYS HA H -1.970 0.797 -8.760 1.00 . A A . 6 CYS HA 1 1
17 3732 1 1 6 CYS HB2 H -0.831 -1.616 -7.455 1.00 . A A . 6 CYS HB2 1 1
17 3733 1 1 6 CYS HB3 H -2.583 -1.443 -7.410 1.00 . A A . 6 CYS HB3 1 1
17 3734 1 1 6 CYS N N -0.122 0.731 -7.843 1.00 . A A . 6 CYS N 1 1
17 3735 1 1 6 CYS O O -1.653 1.518 -5.770 1.00 . A A . 6 CYS O 1 1
17 3736 1 1 6 CYS SG S -1.791 -1.826 -9.626 1.00 . A A . 6 CYS SG 1 1
17 3737 1 1 7 ARG C C -4.828 -0.008 -4.606 1.00 . A A . 7 ARG C 1 1
17 3738 1 1 7 ARG CA C -4.386 1.158 -5.487 1.00 . A A . 7 ARG CA 1 1
17 3739 1 1 7 ARG CB C -5.612 1.912 -6.004 1.00 . A A . 7 ARG CB 1 1
17 3740 1 1 7 ARG CD C -6.519 3.920 -7.214 1.00 . A A . 7 ARG CD 1 1
17 3741 1 1 7 ARG CG C -5.279 3.253 -6.640 1.00 . A A . 7 ARG CG 1 1
17 3742 1 1 7 ARG CZ C -7.291 6.185 -7.778 1.00 . A A . 7 ARG CZ 1 1
17 3743 1 1 7 ARG H H -4.001 0.197 -7.333 1.00 . A A . 7 ARG H 1 1
17 3744 1 1 7 ARG HA H -3.784 1.832 -4.896 1.00 . A A . 7 ARG HA 1 1
17 3745 1 1 7 ARG HB2 H -6.110 1.302 -6.745 1.00 . A A . 7 ARG HB2 1 1
17 3746 1 1 7 ARG HB3 H -6.288 2.086 -5.181 1.00 . A A . 7 ARG HB3 1 1
17 3747 1 1 7 ARG HD2 H -6.765 3.447 -8.152 1.00 . A A . 7 ARG HD2 1 1
17 3748 1 1 7 ARG HD3 H -7.336 3.790 -6.519 1.00 . A A . 7 ARG HD3 1 1
17 3749 1 1 7 ARG HE H -5.407 5.699 -7.342 1.00 . A A . 7 ARG HE 1 1
17 3750 1 1 7 ARG HG2 H -4.851 3.900 -5.888 1.00 . A A . 7 ARG HG2 1 1
17 3751 1 1 7 ARG HG3 H -4.565 3.097 -7.433 1.00 . A A . 7 ARG HG3 1 1
17 3752 1 1 7 ARG HH11 H -8.734 4.771 -7.776 1.00 . A A . 7 ARG HH11 1 1
17 3753 1 1 7 ARG HH12 H -9.264 6.372 -8.173 1.00 . A A . 7 ARG HH12 1 1
17 3754 1 1 7 ARG HH21 H -6.093 7.811 -7.862 1.00 . A A . 7 ARG HH21 1 1
17 3755 1 1 7 ARG HH22 H -7.761 8.101 -8.221 1.00 . A A . 7 ARG HH22 1 1
17 3756 1 1 7 ARG N N -3.572 0.688 -6.601 1.00 . A A . 7 ARG N 1 1
17 3757 1 1 7 ARG NE N -6.315 5.348 -7.443 1.00 . A A . 7 ARG NE 1 1
17 3758 1 1 7 ARG NH1 N -8.531 5.740 -7.921 1.00 . A A . 7 ARG NH1 1 1
17 3759 1 1 7 ARG NH2 N -7.026 7.472 -7.969 1.00 . A A . 7 ARG NH2 1 1
17 3760 1 1 7 ARG O O -5.580 -0.880 -5.042 1.00 . A A . 7 ARG O 1 1
17 3761 1 1 8 LYS C C -6.210 -1.261 -2.342 1.00 . A A . 8 LYS C 1 1
17 3762 1 1 8 LYS CA C -4.699 -1.075 -2.422 1.00 . A A . 8 LYS CA 1 1
17 3763 1 1 8 LYS CB C -4.141 -0.750 -1.035 1.00 . A A . 8 LYS CB 1 1
17 3764 1 1 8 LYS CD C -3.142 -1.889 0.971 1.00 . A A . 8 LYS CD 1 1
17 3765 1 1 8 LYS CE C -2.144 -2.927 1.457 1.00 . A A . 8 LYS CE 1 1
17 3766 1 1 8 LYS CG C -3.111 -1.754 -0.543 1.00 . A A . 8 LYS CG 1 1
17 3767 1 1 8 LYS H H -3.758 0.705 -3.076 1.00 . A A . 8 LYS H 1 1
17 3768 1 1 8 LYS HA H -4.254 -1.992 -2.775 1.00 . A A . 8 LYS HA 1 1
17 3769 1 1 8 LYS HB2 H -3.676 0.224 -1.065 1.00 . A A . 8 LYS HB2 1 1
17 3770 1 1 8 LYS HB3 H -4.957 -0.729 -0.327 1.00 . A A . 8 LYS HB3 1 1
17 3771 1 1 8 LYS HD2 H -2.898 -0.934 1.413 1.00 . A A . 8 LYS HD2 1 1
17 3772 1 1 8 LYS HD3 H -4.136 -2.185 1.276 1.00 . A A . 8 LYS HD3 1 1
17 3773 1 1 8 LYS HE2 H -2.410 -3.219 2.462 1.00 . A A . 8 LYS HE2 1 1
17 3774 1 1 8 LYS HE3 H -2.193 -3.787 0.807 1.00 . A A . 8 LYS HE3 1 1
17 3775 1 1 8 LYS HG2 H -3.323 -2.717 -0.983 1.00 . A A . 8 LYS HG2 1 1
17 3776 1 1 8 LYS HG3 H -2.128 -1.424 -0.847 1.00 . A A . 8 LYS HG3 1 1
17 3777 1 1 8 LYS HZ1 H -0.531 -1.976 2.384 1.00 . A A . 8 LYS HZ1 1 1
17 3778 1 1 8 LYS HZ2 H -0.644 -1.672 0.724 1.00 . A A . 8 LYS HZ2 1 1
17 3779 1 1 8 LYS HZ3 H -0.077 -3.168 1.272 1.00 . A A . 8 LYS HZ3 1 1
17 3780 1 1 8 LYS N N -4.354 -0.017 -3.365 1.00 . A A . 8 LYS N 1 1
17 3781 1 1 8 LYS NZ N -0.752 -2.399 1.459 1.00 . A A . 8 LYS NZ 1 1
17 3782 1 1 8 LYS O O -6.975 -0.321 -2.567 1.00 . A A . 8 LYS O 1 1
17 3783 1 1 9 LYS C C -8.358 -3.490 -0.589 1.00 . A A . 9 LYS C 1 1
17 3784 1 1 9 LYS CA C -8.057 -2.787 -1.909 1.00 . A A . 9 LYS CA 1 1
17 3785 1 1 9 LYS CB C -8.502 -3.665 -3.080 1.00 . A A . 9 LYS CB 1 1
17 3786 1 1 9 LYS CD C -8.463 -4.090 -5.556 1.00 . A A . 9 LYS CD 1 1
17 3787 1 1 9 LYS CE C -7.884 -5.492 -5.443 1.00 . A A . 9 LYS CE 1 1
17 3788 1 1 9 LYS CG C -7.979 -3.196 -4.427 1.00 . A A . 9 LYS CG 1 1
17 3789 1 1 9 LYS H H -5.978 -3.185 -1.854 1.00 . A A . 9 LYS H 1 1
17 3790 1 1 9 LYS HA H -8.603 -1.856 -1.940 1.00 . A A . 9 LYS HA 1 1
17 3791 1 1 9 LYS HB2 H -8.152 -4.673 -2.913 1.00 . A A . 9 LYS HB2 1 1
17 3792 1 1 9 LYS HB3 H -9.582 -3.670 -3.120 1.00 . A A . 9 LYS HB3 1 1
17 3793 1 1 9 LYS HD2 H -9.540 -4.153 -5.517 1.00 . A A . 9 LYS HD2 1 1
17 3794 1 1 9 LYS HD3 H -8.159 -3.658 -6.500 1.00 . A A . 9 LYS HD3 1 1
17 3795 1 1 9 LYS HE2 H -7.764 -5.897 -6.436 1.00 . A A . 9 LYS HE2 1 1
17 3796 1 1 9 LYS HE3 H -6.921 -5.432 -4.959 1.00 . A A . 9 LYS HE3 1 1
17 3797 1 1 9 LYS HG2 H -8.325 -2.188 -4.606 1.00 . A A . 9 LYS HG2 1 1
17 3798 1 1 9 LYS HG3 H -6.898 -3.210 -4.406 1.00 . A A . 9 LYS HG3 1 1
17 3799 1 1 9 LYS HZ1 H -9.155 -7.141 -5.269 1.00 . A A . 9 LYS HZ1 1 1
17 3800 1 1 9 LYS HZ2 H -9.556 -5.855 -4.246 1.00 . A A . 9 LYS HZ2 1 1
17 3801 1 1 9 LYS HZ3 H -8.229 -6.839 -3.885 1.00 . A A . 9 LYS HZ3 1 1
17 3802 1 1 9 LYS N N -6.636 -2.477 -2.021 1.00 . A A . 9 LYS N 1 1
17 3803 1 1 9 LYS NZ N -8.768 -6.395 -4.655 1.00 . A A . 9 LYS NZ 1 1
17 3804 1 1 9 LYS O O -7.491 -4.147 -0.013 1.00 . A A . 9 LYS O 1 1
17 3805 1 1 10 ARG C C -9.801 -5.481 1.086 1.00 . A A . 10 ARG C 1 1
17 3806 1 1 10 ARG CA C -10.007 -3.970 1.135 1.00 . A A . 10 ARG CA 1 1
17 3807 1 1 10 ARG CB C -11.476 -3.654 1.423 1.00 . A A . 10 ARG CB 1 1
17 3808 1 1 10 ARG CD C -12.896 -5.718 1.220 1.00 . A A . 10 ARG CD 1 1
17 3809 1 1 10 ARG CG C -12.448 -4.427 0.549 1.00 . A A . 10 ARG CG 1 1
17 3810 1 1 10 ARG CZ C -14.854 -6.532 2.463 1.00 . A A . 10 ARG CZ 1 1
17 3811 1 1 10 ARG H H -10.239 -2.811 -0.621 1.00 . A A . 10 ARG H 1 1
17 3812 1 1 10 ARG HA H -9.397 -3.560 1.927 1.00 . A A . 10 ARG HA 1 1
17 3813 1 1 10 ARG HB2 H -11.687 -3.892 2.457 1.00 . A A . 10 ARG HB2 1 1
17 3814 1 1 10 ARG HB3 H -11.642 -2.599 1.264 1.00 . A A . 10 ARG HB3 1 1
17 3815 1 1 10 ARG HD2 H -13.089 -6.456 0.456 1.00 . A A . 10 ARG HD2 1 1
17 3816 1 1 10 ARG HD3 H -12.102 -6.066 1.864 1.00 . A A . 10 ARG HD3 1 1
17 3817 1 1 10 ARG HE H -14.374 -4.611 2.224 1.00 . A A . 10 ARG HE 1 1
17 3818 1 1 10 ARG HG2 H -13.317 -3.813 0.361 1.00 . A A . 10 ARG HG2 1 1
17 3819 1 1 10 ARG HG3 H -11.965 -4.668 -0.386 1.00 . A A . 10 ARG HG3 1 1
17 3820 1 1 10 ARG HH11 H -13.697 -7.978 1.658 1.00 . A A . 10 ARG HH11 1 1
17 3821 1 1 10 ARG HH12 H -15.080 -8.538 2.537 1.00 . A A . 10 ARG HH12 1 1
17 3822 1 1 10 ARG HH21 H -16.198 -5.337 3.385 1.00 . A A . 10 ARG HH21 1 1
17 3823 1 1 10 ARG HH22 H -16.503 -7.035 3.518 1.00 . A A . 10 ARG HH22 1 1
17 3824 1 1 10 ARG N N -9.592 -3.348 -0.117 1.00 . A A . 10 ARG N 1 1
17 3825 1 1 10 ARG NE N -14.106 -5.530 2.015 1.00 . A A . 10 ARG NE 1 1
17 3826 1 1 10 ARG NH1 N -14.516 -7.786 2.197 1.00 . A A . 10 ARG NH1 1 1
17 3827 1 1 10 ARG NH2 N -15.941 -6.280 3.182 1.00 . A A . 10 ARG NH2 1 1
17 3828 1 1 10 ARG O O -9.624 -6.128 2.119 1.00 . A A . 10 ARG O 1 1
17 3829 1 1 11 HIS C C -8.195 -7.874 -0.026 1.00 . A A . 11 HIS C 1 1
17 3830 1 1 11 HIS CA C -9.640 -7.473 -0.305 1.00 . A A . 11 HIS CA 1 1
17 3831 1 1 11 HIS CB C -10.031 -7.880 -1.725 1.00 . A A . 11 HIS CB 1 1
17 3832 1 1 11 HIS CD2 C -12.152 -6.479 -2.239 1.00 . A A . 11 HIS CD2 1 1
17 3833 1 1 11 HIS CE1 C -13.577 -8.129 -2.472 1.00 . A A . 11 HIS CE1 1 1
17 3834 1 1 11 HIS CG C -11.473 -7.633 -2.044 1.00 . A A . 11 HIS CG 1 1
17 3835 1 1 11 HIS H H -9.970 -5.469 -0.906 1.00 . A A . 11 HIS H 1 1
17 3836 1 1 11 HIS HA H -10.283 -7.982 0.396 1.00 . A A . 11 HIS HA 1 1
