NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
|
|
515028 |
2ldc   |
17658 | cing | 4-filtered-FRED | STAR | entry | full | 267 |
data_FRED_restraints_with_modified_coordinates_PDB_code_2ldc
# This FRED archive file contains, for PDB entry <2ldc>:
#
# - 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_2ldc
_Assembly.Sf_category assembly
_Assembly.Entry_ID 1
_Assembly.ID 1
_Assembly.Name 2ldc
_Assembly.Number_of_components 1
_Assembly.Organic_ligands .
_Assembly.Metal_ions .
_Assembly.Paramagnetic .
_Assembly.Thiol_state "not present"
_Assembly.Molecular_mass 1367.61
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 $Estrogen_receptor_binding_stapled_peptide_SP1 A . 1 1
stop_
save_
save_Estrogen_receptor_binding_stapled_peptide_SP1
_Entity.Sf_category entity
_Entity.Entry_ID 1
_Entity.ID 1
_Entity.Name "Estrogen receptor binding stapled peptide SP1"
_Entity.Type polymer
_Entity.Polymer_type polypeptide(L)
_Entity.Polymer_seq_one_letter_code XHXILHXLLQDSX
_Entity.Number_of_monomers 13
loop_
_Entity_comp_index.ID
_Entity_comp_index.Comp_ID
_Entity_comp_index.Comp_label
_Entity_comp_index.Entry_ID
_Entity_comp_index.Entity_ID
1 ACE $ACE 1 1
2 HIS . 1 1
3 . $. 1 1
4 ILE . 1 1
5 LEU . 1 1
6 HIS . 1 1
7 . $. 1 1
8 LEU . 1 1
9 LEU . 1 1
10 GLN . 1 1
11 ASP . 1 1
12 SER . 1 1
13 NH2 $NH2 1 1
stop_
loop_
_Entity_poly_seq.Mon_ID
_Entity_poly_seq.Num
_Entity_poly_seq.Comp_index_ID
_Entity_poly_seq.Entry_ID
_Entity_poly_seq.Entity_ID
ACE 1 1 1 1
HIS 2 2 1 1
. 3 3 1 1
ILE 4 4 1 1
LEU 5 5 1 1
HIS 6 6 1 1
. 7 7 1 1
LEU 8 8 1 1
LEU 9 9 1 1
GLN 10 10 1 1
ASP 11 11 1 1
SER 12 12 1 1
NH2 13 13 1 1
stop_
save_
save_ACE
_Chem_comp.Sf_category chem_comp
_Chem_comp.Entry_ID 1
_Chem_comp.ID ACE
_Chem_comp.Type non-polymer
save_
save_NH2
_Chem_comp.Sf_category chem_comp
_Chem_comp.Entry_ID 1
_Chem_comp.ID NH2
_Chem_comp.Type non-polymer
save_
save_.
_Chem_comp.Sf_category chem_comp
_Chem_comp.Entry_ID 1
_Chem_comp.ID .
_Chem_comp.Type non-polymer
save_
save_CNS/XPLOR_distance_constraints_2_1
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID 1
_Distance_constraint_list.ID 1
_Distance_constraint_list.Constraint_type NOE
_Distance_constraint_list.Constraint_file_ID .
_Distance_constraint_list.Block_ID .