17 3837 1 1 11 HIS HB2 H -9.435 -7.319 -2.431 1.00 . A A . 11 HIS HB2 1 1
17 3838 1 1 11 HIS HB3 H -9.837 -8.935 -1.857 1.00 . A A . 11 HIS HB3 1 1
17 3839 1 1 11 HIS HD1 H -12.209 -9.607 -2.115 1.00 . A A . 11 HIS HD1 1 1
17 3840 1 1 11 HIS HD2 H -11.743 -5.479 -2.196 1.00 . A A . 11 HIS HD2 1 1
17 3841 1 1 11 HIS HE1 H -14.488 -8.683 -2.642 1.00 . A A . 11 HIS HE1 1 1
17 3842 1 1 11 HIS N N -9.824 -6.038 -0.121 1.00 . A A . 11 HIS N 1 1
17 3843 1 1 11 HIS ND1 N -12.394 -8.648 -2.196 1.00 . A A . 11 HIS ND1 1 1
17 3844 1 1 11 HIS NE2 N -13.457 -6.813 -2.503 1.00 . A A . 11 HIS NE2 1 1
17 3845 1 1 11 HIS O O -7.897 -9.049 0.186 1.00 . A A . 11 HIS O 1 1
17 3846 1 1 12 GLY C C -5.059 -7.102 -1.038 1.00 . A A . 12 GLY C 1 1
17 3847 1 1 12 GLY CA C -5.897 -7.162 0.223 1.00 . A A . 12 GLY CA 1 1
17 3848 1 1 12 GLY H H -7.596 -5.972 -0.205 1.00 . A A . 12 GLY H 1 1
17 3849 1 1 12 GLY HA2 H -5.522 -6.435 0.927 1.00 . A A . 12 GLY HA2 1 1
17 3850 1 1 12 GLY HA3 H -5.806 -8.148 0.656 1.00 . A A . 12 GLY HA3 1 1
17 3851 1 1 12 GLY N N -7.300 -6.891 -0.030 1.00 . A A . 12 GLY N 1 1
17 3852 1 1 12 GLY O O -3.834 -7.008 -0.974 1.00 . A A . 12 GLY O 1 1
17 3853 1 1 13 GLY C C -4.682 -5.696 -3.882 1.00 . A A . 13 GLY C 1 1
17 3854 1 1 13 GLY CA C -5.013 -7.112 -3.456 1.00 . A A . 13 GLY CA 1 1
17 3855 1 1 13 GLY H H -6.698 -7.235 -2.181 1.00 . A A . 13 GLY H 1 1
17 3856 1 1 13 GLY HA2 H -4.095 -7.674 -3.364 1.00 . A A . 13 GLY HA2 1 1
17 3857 1 1 13 GLY HA3 H -5.628 -7.569 -4.217 1.00 . A A . 13 GLY HA3 1 1
17 3858 1 1 13 GLY N N -5.721 -7.160 -2.191 1.00 . A A . 13 GLY N 1 1
17 3859 1 1 13 GLY O O -4.803 -4.758 -3.094 1.00 . A A . 13 GLY O 1 1
17 3860 1 1 14 CYS C C -4.680 -3.933 -6.944 1.00 . A A . 14 CYS C 1 1
17 3861 1 1 14 CYS CA C -3.907 -4.228 -5.662 1.00 . A A . 14 CYS CA 1 1
17 3862 1 1 14 CYS CB C -2.403 -4.151 -5.933 1.00 . A A . 14 CYS CB 1 1
17 3863 1 1 14 CYS H H -4.183 -6.326 -5.714 1.00 . A A . 14 CYS H 1 1
17 3864 1 1 14 CYS HA H -4.168 -3.488 -4.921 1.00 . A A . 14 CYS HA 1 1
17 3865 1 1 14 CYS HB2 H -2.131 -4.928 -6.632 1.00 . A A . 14 CYS HB2 1 1
17 3866 1 1 14 CYS HB3 H -2.171 -3.189 -6.364 1.00 . A A . 14 CYS HB3 1 1
17 3867 1 1 14 CYS N N -4.259 -5.539 -5.133 1.00 . A A . 14 CYS N 1 1
17 3868 1 1 14 CYS O O -4.513 -4.617 -7.954 1.00 . A A . 14 CYS O 1 1
17 3869 1 1 14 CYS SG S -1.369 -4.358 -4.447 1.00 . A A . 14 CYS SG 1 1
17 3870 1 1 15 SER C C -5.445 -1.992 -9.173 1.00 . A A . 15 SER C 1 1
17 3871 1 1 15 SER CA C -6.330 -2.526 -8.051 1.00 . A A . 15 SER CA 1 1
17 3872 1 1 15 SER CB C -7.362 -1.468 -7.653 1.00 . A A . 15 SER CB 1 1
17 3873 1 1 15 SER H H -5.616 -2.403 -6.061 1.00 . A A . 15 SER H 1 1
17 3874 1 1 15 SER HA H -6.847 -3.406 -8.402 1.00 . A A . 15 SER HA 1 1
17 3875 1 1 15 SER HB2 H -7.762 -1.708 -6.679 1.00 . A A . 15 SER HB2 1 1
17 3876 1 1 15 SER HB3 H -6.886 -0.499 -7.618 1.00 . A A . 15 SER HB3 1 1
17 3877 1 1 15 SER HG H -9.264 -1.497 -8.119 1.00 . A A . 15 SER HG 1 1
17 3878 1 1 15 SER N N -5.528 -2.909 -6.895 1.00 . A A . 15 SER N 1 1
17 3879 1 1 15 SER O O -4.715 -1.016 -8.994 1.00 . A A . 15 SER O 1 1
17 3880 1 1 15 SER OG O -8.428 -1.420 -8.584 1.00 . A A . 15 SER OG 1 1
17 3881 1 1 16 CYS C C -5.592 -2.138 -12.737 1.00 . A A . 16 CYS C 1 1
17 3882 1 1 16 CYS CA C -4.724 -2.231 -11.485 1.00 . A A . 16 CYS CA 1 1
17 3883 1 1 16 CYS CB C -3.578 -3.218 -11.718 1.00 . A A . 16 CYS CB 1 1
17 3884 1 1 16 CYS H H -6.119 -3.408 -10.413 1.00 . A A . 16 CYS H 1 1
17 3885 1 1 16 CYS HA H -4.311 -1.256 -11.277 1.00 . A A . 16 CYS HA 1 1
17 3886 1 1 16 CYS HB2 H -3.987 -4.156 -12.065 1.00 . A A . 16 CYS HB2 1 1
17 3887 1 1 16 CYS HB3 H -2.916 -2.819 -12.471 1.00 . A A . 16 CYS HB3 1 1
17 3888 1 1 16 CYS N N -5.518 -2.637 -10.332 1.00 . A A . 16 CYS N 1 1
17 3889 1 1 16 CYS O O -6.698 -2.676 -12.779 1.00 . A A . 16 CYS O 1 1
17 3890 1 1 16 CYS SG S -2.585 -3.567 -10.231 1.00 . A A . 16 CYS SG 1 1
17 3891 1 1 17 NH2 HN1 H -5.581 -1.341 -14.614 1.00 . A A . 17 NH2 HN1 1 1
17 3892 1 1 17 NH2 HN2 H -4.195 -1.045 -13.661 1.00 . A A . 17 NH2 HN2 1 1
17 3893 1 1 17 NH2 N N -5.082 -1.451 -13.755 1.00 . A A . 17 NH2 N 1 1
18 3894 1 1 1 TRP C C 1.756 -0.803 -2.258 1.00 . A A . 1 TRP C 1 1
18 3895 1 1 1 TRP CA C 2.040 0.444 -1.427 1.00 . A A . 1 TRP CA 1 1
18 3896 1 1 1 TRP CB C 3.549 0.647 -1.287 1.00 . A A . 1 TRP CB 1 1
18 3897 1 1 1 TRP CD1 C 4.641 2.030 -3.149 1.00 . A A . 1 TRP CD1 1 1
18 3898 1 1 1 TRP CD2 C 4.627 -0.177 -3.529 1.00 . A A . 1 TRP CD2 1 1
18 3899 1 1 1 TRP CE2 C 5.250 0.463 -4.618 1.00 . A A . 1 TRP CE2 1 1
18 3900 1 1 1 TRP CE3 C 4.505 -1.569 -3.546 1.00 . A A . 1 TRP CE3 1 1
18 3901 1 1 1 TRP CG C 4.245 0.844 -2.600 1.00 . A A . 1 TRP CG 1 1
18 3902 1 1 1 TRP CH2 C 5.614 -1.604 -5.701 1.00 . A A . 1 TRP CH2 1 1
18 3903 1 1 1 TRP CZ2 C 5.746 -0.243 -5.711 1.00 . A A . 1 TRP CZ2 1 1
18 3904 1 1 1 TRP CZ3 C 4.998 -2.267 -4.632 1.00 . A A . 1 TRP CZ3 1 1
18 3905 1 1 1 TRP H1 H 1.682 -0.386 0.488 1.00 . A A . 1 TRP H1 1 1
18 3906 1 1 1 TRP HA H 1.615 1.301 -1.928 1.00 . A A . 1 TRP HA 1 1
18 3907 1 1 1 TRP HB2 H 3.735 1.518 -0.678 1.00 . A A . 1 TRP HB2 1 1
18 3908 1 1 1 TRP HB3 H 3.979 -0.221 -0.809 1.00 . A A . 1 TRP HB3 1 1
18 3909 1 1 1 TRP HD1 H 4.492 2.993 -2.686 1.00 . A A . 1 TRP HD1 1 1
18 3910 1 1 1 TRP HE1 H 5.614 2.502 -4.950 1.00 . A A . 1 TRP HE1 1 1
18 3911 1 1 1 TRP HE3 H 4.034 -2.098 -2.731 1.00 . A A . 1 TRP HE3 1 1
18 3912 1 1 1 TRP HH2 H 5.984 -2.191 -6.528 1.00 . A A . 1 TRP HH2 1 1
18 3913 1 1 1 TRP HZ2 H 6.224 0.254 -6.543 1.00 . A A . 1 TRP HZ2 1 1
18 3914 1 1 1 TRP HZ3 H 4.913 -3.344 -4.662 1.00 . A A . 1 TRP HZ3 1 1
18 3915 1 1 1 TRP N N 1.419 0.345 -0.110 1.00 . A A . 1 TRP N 1 1
18 3916 1 1 1 TRP NE1 N 5.245 1.808 -4.363 1.00 . A A . 1 TRP NE1 1 1
18 3917 1 1 1 TRP O O 1.919 -1.927 -1.783 1.00 . A A . 1 TRP O 1 1
18 3918 1 1 2 CYS C C 1.922 -1.667 -5.632 1.00 . A A . 2 CYS C 1 1
18 3919 1 1 2 CYS CA C 1.025 -1.703 -4.397 1.00 . A A . 2 CYS CA 1 1
18 3920 1 1 2 CYS CB C -0.445 -1.653 -4.820 1.00 . A A . 2 CYS CB 1 1
18 3921 1 1 2 CYS H H 1.222 0.324 -3.822 1.00 . A A . 2 CYS H 1 1
18 3922 1 1 2 CYS HA H 1.206 -2.624 -3.863 1.00 . A A . 2 CYS HA 1 1
18 3923 1 1 2 CYS HB2 H -0.782 -0.627 -4.801 1.00 . A A . 2 CYS HB2 1 1
18 3924 1 1 2 CYS HB3 H -0.536 -2.039 -5.824 1.00 . A A . 2 CYS HB3 1 1
18 3925 1 1 2 CYS N N 1.332 -0.596 -3.500 1.00 . A A . 2 CYS N 1 1
18 3926 1 1 2 CYS O O 2.526 -0.641 -5.944 1.00 . A A . 2 CYS O 1 1
18 3927 1 1 2 CYS SG S -1.558 -2.620 -3.750 1.00 . A A . 2 CYS SG 1 1
18 3928 1 1 3 ALA C C 2.461 -1.803 -8.533 1.00 . A A . 3 ALA C 1 1
18 3929 1 1 3 ALA CA C 2.824 -2.892 -7.531 1.00 . A A . 3 ALA CA 1 1
18 3930 1 1 3 ALA CB C 2.670 -4.267 -8.165 1.00 . A A . 3 ALA CB 1 1
18 3931 1 1 3 ALA H H 1.499 -3.580 -6.031 1.00 . A A . 3 ALA H 1 1
18 3932 1 1 3 ALA HA H 3.857 -2.771 -7.240 1.00 . A A . 3 ALA HA 1 1
18 3933 1 1 3 ALA HB1 H 3.139 -5.009 -7.534 1.00 . A A . 3 ALA HB1 1 1
18 3934 1 1 3 ALA HB2 H 1.621 -4.498 -8.273 1.00 . A A . 3 ALA HB2 1 1
18 3935 1 1 3 ALA HB3 H 3.143 -4.271 -9.136 1.00 . A A . 3 ALA HB3 1 1
18 3936 1 1 3 ALA N N 2.004 -2.796 -6.331 1.00 . A A . 3 ALA N 1 1
18 3937 1 1 3 ALA O O 1.291 -1.453 -8.688 1.00 . A A . 3 ALA O 1 1
18 3938 1 1 4 SER C C 2.474 0.945 -9.590 1.00 . A A . 4 SER C 1 1
18 3939 1 1 4 SER CA C 3.260 -0.214 -10.196 1.00 . A A . 4 SER CA 1 1
18 3940 1 1 4 SER CB C 2.517 -0.767 -11.414 1.00 . A A . 4 SER CB 1 1
18 3941 1 1 4 SER H H 4.382 -1.590 -9.043 1.00 . A A . 4 SER H 1 1
18 3942 1 1 4 SER HA H 4.227 0.147 -10.509 1.00 . A A . 4 SER HA 1 1
18 3943 1 1 4 SER HB2 H 2.983 -1.687 -11.730 1.00 . A A . 4 SER HB2 1 1