loop_
_Dist_constraint_tree.Constraint_ID
_Dist_constraint_tree.Node_ID
_Dist_constraint_tree.Down_node_ID
_Dist_constraint_tree.Right_node_ID
_Dist_constraint_tree.Logic_operation
_Dist_constraint_tree.Entry_ID
_Dist_constraint_tree.Distance_constraint_list_ID
1 1 . . . 1 1
2 1 . . . 1 1
3 1 . . . 1 1
4 1 . . . 1 1
5 1 . . . 1 1
6 1 . . . 1 1
7 1 . . . 1 1
8 1 . . . 1 1
9 1 . . . 1 1
10 1 . . . 1 1
11 1 . . . 1 1
12 1 . . . 1 1
13 1 . . . 1 1
14 1 . . . 1 1
15 1 . . . 1 1
16 1 . . . 1 1
17 1 . . . 1 1
18 1 . . . 1 1
19 1 . . . 1 1
20 1 . . . 1 1
21 1 . . . 1 1
22 1 . . . 1 1
23 1 . . . 1 1
24 1 . . . 1 1
25 1 . . . 1 1
26 1 . . . 1 1
27 1 . . . 1 1
28 1 . . . 1 1
29 1 . . . 1 1
30 1 . . . 1 1
31 1 . . . 1 1
32 1 . . . 1 1
33 1 . . . 1 1
34 1 . . . 1 1
35 1 . . . 1 1
36 1 . . . 1 1
37 1 . . . 1 1
38 1 . . . 1 1
39 1 . . . 1 1
40 1 . . . 1 1
41 1 . . . 1 1
42 1 . . . 1 1
43 1 . . . 1 1
44 1 . . . 1 1
45 1 . . . 1 1
46 1 . . . 1 1
47 1 . . . 1 1
48 1 . . . 1 1
49 1 . . . 1 1
50 1 . . . 1 1
51 1 . . . 1 1
52 1 . . . 1 1
53 1 . . . 1 1
54 1 . . . 1 1
55 1 . . . 1 1
56 1 . . . 1 1
57 1 . . . 1 1
58 1 . . . 1 1
59 1 . . . 1 1
60 1 . . . 1 1
61 1 . . . 1 1
62 1 . . . 1 1
63 1 . . . 1 1
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
185 1 . . . 1 1
186 1 . . . 1 1
187 1 . . . 1 1
188 1 . . . 1 1
189 1 . . . 1 1
190 1 . . . 1 1
191 1 . . . 1 1
192 1 . . . 1 1
193 1 . . . 1 1
194 1 . . . 1 1
195 1 . . . 1 1
196 1 . . . 1 1
197 1 . . . 1 1
198 1 . . . 1 1
199 1 . . . 1 1
200 1 . . . 1 1
201 1 . . . 1 1
202 1 . . . 1 1
203 1 . . . 1 1
204 1 . . . 1 1
205 1 . . . 1 1
206 1 . . . 1 1
207 1 . . . 1 1
208 1 . . . 1 1
209 1 . . . 1 1
210 1 . . . 1 1
211 1 . . . 1 1
212 1 . . . 1 1
213 1 . . . 1 1
214 1 . . . 1 1
215 1 . . . 1 1
216 1 . . . 1 1
217 1 . . . 1 1
218 1 . . . 1 1
219 1 . . . 1 1
220 1 . . . 1 1
221 1 . . . 1 1
222 1 . . . 1 1
223 1 . . . 1 1
224 1 . . . 1 1
225 1 . . . 1 1
226 1 . . . 1 1
227 1 . . . 1 1
228 1 . . . 1 1
229 1 . . . 1 1
230 1 . . . 1 1
231 1 . . . 1 1
232 1 . . . 1 1
233 1 . . . 1 1
234 1 . . . 1 1
235 1 . . . 1 1
236 1 . . . 1 1
237 1 . . . 1 1
238 1 . . . 1 1
239 1 . . . 1 1
240 1 . . . 1 1
241 1 . . . 1 1
242 1 . . . 1 1
243 1 . . . 1 1
244 1 . . . 1 1
245 1 . . . 1 1
246 1 . . . 1 1
247 1 . . . 1 1
248 1 . . . 1 1
249 1 . . . 1 1
250 1 . . . 1 1
251 1 . . . 1 1
252 1 . . . 1 1
253 1 . . . 1 1
254 1 . . . 1 1
255 1 . . . 1 1
256 1 . . . 1 1
257 1 . . . 1 1
258 1 . . . 1 1
259 1 . . . 1 1
260 1 . . . 1 1
261 1 . . . 1 1
262 1 . . . 1 1
263 1 . . . 1 1
264 1 . . . 1 1
265 1 . . . 1 1
266 1 . . . 1 1
267 1 . . . 1 1
stop_
loop_
_Dist_constraint.Tree_node_member_constraint_ID
_Dist_constraint.Tree_node_member_node_ID
_Dist_constraint.Constraint_tree_node_member_ID
_Dist_constraint.Entity_assembly_ID
_Dist_constraint.Entity_ID
_Dist_constraint.Comp_index_ID
_Dist_constraint.Comp_ID
_Dist_constraint.Atom_ID
_Dist_constraint.Auth_asym_ID
_Dist_constraint.Auth_seq_ID
_Dist_constraint.Auth_comp_ID
_Dist_constraint.Auth_atom_ID
_Dist_constraint.Entry_ID
_Dist_constraint.Distance_constraint_list_ID
1 1 1 1 1 2 HIS H . 1 . HN 1 1
1 1 2 1 1 2 HIS HA . 1 . HA 1 1
2 1 1 1 1 2 HIS H . 1 . HN 1 1
2 1 2 1 1 2 HIS QB . 1 . HB# 1 1
3 1 1 1 1 2 HIS H . 1 . HN 1 1
3 1 2 1 1 2 HIS HD2 . 1 . HD2 1 1
4 1 1 1 1 2 HIS H . 1 . HN 1 1
4 1 2 1 1 4 ILE H . 3 . HN 1 1
5 1 1 1 1 2 HIS H . 1 . HN 1 1
5 1 2 1 1 4 ILE MD . 3 . HD1# 1 1
6 1 1 1 1 2 HIS H . 1 . HN 1 1
6 1 2 1 1 4 ILE QG . 3 . HG12 1 1
7 1 1 1 1 2 HIS HA . 1 . HA 1 1
7 1 2 1 1 2 HIS QB . 1 . HB# 1 1
8 1 1 1 1 2 HIS HA . 1 . HA 1 1
8 1 2 1 1 2 HIS HD2 . 1 . HD2 1 1
9 1 1 1 1 2 HIS HA . 1 . HA 1 1
9 1 2 1 1 2 HIS HE1 . 1 . HE1 1 1
10 1 1 1 1 2 HIS HA . 1 . HA 1 1
10 1 2 1 1 3 . HN . 2 . HN 1 1
11 1 1 1 1 2 HIS HA . 1 . HA 1 1
11 1 2 1 1 4 ILE H . 3 . HN 1 1
12 1 1 1 1 2 HIS HA . 1 . HA 1 1
12 1 2 1 1 4 ILE HB . 3 . HB 1 1
13 1 1 1 1 2 HIS HA . 1 . HA 1 1
13 1 2 1 1 4 ILE MD . 3 . HD1# 1 1
14 1 1 1 1 2 HIS HA . 1 . HA 1 1
14 1 2 1 1 4 ILE QG . 3 . HG12 1 1
15 1 1 1 1 2 HIS HA . 1 . HA 1 1
15 1 2 1 1 5 LEU H . 4 . HN 1 1