18 3944 1 1 4 SER HB3 H 1.486 -0.957 -11.148 1.00 . A A . 4 SER HB3 1 1
18 3945 1 1 4 SER HG H 1.879 0.829 -12.355 1.00 . A A . 4 SER HG 1 1
18 3946 1 1 4 SER N N 3.472 -1.268 -9.212 1.00 . A A . 4 SER N 1 1
18 3947 1 1 4 SER O O 1.693 1.606 -10.274 1.00 . A A . 4 SER O 1 1
18 3948 1 1 4 SER OG O 2.548 0.153 -12.491 1.00 . A A . 4 SER OG 1 1
18 3949 1 1 5 GLY C C 0.487 2.088 -7.643 1.00 . A A . 5 GLY C 1 1
18 3950 1 1 5 GLY CA C 1.991 2.264 -7.621 1.00 . A A . 5 GLY CA 1 1
18 3951 1 1 5 GLY H H 3.320 0.626 -7.804 1.00 . A A . 5 GLY H 1 1
18 3952 1 1 5 GLY HA2 H 2.324 2.303 -6.596 1.00 . A A . 5 GLY HA2 1 1
18 3953 1 1 5 GLY HA3 H 2.240 3.197 -8.106 1.00 . A A . 5 GLY HA3 1 1
18 3954 1 1 5 GLY N N 2.686 1.185 -8.300 1.00 . A A . 5 GLY N 1 1
18 3955 1 1 5 GLY O O -0.261 3.047 -7.447 1.00 . A A . 5 GLY O 1 1
18 3956 1 1 6 CYS C C -2.074 0.971 -6.632 1.00 . A A . 6 CYS C 1 1
18 3957 1 1 6 CYS CA C -1.387 0.561 -7.933 1.00 . A A . 6 CYS CA 1 1
18 3958 1 1 6 CYS CB C -1.608 -0.931 -8.191 1.00 . A A . 6 CYS CB 1 1
18 3959 1 1 6 CYS H H 0.684 0.136 -8.032 1.00 . A A . 6 CYS H 1 1
18 3960 1 1 6 CYS HA H -1.817 1.126 -8.746 1.00 . A A . 6 CYS HA 1 1
18 3961 1 1 6 CYS HB2 H -0.802 -1.490 -7.737 1.00 . A A . 6 CYS HB2 1 1
18 3962 1 1 6 CYS HB3 H -2.544 -1.232 -7.744 1.00 . A A . 6 CYS HB3 1 1
18 3963 1 1 6 CYS N N 0.039 0.860 -7.883 1.00 . A A . 6 CYS N 1 1
18 3964 1 1 6 CYS O O -1.424 1.428 -5.693 1.00 . A A . 6 CYS O 1 1
18 3965 1 1 6 CYS SG S -1.665 -1.379 -9.955 1.00 . A A . 6 CYS SG 1 1
18 3966 1 1 7 ARG C C -4.493 -0.087 -4.579 1.00 . A A . 7 ARG C 1 1
18 3967 1 1 7 ARG CA C -4.166 1.154 -5.404 1.00 . A A . 7 ARG CA 1 1
18 3968 1 1 7 ARG CB C -5.458 1.865 -5.808 1.00 . A A . 7 ARG CB 1 1
18 3969 1 1 7 ARG CD C -4.944 4.291 -5.391 1.00 . A A . 7 ARG CD 1 1
18 3970 1 1 7 ARG CG C -5.230 3.229 -6.441 1.00 . A A . 7 ARG CG 1 1
18 3971 1 1 7 ARG CZ C -6.896 5.782 -5.487 1.00 . A A . 7 ARG CZ 1 1
18 3972 1 1 7 ARG H H -3.853 0.431 -7.369 1.00 . A A . 7 ARG H 1 1
18 3973 1 1 7 ARG HA H -3.569 1.824 -4.804 1.00 . A A . 7 ARG HA 1 1
18 3974 1 1 7 ARG HB2 H -5.990 1.248 -6.518 1.00 . A A . 7 ARG HB2 1 1
18 3975 1 1 7 ARG HB3 H -6.072 1.999 -4.930 1.00 . A A . 7 ARG HB3 1 1
18 3976 1 1 7 ARG HD2 H -4.385 3.838 -4.585 1.00 . A A . 7 ARG HD2 1 1
18 3977 1 1 7 ARG HD3 H -4.356 5.075 -5.842 1.00 . A A . 7 ARG HD3 1 1
18 3978 1 1 7 ARG HE H -6.467 4.562 -3.968 1.00 . A A . 7 ARG HE 1 1
18 3979 1 1 7 ARG HG2 H -4.388 3.167 -7.113 1.00 . A A . 7 ARG HG2 1 1
18 3980 1 1 7 ARG HG3 H -6.114 3.510 -6.994 1.00 . A A . 7 ARG HG3 1 1
18 3981 1 1 7 ARG HH11 H -5.689 5.856 -7.104 1.00 . A A . 7 ARG HH11 1 1
18 3982 1 1 7 ARG HH12 H -7.067 6.903 -7.160 1.00 . A A . 7 ARG HH12 1 1
18 3983 1 1 7 ARG HH21 H -8.287 5.936 -4.029 1.00 . A A . 7 ARG HH21 1 1
18 3984 1 1 7 ARG HH22 H -8.545 6.948 -5.409 1.00 . A A . 7 ARG HH22 1 1
18 3985 1 1 7 ARG N N -3.391 0.802 -6.587 1.00 . A A . 7 ARG N 1 1
18 3986 1 1 7 ARG NE N -6.171 4.869 -4.850 1.00 . A A . 7 ARG NE 1 1
18 3987 1 1 7 ARG NH1 N -6.520 6.216 -6.681 1.00 . A A . 7 ARG NH1 1 1
18 3988 1 1 7 ARG NH2 N -8.001 6.262 -4.929 1.00 . A A . 7 ARG NH2 1 1
18 3989 1 1 7 ARG O O -4.623 -1.187 -5.116 1.00 . A A . 7 ARG O 1 1
18 3990 1 1 8 LYS C C -6.441 -1.259 -2.319 1.00 . A A . 8 LYS C 1 1
18 3991 1 1 8 LYS CA C -4.938 -1.006 -2.369 1.00 . A A . 8 LYS CA 1 1
18 3992 1 1 8 LYS CB C -4.412 -0.708 -0.962 1.00 . A A . 8 LYS CB 1 1
18 3993 1 1 8 LYS CD C -2.363 -0.556 0.483 1.00 . A A . 8 LYS CD 1 1
18 3994 1 1 8 LYS CE C -2.961 -1.045 1.793 1.00 . A A . 8 LYS CE 1 1
18 3995 1 1 8 LYS CG C -3.010 -1.236 -0.712 1.00 . A A . 8 LYS CG 1 1
18 3996 1 1 8 LYS H H -4.509 0.998 -2.899 1.00 . A A . 8 LYS H 1 1
18 3997 1 1 8 LYS HA H -4.448 -1.891 -2.746 1.00 . A A . 8 LYS HA 1 1
18 3998 1 1 8 LYS HB2 H -4.404 0.361 -0.813 1.00 . A A . 8 LYS HB2 1 1
18 3999 1 1 8 LYS HB3 H -5.078 -1.159 -0.240 1.00 . A A . 8 LYS HB3 1 1
18 4000 1 1 8 LYS HD2 H -1.305 -0.772 0.481 1.00 . A A . 8 LYS HD2 1 1
18 4001 1 1 8 LYS HD3 H -2.514 0.511 0.404 1.00 . A A . 8 LYS HD3 1 1
18 4002 1 1 8 LYS HE2 H -3.995 -0.738 1.838 1.00 . A A . 8 LYS HE2 1 1
18 4003 1 1 8 LYS HE3 H -2.903 -2.123 1.821 1.00 . A A . 8 LYS HE3 1 1
18 4004 1 1 8 LYS HG2 H -3.064 -2.298 -0.523 1.00 . A A . 8 LYS HG2 1 1
18 4005 1 1 8 LYS HG3 H -2.405 -1.055 -1.589 1.00 . A A . 8 LYS HG3 1 1
18 4006 1 1 8 LYS HZ1 H -1.657 -1.231 3.414 1.00 . A A . 8 LYS HZ1 1 1
18 4007 1 1 8 LYS HZ2 H -2.921 -0.138 3.674 1.00 . A A . 8 LYS HZ2 1 1
18 4008 1 1 8 LYS HZ3 H -1.623 0.293 2.678 1.00 . A A . 8 LYS HZ3 1 1
18 4009 1 1 8 LYS N N -4.624 0.096 -3.269 1.00 . A A . 8 LYS N 1 1
18 4010 1 1 8 LYS NZ N -2.240 -0.491 2.973 1.00 . A A . 8 LYS NZ 1 1
18 4011 1 1 8 LYS O O -7.241 -0.352 -2.551 1.00 . A A . 8 LYS O 1 1
18 4012 1 1 9 LYS C C -8.535 -3.530 -0.590 1.00 . A A . 9 LYS C 1 1
18 4013 1 1 9 LYS CA C -8.226 -2.867 -1.929 1.00 . A A . 9 LYS CA 1 1
18 4014 1 1 9 LYS CB C -8.594 -3.812 -3.075 1.00 . A A . 9 LYS CB 1 1
18 4015 1 1 9 LYS CD C -8.501 -4.306 -5.536 1.00 . A A . 9 LYS CD 1 1
18 4016 1 1 9 LYS CE C -7.887 -5.688 -5.380 1.00 . A A . 9 LYS CE 1 1
18 4017 1 1 9 LYS CG C -8.056 -3.370 -4.424 1.00 . A A . 9 LYS CG 1 1
18 4018 1 1 9 LYS H H -6.134 -3.175 -1.838 1.00 . A A . 9 LYS H 1 1
18 4019 1 1 9 LYS HA H -8.813 -1.965 -2.014 1.00 . A A . 9 LYS HA 1 1
18 4020 1 1 9 LYS HB2 H -8.199 -4.794 -2.857 1.00 . A A . 9 LYS HB2 1 1
18 4021 1 1 9 LYS HB3 H -9.671 -3.874 -3.143 1.00 . A A . 9 LYS HB3 1 1
18 4022 1 1 9 LYS HD2 H -9.576 -4.397 -5.509 1.00 . A A . 9 LYS HD2 1 1
18 4023 1 1 9 LYS HD3 H -8.196 -3.891 -6.487 1.00 . A A . 9 LYS HD3 1 1
18 4024 1 1 9 LYS HE2 H -7.708 -6.101 -6.361 1.00 . A A . 9 LYS HE2 1 1
18 4025 1 1 9 LYS HE3 H -6.949 -5.594 -4.854 1.00 . A A . 9 LYS HE3 1 1
18 4026 1 1 9 LYS HG2 H -8.418 -2.376 -4.639 1.00 . A A . 9 LYS HG2 1 1
18 4027 1 1 9 LYS HG3 H -6.976 -3.361 -4.385 1.00 . A A . 9 LYS HG3 1 1
18 4028 1 1 9 LYS HZ1 H -8.240 -7.091 -3.874 1.00 . A A . 9 LYS HZ1 1 1
18 4029 1 1 9 LYS HZ2 H -9.179 -7.326 -5.260 1.00 . A A . 9 LYS HZ2 1 1
18 4030 1 1 9 LYS HZ3 H -9.556 -6.074 -4.185 1.00 . A A . 9 LYS HZ3 1 1
18 4031 1 1 9 LYS N N -6.818 -2.496 -2.012 1.00 . A A . 9 LYS N 1 1
18 4032 1 1 9 LYS NZ N -8.778 -6.609 -4.622 1.00 . A A . 9 LYS NZ 1 1
18 4033 1 1 9 LYS O O -7.646 -4.078 0.061 1.00 . A A . 9 LYS O 1 1
18 4034 1 1 10 ARG C C -9.931 -5.571 1.095 1.00 . A A . 10 ARG C 1 1
18 4035 1 1 10 ARG CA C -10.226 -4.073 1.074 1.00 . A A . 10 ARG CA 1 1
18 4036 1 1 10 ARG CB C -11.719 -3.833 1.297 1.00 . A A . 10 ARG CB 1 1
18 4037 1 1 10 ARG CD C -12.963 -3.510 -0.864 1.00 . A A . 10 ARG CD 1 1
18 4038 1 1 10 ARG CG C -12.605 -4.485 0.247 1.00 . A A . 10 ARG CG 1 1
18 4039 1 1 10 ARG CZ C -14.811 -3.097 -2.431 1.00 . A A . 10 ARG CZ 1 1
18 4040 1 1 10 ARG H H -10.463 -3.027 -0.750 1.00 . A A . 10 ARG H 1 1
18 4041 1 1 10 ARG HA H -9.671 -3.598 1.869 1.00 . A A . 10 ARG HA 1 1
18 4042 1 1 10 ARG HB2 H -11.995 -4.228 2.264 1.00 . A A . 10 ARG HB2 1 1
18 4043 1 1 10 ARG HB3 H -11.907 -2.770 1.285 1.00 . A A . 10 ARG HB3 1 1
18 4044 1 1 10 ARG HD2 H -13.030 -2.517 -0.444 1.00 . A A . 10 ARG HD2 1 1
18 4045 1 1 10 ARG HD3 H -12.183 -3.533 -1.609 1.00 . A A . 10 ARG HD3 1 1
18 4046 1 1 10 ARG HE H -14.682 -4.668 -1.211 1.00 . A A . 10 ARG HE 1 1
18 4047 1 1 10 ARG HG2 H -12.079 -5.325 -0.182 1.00 . A A . 10 ARG HG2 1 1
18 4048 1 1 10 ARG HG3 H -13.513 -4.829 0.720 1.00 . A A . 10 ARG HG3 1 1
18 4049 1 1 10 ARG HH11 H -13.356 -1.695 -2.442 1.00 . A A . 10 ARG HH11 1 1
18 4050 1 1 10 ARG HH12 H -14.665 -1.415 -3.542 1.00 . A A . 10 ARG HH12 1 1