16 1 1 1 1 2 HIS HA . 1 . HA 1 1
16 1 2 1 1 5 LEU QB . 4 . HB1 1 1
17 1 1 1 1 2 HIS HA . 1 . HA 1 1
17 1 2 1 1 5 LEU QD . 4 . HD1# 1 1
18 1 1 1 1 2 HIS HA . 1 . HA 1 1
18 1 2 1 1 5 LEU HG . 4 . HG 1 1
19 1 1 1 1 2 HIS HA . 1 . HA 1 1
19 1 2 1 1 6 HIS HD2 . 5 . HD2 1 1
20 1 1 1 1 2 HIS QB . 1 . HB# 1 1
20 1 2 1 1 2 HIS HD2 . 1 . HD2 1 1
21 1 1 1 1 2 HIS QB . 1 . HB# 1 1
21 1 2 1 1 2 HIS HE1 . 1 . HE1 1 1
22 1 1 1 1 2 HIS QB . 1 . HB# 1 1
22 1 2 1 1 3 . HN . 2 . HN 1 1
23 1 1 1 1 2 HIS QB . 1 . HB# 1 1
23 1 2 1 1 4 ILE H . 3 . HN 1 1
24 1 1 1 1 2 HIS QB . 1 . HB# 1 1
24 1 2 1 1 4 ILE MD . 3 . HD1# 1 1
25 1 1 1 1 2 HIS QB . 1 . HB# 1 1
25 1 2 1 1 5 LEU H . 4 . HN 1 1
26 1 1 1 1 2 HIS QB . 1 . HB# 1 1
26 1 2 1 1 5 LEU QB . 4 . HB1 1 1
27 1 1 1 1 2 HIS QB . 1 . HB# 1 1
27 1 2 1 1 5 LEU QD . 4 . HD1# 1 1
28 1 1 1 1 2 HIS QB . 1 . HB# 1 1
28 1 2 1 1 6 HIS H . 5 . HN 1 1
29 1 1 1 1 2 HIS QB . 1 . HB# 1 1
29 1 2 1 1 6 HIS HD2 . 5 . HD2 1 1
30 1 1 1 1 2 HIS HD2 . 1 . HD2 1 1
30 1 2 1 1 3 . HN . 2 . HN 1 1
31 1 1 1 1 2 HIS HD2 . 1 . HD2 1 1
31 1 2 1 1 5 LEU QB . 4 . HB1 1 1
32 1 1 1 1 2 HIS HD2 . 1 . HD2 1 1
32 1 2 1 1 5 LEU QD . 4 . HD1# 1 1
33 1 1 1 1 2 HIS HD2 . 1 . HD2 1 1
33 1 2 1 1 5 LEU HG . 4 . HG 1 1
34 1 1 1 1 2 HIS HD2 . 1 . HD2 1 1
34 1 2 1 1 6 HIS H . 5 . HN 1 1
35 1 1 1 1 2 HIS HD2 . 1 . HD2 1 1
35 1 2 1 1 6 HIS QB . 5 . HB2 1 1
36 1 1 1 1 2 HIS HE1 . 1 . HE1 1 1
36 1 2 1 1 5 LEU QB . 4 . HB1 1 1
37 1 1 1 1 2 HIS HE1 . 1 . HE1 1 1
37 1 2 1 1 5 LEU QD . 4 . HD1# 1 1
38 1 1 1 1 3 . HN . 2 . HN 1 1
38 1 2 1 1 4 ILE H . 3 . HN 1 1
39 1 1 1 1 3 . HN . 2 . HN 1 1
39 1 2 1 1 4 ILE MD . 3 . HD1# 1 1
40 1 1 1 1 3 . HN . 2 . HN 1 1
40 1 2 1 1 5 LEU H . 4 . HN 1 1
41 1 1 1 1 3 . HN . 2 . HN 1 1
41 1 2 1 1 6 HIS H . 5 . HN 1 1
42 1 1 1 1 4 ILE H . 3 . HN 1 1
42 1 2 1 1 4 ILE HA . 3 . HA 1 1
43 1 1 1 1 4 ILE H . 3 . HN 1 1
43 1 2 1 1 4 ILE HB . 3 . HB 1 1
44 1 1 1 1 4 ILE H . 3 . HN 1 1
44 1 2 1 1 4 ILE MD . 3 . HD1# 1 1
45 1 1 1 1 4 ILE H . 3 . HN 1 1
45 1 2 1 1 4 ILE QG . 3 . HG11 1 1
46 1 1 1 1 4 ILE H . 3 . HN 1 1
46 1 2 1 1 4 ILE MG . 3 . HG2# 1 1
47 1 1 1 1 4 ILE H . 3 . HN 1 1
47 1 2 1 1 5 LEU H . 4 . HN 1 1
48 1 1 1 1 4 ILE H . 3 . HN 1 1
48 1 2 1 1 6 HIS H . 5 . HN 1 1
49 1 1 1 1 4 ILE HA . 3 . HA 1 1
49 1 2 1 1 4 ILE HB . 3 . HB 1 1
50 1 1 1 1 4 ILE HA . 3 . HA 1 1
50 1 2 1 1 4 ILE MD . 3 . HD1# 1 1
51 1 1 1 1 4 ILE HA . 3 . HA 1 1
51 1 2 1 1 4 ILE QG . 3 . HG11 1 1
52 1 1 1 1 4 ILE HA . 3 . HA 1 1
52 1 2 1 1 4 ILE MG . 3 . HG2# 1 1
53 1 1 1 1 4 ILE HA . 3 . HA 1 1
53 1 2 1 1 5 LEU H . 4 . HN 1 1
54 1 1 1 1 4 ILE HA . 3 . HA 1 1
54 1 2 1 1 6 HIS H . 5 . HN 1 1
55 1 1 1 1 4 ILE HA . 3 . HA 1 1
55 1 2 1 1 7 . HN . 6 . HN 1 1
56 1 1 1 1 4 ILE HA . 3 . HA 1 1
56 1 2 1 1 8 LEU H . 7 . HN 1 1
57 1 1 1 1 4 ILE HB . 3 . HB 1 1
57 1 2 1 1 4 ILE MD . 3 . HD1# 1 1
58 1 1 1 1 4 ILE HB . 3 . HB 1 1
58 1 2 1 1 4 ILE QG . 3 . HG11 1 1
59 1 1 1 1 4 ILE HB . 3 . HB 1 1
59 1 2 1 1 4 ILE MG . 3 . HG2# 1 1
60 1 1 1 1 4 ILE HB . 3 . HB 1 1
60 1 2 1 1 5 LEU H . 4 . HN 1 1
61 1 1 1 1 4 ILE HB . 3 . HB 1 1
61 1 2 1 1 5 LEU HA . 4 . HA 1 1
62 1 1 1 1 4 ILE HB . 3 . HB 1 1
62 1 2 1 1 5 LEU QB . 4 . HB2 1 1
63 1 1 1 1 4 ILE MD . 3 . HD1# 1 1
63 1 2 1 1 4 ILE QG . 3 . HG11 1 1
64 1 1 1 1 4 ILE MD . 3 . HD1# 1 1
64 1 2 1 1 5 LEU H . 4 . HN 1 1
65 1 1 1 1 4 ILE MD . 3 . HD1# 1 1
65 1 2 1 1 5 LEU QB . 4 . HB2 1 1
66 1 1 1 1 4 ILE MD . 3 . HD1# 1 1
66 1 2 1 1 6 HIS H . 5 . HN 1 1
67 1 1 1 1 4 ILE QG . 3 . HG11 1 1
67 1 2 1 1 4 ILE MG . 3 . HG2# 1 1
68 1 1 1 1 4 ILE QG . 3 . HG11 1 1
68 1 2 1 1 5 LEU H . 4 . HN 1 1
69 1 1 1 1 4 ILE QG . 3 . HG12 1 1
69 1 2 1 1 5 LEU HG . 4 . HG 1 1
70 1 1 1 1 4 ILE MG . 3 . HG2# 1 1
70 1 2 1 1 5 LEU H . 4 . HN 1 1
71 1 1 1 1 4 ILE MG . 3 . HG2# 1 1
71 1 2 1 1 5 LEU HA . 4 . HA 1 1
72 1 1 1 1 4 ILE MG . 3 . HG2# 1 1
72 1 2 1 1 7 . HN . 6 . HN 1 1
73 1 1 1 1 4 ILE MG . 3 . HG2# 1 1
73 1 2 1 1 8 LEU QB . 7 . HB2 1 1
74 1 1 1 1 4 ILE MG . 3 . HG2# 1 1
74 1 2 1 1 8 LEU QD . 7 . HD2# 1 1
75 1 1 1 1 5 LEU H . 4 . HN 1 1
75 1 2 1 1 5 LEU HA . 4 . HA 1 1
76 1 1 1 1 5 LEU H . 4 . HN 1 1