18 4051 1 1 10 ARG HH21 H -16.411 -4.312 -2.656 1.00 . A A . 10 ARG HH21 1 1
18 4052 1 1 10 ARG HH22 H -16.402 -2.904 -3.663 1.00 . A A . 10 ARG HH22 1 1
18 4053 1 1 10 ARG N N -9.800 -3.477 -0.187 1.00 . A A . 10 ARG N 1 1
18 4054 1 1 10 ARG NE N -14.235 -3.845 -1.497 1.00 . A A . 10 ARG NE 1 1
18 4055 1 1 10 ARG NH1 N -14.230 -1.976 -2.839 1.00 . A A . 10 ARG NH1 1 1
18 4056 1 1 10 ARG NH2 N -15.969 -3.468 -2.960 1.00 . A A . 10 ARG NH2 1 1
18 4057 1 1 10 ARG O O -9.842 -6.181 2.160 1.00 . A A . 10 ARG O 1 1
18 4058 1 1 11 HIS C C -8.029 -7.869 0.093 1.00 . A A . 11 HIS C 1 1
18 4059 1 1 11 HIS CA C -9.497 -7.581 -0.207 1.00 . A A . 11 HIS CA 1 1
18 4060 1 1 11 HIS CB C -9.850 -8.079 -1.609 1.00 . A A . 11 HIS CB 1 1
18 4061 1 1 11 HIS CD2 C -12.216 -7.117 -2.059 1.00 . A A . 11 HIS CD2 1 1
18 4062 1 1 11 HIS CE1 C -13.307 -9.012 -2.224 1.00 . A A . 11 HIS CE1 1 1
18 4063 1 1 11 HIS CG C -11.323 -8.117 -1.878 1.00 . A A . 11 HIS CG 1 1
18 4064 1 1 11 HIS H H -9.864 -5.615 -0.903 1.00 . A A . 11 HIS H 1 1
18 4065 1 1 11 HIS HA H -10.108 -8.102 0.514 1.00 . A A . 11 HIS HA 1 1
18 4066 1 1 11 HIS HB2 H -9.397 -7.426 -2.341 1.00 . A A . 11 HIS HB2 1 1
18 4067 1 1 11 HIS HB3 H -9.462 -9.079 -1.738 1.00 . A A . 11 HIS HB3 1 1
18 4068 1 1 11 HIS HD1 H -11.669 -10.196 -1.902 1.00 . A A . 11 HIS HD1 1 1
18 4069 1 1 11 HIS HD2 H -12.006 -6.057 -2.040 1.00 . A A . 11 HIS HD2 1 1
18 4070 1 1 11 HIS HE1 H -14.099 -9.733 -2.355 1.00 . A A . 11 HIS HE1 1 1
18 4071 1 1 11 HIS N N -9.782 -6.155 -0.090 1.00 . A A . 11 HIS N 1 1
18 4072 1 1 11 HIS ND1 N -12.037 -9.292 -1.986 1.00 . A A . 11 HIS ND1 1 1
18 4073 1 1 11 HIS NE2 N -13.442 -7.700 -2.272 1.00 . A A . 11 HIS NE2 1 1
18 4074 1 1 11 HIS O O -7.652 -9.008 0.364 1.00 . A A . 11 HIS O 1 1
18 4075 1 1 12 GLY C C -4.949 -6.937 -0.953 1.00 . A A . 12 GLY C 1 1
18 4076 1 1 12 GLY CA C -5.787 -6.990 0.309 1.00 . A A . 12 GLY CA 1 1
18 4077 1 1 12 GLY H H -7.560 -5.941 -0.181 1.00 . A A . 12 GLY H 1 1
18 4078 1 1 12 GLY HA2 H -5.466 -6.203 0.976 1.00 . A A . 12 GLY HA2 1 1
18 4079 1 1 12 GLY HA3 H -5.631 -7.943 0.792 1.00 . A A . 12 GLY HA3 1 1
18 4080 1 1 12 GLY N N -7.204 -6.827 0.041 1.00 . A A . 12 GLY N 1 1
18 4081 1 1 12 GLY O O -3.736 -6.741 -0.894 1.00 . A A . 12 GLY O 1 1
18 4082 1 1 13 GLY C C -4.654 -5.671 -3.866 1.00 . A A . 13 GLY C 1 1
18 4083 1 1 13 GLY CA C -4.887 -7.083 -3.366 1.00 . A A . 13 GLY CA 1 1
18 4084 1 1 13 GLY H H -6.565 -7.266 -2.088 1.00 . A A . 13 GLY H 1 1
18 4085 1 1 13 GLY HA2 H -3.933 -7.572 -3.242 1.00 . A A . 13 GLY HA2 1 1
18 4086 1 1 13 GLY HA3 H -5.465 -7.622 -4.103 1.00 . A A . 13 GLY HA3 1 1
18 4087 1 1 13 GLY N N -5.597 -7.113 -2.100 1.00 . A A . 13 GLY N 1 1
18 4088 1 1 13 GLY O O -4.846 -4.704 -3.129 1.00 . A A . 13 GLY O 1 1
18 4089 1 1 14 CYS C C -4.823 -4.044 -6.972 1.00 . A A . 14 CYS C 1 1
18 4090 1 1 14 CYS CA C -3.975 -4.249 -5.721 1.00 . A A . 14 CYS CA 1 1
18 4091 1 1 14 CYS CB C -2.491 -4.113 -6.069 1.00 . A A . 14 CYS CB 1 1
18 4092 1 1 14 CYS H H -4.103 -6.360 -5.661 1.00 . A A . 14 CYS H 1 1
18 4093 1 1 14 CYS HA H -4.237 -3.492 -4.996 1.00 . A A . 14 CYS HA 1 1
18 4094 1 1 14 CYS HB2 H -2.251 -4.806 -6.862 1.00 . A A . 14 CYS HB2 1 1
18 4095 1 1 14 CYS HB3 H -2.299 -3.106 -6.407 1.00 . A A . 14 CYS HB3 1 1
18 4096 1 1 14 CYS N N -4.237 -5.551 -5.123 1.00 . A A . 14 CYS N 1 1
18 4097 1 1 14 CYS O O -4.792 -4.858 -7.895 1.00 . A A . 14 CYS O 1 1
18 4098 1 1 14 CYS SG S -1.367 -4.456 -4.677 1.00 . A A . 14 CYS SG 1 1
18 4099 1 1 15 SER C C -5.631 -2.021 -9.271 1.00 . A A . 15 SER C 1 1
18 4100 1 1 15 SER CA C -6.438 -2.641 -8.133 1.00 . A A . 15 SER CA 1 1
18 4101 1 1 15 SER CB C -7.557 -1.687 -7.709 1.00 . A A . 15 SER CB 1 1
18 4102 1 1 15 SER H H -5.559 -2.340 -6.230 1.00 . A A . 15 SER H 1 1
18 4103 1 1 15 SER HA H -6.877 -3.564 -8.479 1.00 . A A . 15 SER HA 1 1
18 4104 1 1 15 SER HB2 H -7.872 -1.930 -6.705 1.00 . A A . 15 SER HB2 1 1
18 4105 1 1 15 SER HB3 H -7.189 -0.672 -7.734 1.00 . A A . 15 SER HB3 1 1
18 4106 1 1 15 SER HG H -9.262 -1.048 -8.431 1.00 . A A . 15 SER HG 1 1
18 4107 1 1 15 SER N N -5.579 -2.951 -6.996 1.00 . A A . 15 SER N 1 1
18 4108 1 1 15 SER O O -5.162 -0.887 -9.169 1.00 . A A . 15 SER O 1 1
18 4109 1 1 15 SER OG O -8.672 -1.791 -8.576 1.00 . A A . 15 SER OG 1 1
18 4110 1 1 16 CYS C C -5.588 -2.341 -12.771 1.00 . A A . 16 CYS C 1 1
18 4111 1 1 16 CYS CA C -4.725 -2.302 -11.512 1.00 . A A . 16 CYS CA 1 1
18 4112 1 1 16 CYS CB C -3.471 -3.153 -11.715 1.00 . A A . 16 CYS CB 1 1
18 4113 1 1 16 CYS H H -5.873 -3.671 -10.376 1.00 . A A . 16 CYS H 1 1
18 4114 1 1 16 CYS HA H -4.431 -1.282 -11.324 1.00 . A A . 16 CYS HA 1 1
18 4115 1 1 16 CYS HB2 H -3.763 -4.144 -12.033 1.00 . A A . 16 CYS HB2 1 1
18 4116 1 1 16 CYS HB3 H -2.858 -2.702 -12.482 1.00 . A A . 16 CYS HB3 1 1
18 4117 1 1 16 CYS N N -5.475 -2.775 -10.354 1.00 . A A . 16 CYS N 1 1
18 4118 1 1 16 CYS O O -6.472 -3.186 -12.904 1.00 . A A . 16 CYS O 1 1
18 4119 1 1 16 CYS SG S -2.444 -3.333 -10.221 1.00 . A A . 16 CYS SG 1 1
18 4120 1 1 17 NH2 HN1 H -5.837 -1.371 -14.547 1.00 . A A . 17 NH2 HN1 1 1
18 4121 1 1 17 NH2 HN2 H -4.605 -0.772 -13.528 1.00 . A A . 17 NH2 HN2 1 1
18 4122 1 1 17 NH2 N N -5.323 -1.419 -13.691 1.00 . A A . 17 NH2 N 1 1
19 4123 1 1 1 TRP C C 1.775 -1.410 -2.162 1.00 . A A . 1 TRP C 1 1
19 4124 1 1 1 TRP CA C 2.210 -0.309 -1.202 1.00 . A A . 1 TRP CA 1 1
19 4125 1 1 1 TRP CB C 3.719 -0.392 -0.961 1.00 . A A . 1 TRP CB 1 1
19 4126 1 1 1 TRP CD1 C 5.180 0.956 -2.579 1.00 . A A . 1 TRP CD1 1 1
19 4127 1 1 1 TRP CD2 C 4.778 -1.148 -3.234 1.00 . A A . 1 TRP CD2 1 1
19 4128 1 1 1 TRP CE2 C 5.586 -0.521 -4.203 1.00 . A A . 1 TRP CE2 1 1
19 4129 1 1 1 TRP CE3 C 4.399 -2.478 -3.433 1.00 . A A . 1 TRP CE3 1 1
19 4130 1 1 1 TRP CG C 4.531 -0.185 -2.203 1.00 . A A . 1 TRP CG 1 1
19 4131 1 1 1 TRP CH2 C 5.631 -2.481 -5.520 1.00 . A A . 1 TRP CH2 1 1
19 4132 1 1 1 TRP CZ2 C 6.018 -1.180 -5.351 1.00 . A A . 1 TRP CZ2 1 1
19 4133 1 1 1 TRP CZ3 C 4.828 -3.130 -4.572 1.00 . A A . 1 TRP CZ3 1 1
19 4134 1 1 1 TRP H1 H 1.744 -1.101 0.706 1.00 . A A . 1 TRP H1 1 1
19 4135 1 1 1 TRP HA H 1.978 0.649 -1.643 1.00 . A A . 1 TRP HA 1 1
19 4136 1 1 1 TRP HB2 H 4.005 0.366 -0.246 1.00 . A A . 1 TRP HB2 1 1
19 4137 1 1 1 TRP HB3 H 3.959 -1.367 -0.562 1.00 . A A . 1 TRP HB3 1 1
19 4138 1 1 1 TRP HD1 H 5.182 1.871 -2.005 1.00 . A A . 1 TRP HD1 1 1
19 4139 1 1 1 TRP HE1 H 6.351 1.432 -4.257 1.00 . A A . 1 TRP HE1 1 1
19 4140 1 1 1 TRP HE3 H 3.780 -2.995 -2.714 1.00 . A A . 1 TRP HE3 1 1
19 4141 1 1 1 TRP HH2 H 5.943 -3.029 -6.396 1.00 . A A . 1 TRP HH2 1 1
19 4142 1 1 1 TRP HZ2 H 6.638 -0.694 -6.091 1.00 . A A . 1 TRP HZ2 1 1
19 4143 1 1 1 TRP HZ3 H 4.544 -4.158 -4.743 1.00 . A A . 1 TRP HZ3 1 1
19 4144 1 1 1 TRP N N 1.490 -0.406 0.062 1.00 . A A . 1 TRP N 1 1
19 4145 1 1 1 TRP NE1 N 5.817 0.762 -3.780 1.00 . A A . 1 TRP NE1 1 1
19 4146 1 1 1 TRP O O 1.687 -2.579 -1.783 1.00 . A A . 1 TRP O 1 1
19 4147 1 1 2 CYS C C 2.022 -1.962 -5.624 1.00 . A A . 2 CYS C 1 1
19 4148 1 1 2 CYS CA C 1.081 -1.988 -4.423 1.00 . A A . 2 CYS CA 1 1
19 4149 1 1 2 CYS CB C -0.348 -1.682 -4.874 1.00 . A A . 2 CYS CB 1 1
19 4150 1 1 2 CYS H H 1.596 -0.086 -3.650 1.00 . A A . 2 CYS H 1 1
19 4151 1 1 2 CYS HA H 1.107 -2.974 -3.982 1.00 . A A . 2 CYS HA 1 1
19 4152 1 1 2 CYS HB2 H -0.575 -0.649 -4.650 1.00 . A A . 2 CYS HB2 1 1
19 4153 1 1 2 CYS HB3 H -0.423 -1.839 -5.940 1.00 . A A . 2 CYS HB3 1 1
19 4154 1 1 2 CYS N N 1.507 -1.033 -3.407 1.00 . A A . 2 CYS N 1 1
19 4155 1 1 2 CYS O O 2.887 -1.093 -5.728 1.00 . A A . 2 CYS O 1 1