76 1 2 1 1 5 LEU QB . 4 . HB1 1 1
77 1 1 1 1 5 LEU H . 4 . HN 1 1
77 1 2 1 1 5 LEU QD . 4 . HD1# 1 1
78 1 1 1 1 5 LEU H . 4 . HN 1 1
78 1 2 1 1 5 LEU HG . 4 . HG 1 1
79 1 1 1 1 5 LEU H . 4 . HN 1 1
79 1 2 1 1 6 HIS H . 5 . HN 1 1
80 1 1 1 1 5 LEU H . 4 . HN 1 1
80 1 2 1 1 6 HIS QB . 5 . HB2 1 1
81 1 1 1 1 5 LEU H . 4 . HN 1 1
81 1 2 1 1 7 . HN . 6 . HN 1 1
82 1 1 1 1 5 LEU HA . 4 . HA 1 1
82 1 2 1 1 5 LEU QB . 4 . HB1 1 1
83 1 1 1 1 5 LEU HA . 4 . HA 1 1
83 1 2 1 1 5 LEU QD . 4 . HD1# 1 1
84 1 1 1 1 5 LEU HA . 4 . HA 1 1
84 1 2 1 1 5 LEU HG . 4 . HG 1 1
85 1 1 1 1 5 LEU HA . 4 . HA 1 1
85 1 2 1 1 6 HIS H . 5 . HN 1 1
86 1 1 1 1 5 LEU HA . 4 . HA 1 1
86 1 2 1 1 6 HIS HA . 5 . HA 1 1
87 1 1 1 1 5 LEU HA . 4 . HA 1 1
87 1 2 1 1 7 . HN . 6 . HN 1 1
88 1 1 1 1 5 LEU HA . 4 . HA 1 1
88 1 2 1 1 8 LEU H . 7 . HN 1 1
89 1 1 1 1 5 LEU HA . 4 . HA 1 1
89 1 2 1 1 8 LEU QB . 7 . HB1 1 1
90 1 1 1 1 5 LEU HA . 4 . HA 1 1
90 1 2 1 1 8 LEU QD . 7 . HD2# 1 1
91 1 1 1 1 5 LEU HA . 4 . HA 1 1
91 1 2 1 1 8 LEU HG . 7 . HG 1 1
92 1 1 1 1 5 LEU HA . 4 . HA 1 1
92 1 2 1 1 9 LEU H . 8 . HN 1 1
93 1 1 1 1 5 LEU HA . 4 . HA 1 1
93 1 2 1 1 9 LEU QD . 8 . HD2# 1 1
94 1 1 1 1 5 LEU HA . 4 . HA 1 1
94 1 2 1 1 9 LEU HG . 8 . HG 1 1
95 1 1 1 1 5 LEU QB . 4 . HB1 1 1
95 1 2 1 1 5 LEU QD . 4 . HD1# 1 1
96 1 1 1 1 5 LEU QB . 4 . HB1 1 1
96 1 2 1 1 6 HIS H . 5 . HN 1 1
97 1 1 1 1 5 LEU QB . 4 . HB1 1 1
97 1 2 1 1 6 HIS HA . 5 . HA 1 1
98 1 1 1 1 5 LEU QB . 4 . HB1 1 1
98 1 2 1 1 6 HIS QB . 5 . HB2 1 1
99 1 1 1 1 5 LEU QB . 4 . HB1 1 1
99 1 2 1 1 6 HIS HD2 . 5 . HD2 1 1
100 1 1 1 1 5 LEU QB . 4 . HB1 1 1
100 1 2 1 1 9 LEU QD . 8 . HD1# 1 1
101 1 1 1 1 5 LEU QD . 4 . HD1# 1 1
101 1 2 1 1 5 LEU HG . 4 . HG 1 1
102 1 1 1 1 5 LEU QD . 4 . HD1# 1 1
102 1 2 1 1 6 HIS H . 5 . HN 1 1
103 1 1 1 1 5 LEU QD . 4 . HD2# 1 1
103 1 2 1 1 6 HIS HA . 5 . HA 1 1
104 1 1 1 1 5 LEU QD . 4 . HD2# 1 1
104 1 2 1 1 6 HIS QB . 5 . HB1 1 1
105 1 1 1 1 5 LEU QD . 4 . HD1# 1 1
105 1 2 1 1 6 HIS HD2 . 5 . HD2 1 1
106 1 1 1 1 5 LEU QD . 4 . HD2# 1 1
106 1 2 1 1 8 LEU H . 7 . HN 1 1
107 1 1 1 1 5 LEU QD . 4 . HD2# 1 1
107 1 2 1 1 8 LEU QB . 7 . HB1 1 1
108 1 1 1 1 5 LEU QD . 4 . HD2# 1 1
108 1 2 1 1 9 LEU H . 8 . HN 1 1
109 1 1 1 1 5 LEU QD . 4 . HD2# 1 1
109 1 2 1 1 9 LEU QB . 8 . HB2 1 1
110 1 1 1 1 5 LEU QD . 4 . HD2# 1 1
110 1 2 1 1 9 LEU QD . 8 . HD1# 1 1
111 1 1 1 1 5 LEU QD . 4 . HD2# 1 1
111 1 2 1 1 9 LEU HG . 8 . HG 1 1
112 1 1 1 1 5 LEU HG . 4 . HG 1 1
112 1 2 1 1 6 HIS H . 5 . HN 1 1
113 1 1 1 1 5 LEU HG . 4 . HG 1 1
113 1 2 1 1 6 HIS HD2 . 5 . HD2 1 1
114 1 1 1 1 5 LEU HG . 4 . HG 1 1
114 1 2 1 1 8 LEU QB . 7 . HB1 1 1
115 1 1 1 1 5 LEU HG . 4 . HG 1 1
115 1 2 1 1 9 LEU QD . 8 . HD1# 1 1
116 1 1 1 1 6 HIS H . 5 . HN 1 1
116 1 2 1 1 6 HIS HA . 5 . HA 1 1
117 1 1 1 1 6 HIS H . 5 . HN 1 1
117 1 2 1 1 6 HIS QB . 5 . HB1 1 1
118 1 1 1 1 6 HIS H . 5 . HN 1 1
118 1 2 1 1 6 HIS HD2 . 5 . HD2 1 1
119 1 1 1 1 6 HIS H . 5 . HN 1 1
119 1 2 1 1 7 . HN . 6 . HN 1 1
120 1 1 1 1 6 HIS H . 5 . HN 1 1
120 1 2 1 1 8 LEU H . 7 . HN 1 1
121 1 1 1 1 6 HIS H . 5 . HN 1 1
121 1 2 1 1 8 LEU QB . 7 . HB2 1 1
122 1 1 1 1 6 HIS H . 5 . HN 1 1
122 1 2 1 1 9 LEU H . 8 . HN 1 1
123 1 1 1 1 6 HIS H . 5 . HN 1 1
123 1 2 1 1 9 LEU QD . 8 . HD1# 1 1
124 1 1 1 1 6 HIS HA . 5 . HA 1 1
124 1 2 1 1 6 HIS HD2 . 5 . HD2 1 1
125 1 1 1 1 6 HIS HA . 5 . HA 1 1
125 1 2 1 1 6 HIS HE1 . 5 . HE1 1 1
126 1 1 1 1 6 HIS HA . 5 . HA 1 1
126 1 2 1 1 7 . HN . 6 . HN 1 1
127 1 1 1 1 6 HIS HA . 5 . HA 1 1
127 1 2 1 1 8 LEU H . 7 . HN 1 1
128 1 1 1 1 6 HIS HA . 5 . HA 1 1
128 1 2 1 1 8 LEU QB . 7 . HB1 1 1
129 1 1 1 1 6 HIS HA . 5 . HA 1 1
129 1 2 1 1 9 LEU H . 8 . HN 1 1
130 1 1 1 1 6 HIS HA . 5 . HA 1 1
130 1 2 1 1 9 LEU QB . 8 . HB1 1 1
131 1 1 1 1 6 HIS HA . 5 . HA 1 1
131 1 2 1 1 9 LEU QD . 8 . HD2# 1 1
132 1 1 1 1 6 HIS HA . 5 . HA 1 1
132 1 2 1 1 9 LEU HG . 8 . HG 1 1
133 1 1 1 1 6 HIS HA . 5 . HA 1 1
133 1 2 1 1 10 GLN H . 9 . HN 1 1
134 1 1 1 1 6 HIS HA . 5 . HA 1 1
134 1 2 1 1 10 GLN QG . 9 . HG# 1 1
135 1 1 1 1 6 HIS QB . 5 . HB1 1 1
135 1 2 1 1 6 HIS HD2 . 5 . HD2 1 1
136 1 1 1 1 6 HIS QB . 5 . HB1 1 1