19 4156 1 1 2 CYS SG S -1.619 -2.713 -4.072 1.00 . A A . 2 CYS SG 1 1
19 4157 1 1 3 ALA C C 2.483 -1.785 -8.614 1.00 . A A . 3 ALA C 1 1
19 4158 1 1 3 ALA CA C 2.678 -3.006 -7.722 1.00 . A A . 3 ALA CA 1 1
19 4159 1 1 3 ALA CB C 2.366 -4.280 -8.491 1.00 . A A . 3 ALA CB 1 1
19 4160 1 1 3 ALA H H 1.140 -3.585 -6.388 1.00 . A A . 3 ALA H 1 1
19 4161 1 1 3 ALA HA H 3.710 -3.047 -7.407 1.00 . A A . 3 ALA HA 1 1
19 4162 1 1 3 ALA HB1 H 2.628 -5.137 -7.888 1.00 . A A . 3 ALA HB1 1 1
19 4163 1 1 3 ALA HB2 H 1.311 -4.311 -8.723 1.00 . A A . 3 ALA HB2 1 1
19 4164 1 1 3 ALA HB3 H 2.937 -4.296 -9.407 1.00 . A A . 3 ALA HB3 1 1
19 4165 1 1 3 ALA N N 1.846 -2.921 -6.528 1.00 . A A . 3 ALA N 1 1
19 4166 1 1 3 ALA O O 1.356 -1.337 -8.833 1.00 . A A . 3 ALA O 1 1
19 4167 1 1 4 SER C C 2.767 1.058 -9.326 1.00 . A A . 4 SER C 1 1
19 4168 1 1 4 SER CA C 3.536 -0.078 -9.992 1.00 . A A . 4 SER CA 1 1
19 4169 1 1 4 SER CB C 2.887 -0.433 -11.331 1.00 . A A . 4 SER CB 1 1
19 4170 1 1 4 SER H H 4.454 -1.653 -8.915 1.00 . A A . 4 SER H 1 1
19 4171 1 1 4 SER HA H 4.552 0.246 -10.170 1.00 . A A . 4 SER HA 1 1
19 4172 1 1 4 SER HB2 H 3.010 -1.489 -11.520 1.00 . A A . 4 SER HB2 1 1
19 4173 1 1 4 SER HB3 H 1.833 -0.196 -11.290 1.00 . A A . 4 SER HB3 1 1
19 4174 1 1 4 SER HG H 2.836 0.907 -12.759 1.00 . A A . 4 SER HG 1 1
19 4175 1 1 4 SER N N 3.586 -1.250 -9.127 1.00 . A A . 4 SER N 1 1
19 4176 1 1 4 SER O O 2.138 1.875 -9.997 1.00 . A A . 4 SER O 1 1
19 4177 1 1 4 SER OG O 3.477 0.293 -12.395 1.00 . A A . 4 SER OG 1 1
19 4178 1 1 5 GLY C C 0.623 2.085 -7.460 1.00 . A A . 5 GLY C 1 1
19 4179 1 1 5 GLY CA C 2.125 2.140 -7.261 1.00 . A A . 5 GLY CA 1 1
19 4180 1 1 5 GLY H H 3.338 0.423 -7.515 1.00 . A A . 5 GLY H 1 1
19 4181 1 1 5 GLY HA2 H 2.343 2.028 -6.209 1.00 . A A . 5 GLY HA2 1 1
19 4182 1 1 5 GLY HA3 H 2.485 3.103 -7.592 1.00 . A A . 5 GLY HA3 1 1
19 4183 1 1 5 GLY N N 2.821 1.102 -7.998 1.00 . A A . 5 GLY N 1 1
19 4184 1 1 5 GLY O O -0.046 3.119 -7.483 1.00 . A A . 5 GLY O 1 1
19 4185 1 1 6 CYS C C -2.113 0.998 -6.528 1.00 . A A . 6 CYS C 1 1
19 4186 1 1 6 CYS CA C -1.340 0.690 -7.807 1.00 . A A . 6 CYS CA 1 1
19 4187 1 1 6 CYS CB C -1.631 -0.744 -8.259 1.00 . A A . 6 CYS CB 1 1
19 4188 1 1 6 CYS H H 0.676 0.090 -7.579 1.00 . A A . 6 CYS H 1 1
19 4189 1 1 6 CYS HA H -1.660 1.372 -8.579 1.00 . A A . 6 CYS HA 1 1
19 4190 1 1 6 CYS HB2 H -0.874 -1.400 -7.854 1.00 . A A . 6 CYS HB2 1 1
19 4191 1 1 6 CYS HB3 H -2.598 -1.043 -7.882 1.00 . A A . 6 CYS HB3 1 1
19 4192 1 1 6 CYS N N 0.092 0.876 -7.607 1.00 . A A . 6 CYS N 1 1
19 4193 1 1 6 CYS O O -1.522 1.286 -5.487 1.00 . A A . 6 CYS O 1 1
19 4194 1 1 6 CYS SG S -1.644 -0.965 -10.067 1.00 . A A . 6 CYS SG 1 1
19 4195 1 1 7 ARG C C -4.642 -0.083 -4.728 1.00 . A A . 7 ARG C 1 1
19 4196 1 1 7 ARG CA C -4.292 1.207 -5.464 1.00 . A A . 7 ARG CA 1 1
19 4197 1 1 7 ARG CB C -5.573 1.915 -5.911 1.00 . A A . 7 ARG CB 1 1
19 4198 1 1 7 ARG CD C -5.514 4.112 -4.693 1.00 . A A . 7 ARG CD 1 1
19 4199 1 1 7 ARG CG C -5.422 3.421 -6.044 1.00 . A A . 7 ARG CG 1 1
19 4200 1 1 7 ARG CZ C -6.793 6.160 -5.155 1.00 . A A . 7 ARG CZ 1 1
19 4201 1 1 7 ARG H H -3.852 0.698 -7.471 1.00 . A A . 7 ARG H 1 1
19 4202 1 1 7 ARG HA H -3.749 1.854 -4.793 1.00 . A A . 7 ARG HA 1 1
19 4203 1 1 7 ARG HB2 H -5.874 1.520 -6.869 1.00 . A A . 7 ARG HB2 1 1
19 4204 1 1 7 ARG HB3 H -6.350 1.715 -5.188 1.00 . A A . 7 ARG HB3 1 1
19 4205 1 1 7 ARG HD2 H -6.371 3.724 -4.163 1.00 . A A . 7 ARG HD2 1 1
19 4206 1 1 7 ARG HD3 H -4.617 3.897 -4.131 1.00 . A A . 7 ARG HD3 1 1
19 4207 1 1 7 ARG HE H -4.861 6.110 -4.663 1.00 . A A . 7 ARG HE 1 1
19 4208 1 1 7 ARG HG2 H -4.459 3.640 -6.482 1.00 . A A . 7 ARG HG2 1 1
19 4209 1 1 7 ARG HG3 H -6.204 3.797 -6.686 1.00 . A A . 7 ARG HG3 1 1
19 4210 1 1 7 ARG HH11 H -7.851 4.445 -5.305 1.00 . A A . 7 ARG HH11 1 1
19 4211 1 1 7 ARG HH12 H -8.740 5.897 -5.628 1.00 . A A . 7 ARG HH12 1 1
19 4212 1 1 7 ARG HH21 H -6.021 8.028 -5.087 1.00 . A A . 7 ARG HH21 1 1
19 4213 1 1 7 ARG HH22 H -7.699 7.933 -5.505 1.00 . A A . 7 ARG HH22 1 1
19 4214 1 1 7 ARG N N -3.438 0.933 -6.613 1.00 . A A . 7 ARG N 1 1
19 4215 1 1 7 ARG NE N -5.654 5.560 -4.826 1.00 . A A . 7 ARG NE 1 1
19 4216 1 1 7 ARG NH1 N -7.884 5.442 -5.381 1.00 . A A . 7 ARG NH1 1 1
19 4217 1 1 7 ARG NH2 N -6.842 7.483 -5.257 1.00 . A A . 7 ARG NH2 1 1
19 4218 1 1 7 ARG O O -4.910 -1.112 -5.348 1.00 . A A . 7 ARG O 1 1
19 4219 1 1 8 LYS C C -6.451 -1.471 -2.599 1.00 . A A . 8 LYS C 1 1
19 4220 1 1 8 LYS CA C -4.954 -1.183 -2.578 1.00 . A A . 8 LYS CA 1 1
19 4221 1 1 8 LYS CB C -4.486 -0.957 -1.139 1.00 . A A . 8 LYS CB 1 1
19 4222 1 1 8 LYS CD C -3.230 -3.019 -0.449 1.00 . A A . 8 LYS CD 1 1
19 4223 1 1 8 LYS CE C -2.068 -3.448 0.434 1.00 . A A . 8 LYS CE 1 1
19 4224 1 1 8 LYS CG C -3.123 -1.556 -0.841 1.00 . A A . 8 LYS CG 1 1
19 4225 1 1 8 LYS H H -4.414 0.828 -2.963 1.00 . A A . 8 LYS H 1 1
19 4226 1 1 8 LYS HA H -4.429 -2.032 -2.989 1.00 . A A . 8 LYS HA 1 1
19 4227 1 1 8 LYS HB2 H -4.438 0.106 -0.951 1.00 . A A . 8 LYS HB2 1 1
19 4228 1 1 8 LYS HB3 H -5.206 -1.400 -0.466 1.00 . A A . 8 LYS HB3 1 1
19 4229 1 1 8 LYS HD2 H -4.153 -3.172 0.091 1.00 . A A . 8 LYS HD2 1 1
19 4230 1 1 8 LYS HD3 H -3.232 -3.623 -1.346 1.00 . A A . 8 LYS HD3 1 1
19 4231 1 1 8 LYS HE2 H -1.939 -2.715 1.216 1.00 . A A . 8 LYS HE2 1 1
19 4232 1 1 8 LYS HE3 H -2.302 -4.407 0.873 1.00 . A A . 8 LYS HE3 1 1
19 4233 1 1 8 LYS HG2 H -2.503 -1.475 -1.722 1.00 . A A . 8 LYS HG2 1 1
19 4234 1 1 8 LYS HG3 H -2.669 -1.008 -0.028 1.00 . A A . 8 LYS HG3 1 1
19 4235 1 1 8 LYS HZ1 H -0.655 -2.711 -0.916 1.00 . A A . 8 LYS HZ1 1 1
19 4236 1 1 8 LYS HZ2 H -0.838 -4.391 -0.965 1.00 . A A . 8 LYS HZ2 1 1
19 4237 1 1 8 LYS HZ3 H 0.005 -3.670 0.313 1.00 . A A . 8 LYS HZ3 1 1
19 4238 1 1 8 LYS N N -4.637 -0.020 -3.401 1.00 . A A . 8 LYS N 1 1
19 4239 1 1 8 LYS NZ N -0.799 -3.564 -0.338 1.00 . A A . 8 LYS NZ 1 1
19 4240 1 1 8 LYS O O -7.245 -0.657 -3.071 1.00 . A A . 8 LYS O 1 1
19 4241 1 1 9 LYS C C -8.590 -3.620 -0.677 1.00 . A A . 9 LYS C 1 1
19 4242 1 1 9 LYS CA C -8.234 -3.030 -2.038 1.00 . A A . 9 LYS CA 1 1
19 4243 1 1 9 LYS CB C -8.533 -4.049 -3.141 1.00 . A A . 9 LYS CB 1 1
19 4244 1 1 9 LYS CD C -8.547 -4.538 -5.605 1.00 . A A . 9 LYS CD 1 1
19 4245 1 1 9 LYS CE C -8.128 -5.986 -5.397 1.00 . A A . 9 LYS CE 1 1
19 4246 1 1 9 LYS CG C -8.006 -3.639 -4.506 1.00 . A A . 9 LYS CG 1 1
19 4247 1 1 9 LYS H H -6.152 -3.242 -1.721 1.00 . A A . 9 LYS H 1 1
19 4248 1 1 9 LYS HA H -8.834 -2.148 -2.203 1.00 . A A . 9 LYS HA 1 1
19 4249 1 1 9 LYS HB2 H -8.085 -4.994 -2.873 1.00 . A A . 9 LYS HB2 1 1
19 4250 1 1 9 LYS HB3 H -9.603 -4.177 -3.215 1.00 . A A . 9 LYS HB3 1 1
19 4251 1 1 9 LYS HD2 H -9.625 -4.484 -5.605 1.00 . A A . 9 LYS HD2 1 1
19 4252 1 1 9 LYS HD3 H -8.167 -4.196 -6.557 1.00 . A A . 9 LYS HD3 1 1
19 4253 1 1 9 LYS HE2 H -8.040 -6.464 -6.361 1.00 . A A . 9 LYS HE2 1 1
19 4254 1 1 9 LYS HE3 H -7.169 -6.001 -4.900 1.00 . A A . 9 LYS HE3 1 1
19 4255 1 1 9 LYS HG2 H -8.306 -2.622 -4.707 1.00 . A A . 9 LYS HG2 1 1
19 4256 1 1 9 LYS HG3 H -6.928 -3.704 -4.498 1.00 . A A . 9 LYS HG3 1 1
19 4257 1 1 9 LYS HZ1 H -9.896 -6.109 -4.293 1.00 . A A . 9 LYS HZ1 1 1
19 4258 1 1 9 LYS HZ2 H -8.657 -7.105 -3.715 1.00 . A A . 9 LYS HZ2 1 1
19 4259 1 1 9 LYS HZ3 H -9.502 -7.534 -5.116 1.00 . A A . 9 LYS HZ3 1 1
19 4260 1 1 9 LYS N N -6.831 -2.634 -2.082 1.00 . A A . 9 LYS N 1 1
19 4261 1 1 9 LYS NZ N -9.115 -6.736 -4.573 1.00 . A A . 9 LYS NZ 1 1
19 4262 1 1 9 LYS O O -7.710 -3.981 0.103 1.00 . A A . 9 LYS O 1 1
19 4263 1 1 10 ARG C C -9.809 -5.669 1.091 1.00 . A A . 10 ARG C 1 1
19 4264 1 1 10 ARG CA C -10.359 -4.263 0.866 1.00 . A A . 10 ARG CA 1 1
19 4265 1 1 10 ARG CB C -11.888 -4.291 0.896 1.00 . A A . 10 ARG CB 1 1
19 4266 1 1 10 ARG CD C -13.613 -4.179 -0.929 1.00 . A A . 10 ARG CD 1 1
19 4267 1 1 10 ARG CG C -12.507 -5.008 -0.294 1.00 . A A . 10 ARG CG 1 1
19 4268 1 1 10 ARG CZ C -13.253 -4.339 -3.355 1.00 . A A . 10 ARG CZ 1 1
19 4269 1 1 10 ARG H H -10.541 -3.412 -1.063 1.00 . A A . 10 ARG H 1 1
19 4270 1 1 10 ARG HA H -10.004 -3.620 1.658 1.00 . A A . 10 ARG HA 1 1
19 4271 1 1 10 ARG HB2 H -12.210 -4.792 1.797 1.00 . A A . 10 ARG HB2 1 1
19 4272 1 1 10 ARG HB3 H -12.255 -3.276 0.907 1.00 . A A . 10 ARG HB3 1 1
19 4273 1 1 10 ARG HD2 H -14.492 -4.238 -0.305 1.00 . A A . 10 ARG HD2 1 1
19 4274 1 1 10 ARG HD3 H -13.283 -3.152 -0.992 1.00 . A A . 10 ARG HD3 1 1
19 4275 1 1 10 ARG HE H -14.734 -5.231 -2.361 1.00 . A A . 10 ARG HE 1 1
19 4276 1 1 10 ARG HG2 H -11.740 -5.190 -1.031 1.00 . A A . 10 ARG HG2 1 1
19 4277 1 1 10 ARG HG3 H -12.919 -5.948 0.040 1.00 . A A . 10 ARG HG3 1 1
19 4278 1 1 10 ARG HH11 H -11.905 -3.203 -2.370 1.00 . A A . 10 ARG HH11 1 1
19 4279 1 1 10 ARG HH12 H -11.663 -3.324 -4.081 1.00 . A A . 10 ARG HH12 1 1
19 4280 1 1 10 ARG HH21 H -14.426 -5.399 -4.615 1.00 . A A . 10 ARG HH21 1 1
19 4281 1 1 10 ARG HH22 H -13.099 -4.573 -5.357 1.00 . A A . 10 ARG HH22 1 1
19 4282 1 1 10 ARG N N -9.886 -3.717 -0.400 1.00 . A A . 10 ARG N 1 1
19 4283 1 1 10 ARG NE N -13.950 -4.652 -2.268 1.00 . A A . 10 ARG NE 1 1
19 4284 1 1 10 ARG NH1 N -12.187 -3.558 -3.261 1.00 . A A . 10 ARG NH1 1 1
19 4285 1 1 10 ARG NH2 N -13.623 -4.809 -4.540 1.00 . A A . 10 ARG NH2 1 1
19 4286 1 1 10 ARG O O -9.469 -6.043 2.214 1.00 . A A . 10 ARG O 1 1
19 4287 1 1 11 HIS C C -7.713 -7.814 0.362 1.00 . A A . 11 HIS C 1 1
19 4288 1 1 11 HIS CA C -9.215 -7.809 0.093 1.00 . A A . 11 HIS CA 1 1
19 4289 1 1 11 HIS CB C -9.517 -8.564 -1.202 1.00 . A A . 11 HIS CB 1 1
19 4290 1 1 11 HIS CD2 C -11.928 -7.932 -1.918 1.00 . A A . 11 HIS CD2 1 1
19 4291 1 1 11 HIS CE1 C -12.899 -9.855 -1.509 1.00 . A A . 11 HIS CE1 1 1
19 4292 1 1 11 HIS CG C -10.979 -8.774 -1.447 1.00 . A A . 11 HIS CG 1 1
19 4293 1 1 11 HIS H H -10.010 -6.090 -0.854 1.00 . A A . 11 HIS H 1 1
19 4294 1 1 11 HIS HA H -9.716 -8.303 0.912 1.00 . A A . 11 HIS HA 1 1
19 4295 1 1 11 HIS HB2 H -9.118 -8.006 -2.037 1.00 . A A . 11 HIS HB2 1 1
19 4296 1 1 11 HIS HB3 H -9.043 -9.534 -1.164 1.00 . A A . 11 HIS HB3 1 1
19 4297 1 1 11 HIS HD1 H -11.199 -10.783 -0.850 1.00 . A A . 11 HIS HD1 1 1
19 4298 1 1 11 HIS HD2 H -11.782 -6.902 -2.217 1.00 . A A . 11 HIS HD2 1 1
19 4299 1 1 11 HIS HE1 H -13.644 -10.630 -1.419 1.00 . A A . 11 HIS HE1 1 1
19 4300 1 1 11 HIS N N -9.724 -6.444 0.014 1.00 . A A . 11 HIS N 1 1
19 4301 1 1 11 HIS ND1 N -11.620 -9.970 -1.199 1.00 . A A . 11 HIS ND1 1 1
19 4302 1 1 11 HIS NE2 N -13.112 -8.626 -1.948 1.00 . A A . 11 HIS NE2 1 1
19 4303 1 1 11 HIS O O -7.144 -8.839 0.736 1.00 . A A . 11 HIS O 1 1
19 4304 1 1 12 GLY C C -4.860 -6.507 -0.903 1.00 . A A . 12 GLY C 1 1
19 4305 1 1 12 GLY CA C -5.648 -6.557 0.391 1.00 . A A . 12 GLY CA 1 1
19 4306 1 1 12 GLY H H -7.584 -5.878 -0.133 1.00 . A A . 12 GLY H 1 1
19 4307 1 1 12 GLY HA2 H -5.450 -5.659 0.957 1.00 . A A . 12 GLY HA2 1 1
19 4308 1 1 12 GLY HA3 H -5.322 -7.413 0.964 1.00 . A A . 12 GLY HA3 1 1
19 4309 1 1 12 GLY N N -7.078 -6.663 0.166 1.00 . A A . 12 GLY N 1 1
19 4310 1 1 12 GLY O O -3.701 -6.095 -0.916 1.00 . A A . 12 GLY O 1 1
19 4311 1 1 13 GLY C C -4.733 -5.536 -3.885 1.00 . A A . 13 GLY C 1 1
19 4312 1 1 13 GLY CA C -4.824 -6.925 -3.285 1.00 . A A . 13 GLY CA 1 1
19 4313 1 1 13 GLY H H -6.414 -7.247 -1.924 1.00 . A A . 13 GLY H 1 1
19 4314 1 1 13 GLY HA2 H -3.826 -7.319 -3.163 1.00 . A A . 13 GLY HA2 1 1
19 4315 1 1 13 GLY HA3 H -5.372 -7.562 -3.962 1.00 . A A . 13 GLY HA3 1 1
19 4316 1 1 13 GLY N N -5.490 -6.930 -1.995 1.00 . A A . 13 GLY N 1 1
19 4317 1 1 13 GLY O O -4.990 -4.540 -3.207 1.00 . A A . 13 GLY O 1 1
19 4318 1 1 14 CYS C C -5.234 -4.098 -7.007 1.00 . A A . 14 CYS C 1 1
19 4319 1 1 14 CYS CA C -4.240 -4.190 -5.852 1.00 . A A . 14 CYS CA 1 1
19 4320 1 1 14 CYS CB C -2.815 -4.008 -6.375 1.00 . A A . 14 CYS CB 1 1
19 4321 1 1 14 CYS H H -4.176 -6.296 -5.648 1.00 . A A . 14 CYS H 1 1
19 4322 1 1 14 CYS HA H -4.458 -3.406 -5.143 1.00 . A A . 14 CYS HA 1 1
19 4323 1 1 14 CYS HB2 H -2.662 -4.666 -7.218 1.00 . A A . 14 CYS HB2 1 1
19 4324 1 1 14 CYS HB3 H -2.685 -2.985 -6.695 1.00 . A A . 14 CYS HB3 1 1
19 4325 1 1 14 CYS N N -4.367 -5.467 -5.160 1.00 . A A . 14 CYS N 1 1
19 4326 1 1 14 CYS O O -5.611 -5.109 -7.597 1.00 . A A . 14 CYS O 1 1
19 4327 1 1 14 CYS SG S -1.520 -4.374 -5.146 1.00 . A A . 14 CYS SG 1 1
19 4328 1 1 15 SER C C -5.966 -1.838 -9.529 1.00 . A A . 15 SER C 1 1
19 4329 1 1 15 SER CA C -6.604 -2.650 -8.406 1.00 . A A . 15 SER CA 1 1
19 4330 1 1 15 SER CB C -7.845 -1.927 -7.880 1.00 . A A . 15 SER CB 1 1
19 4331 1 1 15 SER H H -5.314 -2.109 -6.816 1.00 . A A . 15 SER H 1 1
19 4332 1 1 15 SER HA H -6.897 -3.614 -8.796 1.00 . A A . 15 SER HA 1 1
19 4333 1 1 15 SER HB2 H -8.025 -2.224 -6.857 1.00 . A A . 15 SER HB2 1 1
19 4334 1 1 15 SER HB3 H -7.681 -0.860 -7.921 1.00 . A A . 15 SER HB3 1 1
19 4335 1 1 15 SER HG H -9.058 -1.627 -9.387 1.00 . A A . 15 SER HG 1 1
19 4336 1 1 15 SER N N -5.652 -2.875 -7.324 1.00 . A A . 15 SER N 1 1
19 4337 1 1 15 SER O O -6.127 -0.619 -9.599 1.00 . A A . 15 SER O 1 1
19 4338 1 1 15 SER OG O -8.987 -2.244 -8.656 1.00 . A A . 15 SER OG 1 1
19 4339 1 1 16 CYS C C -5.513 -1.767 -12.731 1.00 . A A . 16 CYS C 1 1
19 4340 1 1 16 CYS CA C -4.578 -1.868 -11.528 1.00 . A A . 16 CYS CA 1 1
19 4341 1 1 16 CYS CB C -3.310 -2.632 -11.916 1.00 . A A . 16 CYS CB 1 1
19 4342 1 1 16 CYS H H -5.149 -3.493 -10.300 1.00 . A A . 16 CYS H 1 1
19 4343 1 1 16 CYS HA H -4.305 -0.872 -11.216 1.00 . A A . 16 CYS HA 1 1
19 4344 1 1 16 CYS HB2 H -3.590 -3.589 -12.334 1.00 . A A . 16 CYS HB2 1 1
19 4345 1 1 16 CYS HB3 H -2.770 -2.065 -12.660 1.00 . A A . 16 CYS HB3 1 1
19 4346 1 1 16 CYS N N -5.241 -2.523 -10.408 1.00 . A A . 16 CYS N 1 1
19 4347 1 1 16 CYS O O -6.621 -2.303 -12.715 1.00 . A A . 16 CYS O 1 1
19 4348 1 1 16 CYS SG S -2.177 -2.948 -10.526 1.00 . A A . 16 CYS SG 1 1
19 4349 1 1 17 NH2 HN1 H -5.603 -0.962 -14.602 1.00 . A A . 17 NH2 HN1 1 1
19 4350 1 1 17 NH2 HN2 H -4.165 -0.673 -13.725 1.00 . A A . 17 NH2 HN2 1 1
19 4351 1 1 17 NH2 N N -5.057 -1.078 -13.771 1.00 . A A . 17 NH2 N 1 1
20 4352 1 1 1 TRP C C 1.594 -0.305 -2.333 1.00 . A A . 1 TRP C 1 1
20 4353 1 1 1 TRP CA C 1.762 1.054 -1.665 1.00 . A A . 1 TRP CA 1 1
20 4354 1 1 1 TRP CB C 3.247 1.407 -1.565 1.00 . A A . 1 TRP CB 1 1
20 4355 1 1 1 TRP CD1 C 4.234 2.610 -3.602 1.00 . A A . 1 TRP CD1 1 1
20 4356 1 1 1 TRP CD2 C 4.397 0.378 -3.682 1.00 . A A . 1 TRP CD2 1 1
20 4357 1 1 1 TRP CE2 C 4.972 0.912 -4.851 1.00 . A A . 1 TRP CE2 1 1
20 4358 1 1 1 TRP CE3 C 4.386 -1.009 -3.510 1.00 . A A . 1 TRP CE3 1 1
20 4359 1 1 1 TRP CG C 3.932 1.480 -2.896 1.00 . A A . 1 TRP CG 1 1
20 4360 1 1 1 TRP CH2 C 5.504 -1.247 -5.648 1.00 . A A . 1 TRP CH2 1 1
20 4361 1 1 1 TRP CZ2 C 5.528 0.107 -5.842 1.00 . A A . 1 TRP CZ2 1 1
20 4362 1 1 1 TRP CZ3 C 4.938 -1.807 -4.494 1.00 . A A . 1 TRP CZ3 1 1
20 4363 1 1 1 TRP H1 H 1.477 0.442 0.341 1.00 . A A . 1 TRP H1 1 1
20 4364 1 1 1 TRP HA H 1.264 1.802 -2.265 1.00 . A A . 1 TRP HA 1 1
20 4365 1 1 1 TRP HB2 H 3.351 2.369 -1.084 1.00 . A A . 1 TRP HB2 1 1
20 4366 1 1 1 TRP HB3 H 3.748 0.657 -0.972 1.00 . A A . 1 TRP HB3 1 1
20 4367 1 1 1 TRP HD1 H 4.007 3.612 -3.272 1.00 . A A . 1 TRP HD1 1 1
20 4368 1 1 1 TRP HE1 H 5.175 2.911 -5.456 1.00 . A A . 1 TRP HE1 1 1
20 4369 1 1 1 TRP HE3 H 3.955 -1.460 -2.628 1.00 . A A . 1 TRP HE3 1 1
20 4370 1 1 1 TRP HH2 H 5.923 -1.908 -6.390 1.00 . A A . 1 TRP HH2 1 1
20 4371 1 1 1 TRP HZ2 H 5.969 0.523 -6.736 1.00 . A A . 1 TRP HZ2 1 1
20 4372 1 1 1 TRP HZ3 H 4.938 -2.881 -4.380 1.00 . A A . 1 TRP HZ3 1 1
20 4373 1 1 1 TRP N N 1.149 1.064 -0.342 1.00 . A A . 1 TRP N 1 1
20 4374 1 1 1 TRP NE1 N 4.859 2.275 -4.779 1.00 . A A . 1 TRP NE1 1 1
20 4375 1 1 1 TRP O O 1.830 -1.345 -1.715 1.00 . A A . 1 TRP O 1 1
20 4376 1 1 2 CYS C C 1.904 -1.575 -5.567 1.00 . A A . 2 CYS C 1 1
20 4377 1 1 2 CYS CA C 0.985 -1.526 -4.349 1.00 . A A . 2 CYS CA 1 1
20 4378 1 1 2 CYS CB C -0.474 -1.647 -4.792 1.00 . A A . 2 CYS CB 1 1
20 4379 1 1 2 CYS H H 1.013 0.567 -4.036 1.00 . A A . 2 CYS H 1 1
20 4380 1 1 2 CYS HA H 1.225 -2.353 -3.700 1.00 . A A . 2 CYS HA 1 1
20 4381 1 1 2 CYS HB2 H -0.890 -0.656 -4.910 1.00 . A A . 2 CYS HB2 1 1
20 4382 1 1 2 CYS HB3 H -0.513 -2.162 -5.740 1.00 . A A . 2 CYS HB3 1 1
20 4383 1 1 2 CYS N N 1.185 -0.293 -3.597 1.00 . A A . 2 CYS N 1 1
20 4384 1 1 2 CYS O O 2.558 -0.589 -5.903 1.00 . A A . 2 CYS O 1 1
20 4385 1 1 2 CYS SG S -1.533 -2.555 -3.621 1.00 . A A . 2 CYS SG 1 1
20 4386 1 1 3 ALA C C 2.460 -1.861 -8.466 1.00 . A A . 3 ALA C 1 1
20 4387 1 1 3 ALA CA C 2.781 -2.908 -7.404 1.00 . A A . 3 ALA CA 1 1
20 4388 1 1 3 ALA CB C 2.603 -4.309 -7.971 1.00 . A A . 3 ALA CB 1 1
20 4389 1 1 3 ALA H H 1.400 -3.480 -5.906 1.00 . A A . 3 ALA H 1 1
20 4390 1 1 3 ALA HA H 3.813 -2.795 -7.103 1.00 . A A . 3 ALA HA 1 1
20 4391 1 1 3 ALA HB1 H 1.555 -4.489 -8.161 1.00 . A A . 3 ALA HB1 1 1
20 4392 1 1 3 ALA HB2 H 3.158 -4.397 -8.893 1.00 . A A . 3 ALA HB2 1 1
20 4393 1 1 3 ALA HB3 H 2.969 -5.034 -7.259 1.00 . A A . 3 ALA HB3 1 1
20 4394 1 1 3 ALA N N 1.946 -2.730 -6.224 1.00 . A A . 3 ALA N 1 1
20 4395 1 1 3 ALA O O 1.297 -1.525 -8.689 1.00 . A A . 3 ALA O 1 1
20 4396 1 1 4 SER C C 2.545 0.859 -9.621 1.00 . A A . 4 SER C 1 1
20 4397 1 1 4 SER CA C 3.328 -0.337 -10.155 1.00 . A A . 4 SER CA 1 1
20 4398 1 1 4 SER CB C 2.607 -0.933 -11.365 1.00 . A A . 4 SER CB 1 1
20 4399 1 1 4 SER H H 4.402 -1.657 -8.896 1.00 . A A . 4 SER H 1 1
20 4400 1 1 4 SER HA H 4.309 -0.005 -10.458 1.00 . A A . 4 SER HA 1 1
20 4401 1 1 4 SER HB2 H 2.984 -1.927 -11.552 1.00 . A A . 4 SER HB2 1 1
20 4402 1 1 4 SER HB3 H 1.546 -0.982 -11.161 1.00 . A A . 4 SER HB3 1 1
20 4403 1 1 4 SER HG H 2.212 -0.424 -13.215 1.00 . A A . 4 SER HG 1 1
20 4404 1 1 4 SER N N 3.499 -1.349 -9.119 1.00 . A A . 4 SER N 1 1
20 4405 1 1 4 SER O O 1.829 1.529 -10.364 1.00 . A A . 4 SER O 1 1
20 4406 1 1 4 SER OG O 2.812 -0.141 -12.522 1.00 . A A . 4 SER OG 1 1
20 4407 1 1 5 GLY C C 0.485 2.072 -7.754 1.00 . A A . 5 GLY C 1 1
20 4408 1 1 5 GLY CA C 1.992 2.237 -7.712 1.00 . A A . 5 GLY CA 1 1
20 4409 1 1 5 GLY H H 3.274 0.554 -7.781 1.00 . A A . 5 GLY H 1 1
20 4410 1 1 5 GLY HA2 H 2.306 2.324 -6.684 1.00 . A A . 5 GLY HA2 1 1
20 4411 1 1 5 GLY HA3 H 2.255 3.144 -8.236 1.00 . A A . 5 GLY HA3 1 1
20 4412 1 1 5 GLY N N 2.690 1.123 -8.325 1.00 . A A . 5 GLY N 1 1
20 4413 1 1 5 GLY O O -0.258 3.043 -7.615 1.00 . A A . 5 GLY O 1 1
20 4414 1 1 6 CYS C C -2.092 0.971 -6.715 1.00 . A A . 6 CYS C 1 1
20 4415 1 1 6 CYS CA C -1.395 0.545 -8.005 1.00 . A A . 6 CYS CA 1 1
20 4416 1 1 6 CYS CB C -1.622 -0.947 -8.251 1.00 . A A . 6 CYS CB 1 1
20 4417 1 1 6 CYS H H 0.675 0.102 -8.047 1.00 . A A . 6 CYS H 1 1
20 4418 1 1 6 CYS HA H -1.813 1.105 -8.827 1.00 . A A . 6 CYS HA 1 1
20 4419 1 1 6 CYS HB2 H -0.844 -1.509 -7.757 1.00 . A A . 6 CYS HB2 1 1
20 4420 1 1 6 CYS HB3 H -2.580 -1.230 -7.841 1.00 . A A . 6 CYS HB3 1 1
20 4421 1 1 6 CYS N N 0.033 0.836 -7.943 1.00 . A A . 6 CYS N 1 1
20 4422 1 1 6 CYS O O -1.448 1.431 -5.772 1.00 . A A . 6 CYS O 1 1
20 4423 1 1 6 CYS SG S -1.609 -1.420 -10.011 1.00 . A A . 6 CYS SG 1 1
20 4424 1 1 7 ARG C C -4.448 -0.035 -4.622 1.00 . A A . 7 ARG C 1 1
20 4425 1 1 7 ARG CA C -4.196 1.179 -5.510 1.00 . A A . 7 ARG CA 1 1
20 4426 1 1 7 ARG CB C -5.528 1.799 -5.935 1.00 . A A . 7 ARG CB 1 1
20 4427 1 1 7 ARG CD C -5.834 4.104 -4.984 1.00 . A A . 7 ARG CD 1 1
20 4428 1 1 7 ARG CG C -5.446 3.292 -6.209 1.00 . A A . 7 ARG CG 1 1
20 4429 1 1 7 ARG CZ C -5.573 6.394 -4.127 1.00 . A A . 7 ARG CZ 1 1
20 4430 1 1 7 ARG H H -3.868 0.439 -7.466 1.00 . A A . 7 ARG H 1 1
20 4431 1 1 7 ARG HA H -3.632 1.910 -4.949 1.00 . A A . 7 ARG HA 1 1
20 4432 1 1 7 ARG HB2 H -5.869 1.309 -6.836 1.00 . A A . 7 ARG HB2 1 1
20 4433 1 1 7 ARG HB3 H -6.252 1.638 -5.152 1.00 . A A . 7 ARG HB3 1 1
20 4434 1 1 7 ARG HD2 H -6.912 4.137 -4.917 1.00 . A A . 7 ARG HD2 1 1
20 4435 1 1 7 ARG HD3 H -5.434 3.621 -4.106 1.00 . A A . 7 ARG HD3 1 1
20 4436 1 1 7 ARG HE H -4.765 5.711 -5.818 1.00 . A A . 7 ARG HE 1 1
20 4437 1 1 7 ARG HG2 H -4.433 3.542 -6.487 1.00 . A A . 7 ARG HG2 1 1
20 4438 1 1 7 ARG HG3 H -6.114 3.536 -7.021 1.00 . A A . 7 ARG HG3 1 1
20 4439 1 1 7 ARG HH11 H -6.702 5.178 -2.975 1.00 . A A . 7 ARG HH11 1 1
20 4440 1 1 7 ARG HH12 H -6.508 6.795 -2.382 1.00 . A A . 7 ARG HH12 1 1
20 4441 1 1 7 ARG HH21 H -4.504 7.842 -5.048 1.00 . A A . 7 ARG HH21 1 1
20 4442 1 1 7 ARG HH22 H -5.259 8.309 -3.562 1.00 . A A . 7 ARG HH22 1 1
20 4443 1 1 7 ARG N N -3.411 0.811 -6.683 1.00 . A A . 7 ARG N 1 1
20 4444 1 1 7 ARG NE N -5.322 5.471 -5.049 1.00 . A A . 7 ARG NE 1 1
20 4445 1 1 7 ARG NH1 N -6.323 6.098 -3.075 1.00 . A A . 7 ARG NH1 1 1
20 4446 1 1 7 ARG NH2 N -5.070 7.615 -4.256 1.00 . A A . 7 ARG NH2 1 1
20 4447 1 1 7 ARG O O -4.372 -1.178 -5.076 1.00 . A A . 7 ARG O 1 1
20 4448 1 1 8 LYS C C -6.489 -1.241 -2.414 1.00 . A A . 8 LYS C 1 1
20 4449 1 1 8 LYS CA C -5.014 -0.852 -2.400 1.00 . A A . 8 LYS CA 1 1
20 4450 1 1 8 LYS CB C -4.602 -0.422 -0.989 1.00 . A A . 8 LYS CB 1 1
20 4451 1 1 8 LYS CD C -2.867 -0.477 0.825 1.00 . A A . 8 LYS CD 1 1
20 4452 1 1 8 LYS CE C -2.795 1.029 1.024 1.00 . A A . 8 LYS CE 1 1
20 4453 1 1 8 LYS CG C -3.189 -0.834 -0.616 1.00 . A A . 8 LYS CG 1 1
20 4454 1 1 8 LYS H H -4.796 1.150 -3.050 1.00 . A A . 8 LYS H 1 1
20 4455 1 1 8 LYS HA H -4.426 -1.710 -2.692 1.00 . A A . 8 LYS HA 1 1
20 4456 1 1 8 LYS HB2 H -4.673 0.654 -0.920 1.00 . A A . 8 LYS HB2 1 1
20 4457 1 1 8 LYS HB3 H -5.284 -0.866 -0.278 1.00 . A A . 8 LYS HB3 1 1
20 4458 1 1 8 LYS HD2 H -3.637 -0.877 1.467 1.00 . A A . 8 LYS HD2 1 1
20 4459 1 1 8 LYS HD3 H -1.913 -0.912 1.090 1.00 . A A . 8 LYS HD3 1 1
20 4460 1 1 8 LYS HE2 H -2.375 1.477 0.136 1.00 . A A . 8 LYS HE2 1 1
20 4461 1 1 8 LYS HE3 H -3.795 1.407 1.179 1.00 . A A . 8 LYS HE3 1 1
20 4462 1 1 8 LYS HG2 H -3.088 -1.901 -0.743 1.00 . A A . 8 LYS HG2 1 1
20 4463 1 1 8 LYS HG3 H -2.492 -0.325 -1.268 1.00 . A A . 8 LYS HG3 1 1
20 4464 1 1 8 LYS HZ1 H -2.051 2.409 2.405 1.00 . A A . 8 LYS HZ1 1 1
20 4465 1 1 8 LYS HZ2 H -0.952 1.190 1.993 1.00 . A A . 8 LYS HZ2 1 1
20 4466 1 1 8 LYS HZ3 H -2.244 0.848 3.031 1.00 . A A . 8 LYS HZ3 1 1
20 4467 1 1 8 LYS N N -4.749 0.218 -3.353 1.00 . A A . 8 LYS N 1 1
20 4468 1 1 8 LYS NZ N -1.951 1.395 2.195 1.00 . A A . 8 LYS NZ 1 1
20 4469 1 1 8 LYS O O -7.338 -0.479 -2.876 1.00 . A A . 8 LYS O 1 1
20 4470 1 1 9 LYS C C -8.464 -3.552 -0.499 1.00 . A A . 9 LYS C 1 1
20 4471 1 1 9 LYS CA C -8.160 -2.921 -1.854 1.00 . A A . 9 LYS CA 1 1
20 4472 1 1 9 LYS CB C -8.399 -3.941 -2.969 1.00 . A A . 9 LYS CB 1 1
20 4473 1 1 9 LYS CD C -8.716 -4.230 -5.444 1.00 . A A . 9 LYS CD 1 1
20 4474 1 1 9 LYS CE C -8.315 -5.696 -5.400 1.00 . A A . 9 LYS CE 1 1
20 4475 1 1 9 LYS CG C -8.027 -3.431 -4.351 1.00 . A A . 9 LYS CG 1 1
20 4476 1 1 9 LYS H H -6.066 -2.994 -1.550 1.00 . A A . 9 LYS H 1 1
20 4477 1 1 9 LYS HA H -8.818 -2.078 -2.001 1.00 . A A . 9 LYS HA 1 1
20 4478 1 1 9 LYS HB2 H -7.813 -4.825 -2.764 1.00 . A A . 9 LYS HB2 1 1
20 4479 1 1 9 LYS HB3 H -9.446 -4.208 -2.978 1.00 . A A . 9 LYS HB3 1 1
20 4480 1 1 9 LYS HD2 H -9.785 -4.157 -5.313 1.00 . A A . 9 LYS HD2 1 1
20 4481 1 1 9 LYS HD3 H -8.441 -3.819 -6.406 1.00 . A A . 9 LYS HD3 1 1
20 4482 1 1 9 LYS HE2 H -7.238 -5.762 -5.407 1.00 . A A . 9 LYS HE2 1 1
20 4483 1 1 9 LYS HE3 H -8.696 -6.132 -4.488 1.00 . A A . 9 LYS HE3 1 1
20 4484 1 1 9 LYS HG2 H -8.325 -2.396 -4.435 1.00 . A A . 9 LYS HG2 1 1
20 4485 1 1 9 LYS HG3 H -6.957 -3.512 -4.477 1.00 . A A . 9 LYS HG3 1 1
20 4486 1 1 9 LYS HZ1 H -9.895 -6.432 -6.551 1.00 . A A . 9 LYS HZ1 1 1
20 4487 1 1 9 LYS HZ2 H -8.540 -7.445 -6.521 1.00 . A A . 9 LYS HZ2 1 1
20 4488 1 1 9 LYS HZ3 H -8.520 -6.032 -7.452 1.00 . A A . 9 LYS HZ3 1 1
20 4489 1 1 9 LYS N N -6.787 -2.431 -1.903 1.00 . A A . 9 LYS N 1 1
20 4490 1 1 9 LYS NZ N -8.856 -6.455 -6.562 1.00 . A A . 9 LYS NZ 1 1
20 4491 1 1 9 LYS O O -7.559 -4.001 0.204 1.00 . A A . 9 LYS O 1 1
20 4492 1 1 10 ARG C C -9.867 -5.656 1.175 1.00 . A A . 10 ARG C 1 1
20 4493 1 1 10 ARG CA C -10.166 -4.160 1.130 1.00 . A A . 10 ARG CA 1 1
20 4494 1 1 10 ARG CB C -11.661 -3.922 1.350 1.00 . A A . 10 ARG CB 1 1
20 4495 1 1 10 ARG CD C -12.990 -3.317 -0.695 1.00 . A A . 10 ARG CD 1 1
20 4496 1 1 10 ARG CG C -12.534 -4.443 0.219 1.00 . A A . 10 ARG CG 1 1
20 4497 1 1 10 ARG CZ C -14.836 -1.699 -0.846 1.00 . A A . 10 ARG CZ 1 1
20 4498 1 1 10 ARG H H -10.419 -3.210 -0.744 1.00 . A A . 10 ARG H 1 1
20 4499 1 1 10 ARG HA H -9.614 -3.671 1.918 1.00 . A A . 10 ARG HA 1 1
20 4500 1 1 10 ARG HB2 H -11.963 -4.415 2.263 1.00 . A A . 10 ARG HB2 1 1
20 4501 1 1 10 ARG HB3 H -11.834 -2.861 1.450 1.00 . A A . 10 ARG HB3 1 1
20 4502 1 1 10 ARG HD2 H -12.255 -2.527 -0.666 1.00 . A A . 10 ARG HD2 1 1
20 4503 1 1 10 ARG HD3 H -13.068 -3.698 -1.703 1.00 . A A . 10 ARG HD3 1 1
20 4504 1 1 10 ARG HE H -14.766 -3.234 0.425 1.00 . A A . 10 ARG HE 1 1
20 4505 1 1 10 ARG HG2 H -11.968 -5.156 -0.361 1.00 . A A . 10 ARG HG2 1 1
20 4506 1 1 10 ARG HG3 H -13.403 -4.926 0.641 1.00 . A A . 10 ARG HG3 1 1
20 4507 1 1 10 ARG HH11 H -13.317 -1.379 -2.140 1.00 . A A . 10 ARG HH11 1 1
20 4508 1 1 10 ARG HH12 H -14.625 -0.247 -2.235 1.00 . A A . 10 ARG HH12 1 1
20 4509 1 1 10 ARG HH21 H -16.493 -1.749 0.309 1.00 . A A . 10 ARG HH21 1 1
20 4510 1 1 10 ARG HH22 H -16.430 -0.458 -0.841 1.00 . A A . 10 ARG HH22 1 1
20 4511 1 1 10 ARG N N -9.744 -3.584 -0.140 1.00 . A A . 10 ARG N 1 1
20 4512 1 1 10 ARG NE N -14.285 -2.774 -0.293 1.00 . A A . 10 ARG NE 1 1
20 4513 1 1 10 ARG NH1 N -14.208 -1.056 -1.819 1.00 . A A . 10 ARG NH1 1 1
20 4514 1 1 10 ARG NH2 N -16.017 -1.267 -0.425 1.00 . A A . 10 ARG NH2 1 1
20 4515 1 1 10 ARG O O -9.689 -6.232 2.249 1.00 . A A . 10 ARG O 1 1
20 4516 1 1 11 HIS C C -8.052 -7.989 0.139 1.00 . A A . 11 HIS C 1 1
20 4517 1 1 11 HIS CA C -9.534 -7.707 -0.093 1.00 . A A . 11 HIS CA 1 1
20 4518 1 1 11 HIS CB C -9.957 -8.241 -1.462 1.00 . A A . 11 HIS CB 1 1
20 4519 1 1 11 HIS CD2 C -12.488 -8.122 -0.910 1.00 . A A . 11 HIS CD2 1 1
20 4520 1 1 11 HIS CE1 C -13.168 -9.786 -2.167 1.00 . A A . 11 HIS CE1 1 1
20 4521 1 1 11 HIS CG C -11.400 -8.635 -1.531 1.00 . A A . 11 HIS CG 1 1
20 4522 1 1 11 HIS H H -9.962 -5.765 -0.819 1.00 . A A . 11 HIS H 1 1
20 4523 1 1 11 HIS HA H -10.107 -8.208 0.672 1.00 . A A . 11 HIS HA 1 1
20 4524 1 1 11 HIS HB2 H -9.786 -7.479 -2.207 1.00 . A A . 11 HIS HB2 1 1
20 4525 1 1 11 HIS HB3 H -9.362 -9.111 -1.702 1.00 . A A . 11 HIS HB3 1 1
20 4526 1 1 11 HIS HD1 H -11.309 -10.249 -2.882 1.00 . A A . 11 HIS HD1 1 1
20 4527 1 1 11 HIS HD2 H -12.501 -7.290 -0.220 1.00 . A A . 11 HIS HD2 1 1
20 4528 1 1 11 HIS HE1 H -13.799 -10.513 -2.656 1.00 . A A . 11 HIS HE1 1 1
20 4529 1 1 11 HIS N N -9.812 -6.279 0.002 1.00 . A A . 11 HIS N 1 1
20 4530 1 1 11 HIS ND1 N -11.860 -9.677 -2.309 1.00 . A A . 11 HIS ND1 1 1
20 4531 1 1 11 HIS NE2 N -13.575 -8.854 -1.322 1.00 . A A . 11 HIS NE2 1 1
20 4532 1 1 11 HIS O O -7.656 -9.129 0.375 1.00 . A A . 11 HIS O 1 1
20 4533 1 1 12 GLY C C -5.025 -7.014 -1.017 1.00 . A A . 12 GLY C 1 1
20 4534 1 1 12 GLY CA C -5.809 -7.096 0.277 1.00 . A A . 12 GLY CA 1 1
20 4535 1 1 12 GLY H H -7.609 -6.054 -0.118 1.00 . A A . 12 GLY H 1 1
20 4536 1 1 12 GLY HA2 H -5.466 -6.319 0.944 1.00 . A A . 12 GLY HA2 1 1
20 4537 1 1 12 GLY HA3 H -5.625 -8.056 0.735 1.00 . A A . 12 GLY HA3 1 1
20 4538 1 1 12 GLY N N -7.237 -6.940 0.072 1.00 . A A . 12 GLY N 1 1
20 4539 1 1 12 GLY O O -3.811 -6.813 -1.005 1.00 . A A . 12 GLY O 1 1
20 4540 1 1 13 GLY C C -4.762 -5.692 -3.865 1.00 . A A . 13 GLY C 1 1
20 4541 1 1 13 GLY CA C -5.065 -7.112 -3.433 1.00 . A A . 13 GLY CA 1 1
20 4542 1 1 13 GLY H H -6.687 -7.328 -2.089 1.00 . A A . 13 GLY H 1 1
20 4543 1 1 13 GLY HA2 H -4.141 -7.668 -3.382 1.00 . A A . 13 GLY HA2 1 1
20 4544 1 1 13 GLY HA3 H -5.708 -7.571 -4.171 1.00 . A A . 13 GLY HA3 1 1
20 4545 1 1 13 GLY N N -5.721 -7.171 -2.140 1.00 . A A . 13 GLY N 1 1
20 4546 1 1 13 GLY O O -4.858 -4.758 -3.068 1.00 . A A . 13 GLY O 1 1
20 4547 1 1 14 CYS C C -4.851 -3.940 -6.952 1.00 . A A . 14 CYS C 1 1
20 4548 1 1 14 CYS CA C -4.071 -4.209 -5.668 1.00 . A A . 14 CYS CA 1 1
20 4549 1 1 14 CYS CB C -2.570 -4.098 -5.938 1.00 . A A . 14 CYS CB 1 1
20 4550 1 1 14 CYS H H -4.334 -6.309 -5.719 1.00 . A A . 14 CYS H 1 1
20 4551 1 1 14 CYS HA H -4.351 -3.472 -4.930 1.00 . A A . 14 CYS HA 1 1
20 4552 1 1 14 CYS HB2 H -2.302 -4.782 -6.730 1.00 . A A . 14 CYS HB2 1 1
20 4553 1 1 14 CYS HB3 H -2.341 -3.089 -6.249 1.00 . A A . 14 CYS HB3 1 1
20 4554 1 1 14 CYS N N -4.393 -5.525 -5.131 1.00 . A A . 14 CYS N 1 1
20 4555 1 1 14 CYS O O -4.808 -4.731 -7.894 1.00 . A A . 14 CYS O 1 1
20 4556 1 1 14 CYS SG S -1.525 -4.485 -4.496 1.00 . A A . 14 CYS SG 1 1
20 4557 1 1 15 SER C C -5.481 -1.789 -9.211 1.00 . A A . 15 SER C 1 1
20 4558 1 1 15 SER CA C -6.356 -2.446 -8.147 1.00 . A A . 15 SER CA 1 1
20 4559 1 1 15 SER CB C -7.484 -1.495 -7.741 1.00 . A A . 15 SER CB 1 1
20 4560 1 1 15 SER H H -5.556 -2.228 -6.199 1.00 . A A . 15 SER H 1 1
20 4561 1 1 15 SER HA H -6.785 -3.347 -8.557 1.00 . A A . 15 SER HA 1 1
20 4562 1 1 15 SER HB2 H -8.037 -1.928 -6.922 1.00 . A A . 15 SER HB2 1 1
20 4563 1 1 15 SER HB3 H -7.061 -0.551 -7.432 1.00 . A A . 15 SER HB3 1 1
20 4564 1 1 15 SER HG H -9.275 -1.403 -8.528 1.00 . A A . 15 SER HG 1 1
20 4565 1 1 15 SER N N -5.563 -2.818 -6.981 1.00 . A A . 15 SER N 1 1
20 4566 1 1 15 SER O O -4.862 -0.752 -8.970 1.00 . A A . 15 SER O 1 1
20 4567 1 1 15 SER OG O -8.371 -1.266 -8.822 1.00 . A A . 15 SER OG 1 1
20 4568 1 1 16 CYS C C -5.519 -1.540 -12.691 1.00 . A A . 16 CYS C 1 1
20 4569 1 1 16 CYS CA C -4.637 -1.879 -11.493 1.00 . A A . 16 CYS CA 1 1
20 4570 1 1 16 CYS CB C -3.569 -2.894 -11.902 1.00 . A A . 16 CYS CB 1 1
20 4571 1 1 16 CYS H H -5.951 -3.224 -10.522 1.00 . A A . 16 CYS H 1 1
20 4572 1 1 16 CYS HA H -4.151 -0.976 -11.152 1.00 . A A . 16 CYS HA 1 1
20 4573 1 1 16 CYS HB2 H -4.053 -3.811 -12.207 1.00 . A A . 16 CYS HB2 1 1
20 4574 1 1 16 CYS HB3 H -3.006 -2.498 -12.735 1.00 . A A . 16 CYS HB3 1 1
20 4575 1 1 16 CYS N N -5.435 -2.400 -10.390 1.00 . A A . 16 CYS N 1 1
20 4576 1 1 16 CYS O O -6.744 -1.636 -12.618 1.00 . A A . 16 CYS O 1 1
20 4577 1 1 16 CYS SG S -2.387 -3.306 -10.579 1.00 . A A . 16 CYS SG 1 1
20 4578 1 1 17 NH2 HN1 H -5.387 -0.904 -14.623 1.00 . A A . 17 NH2 HN1 1 1
20 4579 1 1 17 NH2 HN2 H -3.909 -1.089 -13.788 1.00 . A A . 17 NH2 HN2 1 1
20 4580 1 1 17 NH2 N N -4.887 -1.145 -13.791 1.00 . A A . 17 NH2 N 1 1
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