136 1 2 1 1 6 HIS HE1 . 5 . HE1 1 1
137 1 1 1 1 6 HIS QB . 5 . HB1 1 1
137 1 2 1 1 7 . HN . 6 . HN 1 1
138 1 1 1 1 6 HIS QB . 5 . HB1 1 1
138 1 2 1 1 8 LEU H . 7 . HN 1 1
139 1 1 1 1 6 HIS QB . 5 . HB2 1 1
139 1 2 1 1 9 LEU QD . 8 . HD1# 1 1
140 1 1 1 1 6 HIS QB . 5 . HB1 1 1
140 1 2 1 1 10 GLN H . 9 . HN 1 1
141 1 1 1 1 6 HIS QB . 5 . HB1 1 1
141 1 2 1 1 10 GLN HB2 . 9 . HB2 1 1
142 1 1 1 1 6 HIS QB . 5 . HB1 1 1
142 1 2 1 1 10 GLN QE . 9 . HE21 1 1
143 1 1 1 1 6 HIS QB . 5 . HB1 1 1
143 1 2 1 1 10 GLN QG . 9 . HG# 1 1
144 1 1 1 1 6 HIS HD2 . 5 . HD2 1 1
144 1 2 1 1 9 LEU QD . 8 . HD1# 1 1
145 1 1 1 1 6 HIS HE1 . 5 . HE1 1 1
145 1 2 1 1 9 LEU QD . 8 . HD1# 1 1
146 1 1 1 1 6 HIS HE1 . 5 . HE1 1 1
146 1 2 1 1 10 GLN QE . 9 . HE21 1 1
147 1 1 1 1 6 HIS HE1 . 5 . HE1 1 1
147 1 2 1 1 10 GLN QG . 9 . HG# 1 1
148 1 1 1 1 7 . HN . 6 . HN 1 1
148 1 2 1 1 8 LEU H . 7 . HN 1 1
149 1 1 1 1 7 . HN . 6 . HN 1 1
149 1 2 1 1 8 LEU QB . 7 . HB2 1 1
150 1 1 1 1 7 . HN . 6 . HN 1 1
150 1 2 1 1 9 LEU H . 8 . HN 1 1
151 1 1 1 1 7 . HN . 6 . HN 1 1
151 1 2 1 1 10 GLN H . 9 . HN 1 1
152 1 1 1 1 7 . HN . 6 . HN 1 1
152 1 2 1 1 10 GLN QG . 9 . HG# 1 1
153 1 1 1 1 8 LEU H . 7 . HN 1 1
153 1 2 1 1 8 LEU HA . 7 . HA 1 1
154 1 1 1 1 8 LEU H . 7 . HN 1 1
154 1 2 1 1 8 LEU QB . 7 . HB1 1 1
155 1 1 1 1 8 LEU H . 7 . HN 1 1
155 1 2 1 1 8 LEU QD . 7 . HD1# 1 1
156 1 1 1 1 8 LEU H . 7 . HN 1 1
156 1 2 1 1 8 LEU HG . 7 . HG 1 1
157 1 1 1 1 8 LEU H . 7 . HN 1 1
157 1 2 1 1 9 LEU H . 8 . HN 1 1
158 1 1 1 1 8 LEU H . 7 . HN 1 1
158 1 2 1 1 9 LEU QD . 8 . HD1# 1 1
159 1 1 1 1 8 LEU H . 7 . HN 1 1
159 1 2 1 1 9 LEU HG . 8 . HG 1 1
160 1 1 1 1 8 LEU H . 7 . HN 1 1
160 1 2 1 1 10 GLN H . 9 . HN 1 1
161 1 1 1 1 8 LEU H . 7 . HN 1 1
161 1 2 1 1 10 GLN QG . 9 . HG# 1 1
162 1 1 1 1 8 LEU H . 7 . HN 1 1
162 1 2 1 1 11 ASP H . 10 . HN 1 1
163 1 1 1 1 8 LEU HA . 7 . HA 1 1
163 1 2 1 1 8 LEU QB . 7 . HB1 1 1
164 1 1 1 1 8 LEU HA . 7 . HA 1 1
164 1 2 1 1 8 LEU QD . 7 . HD1# 1 1
165 1 1 1 1 8 LEU HA . 7 . HA 1 1
165 1 2 1 1 8 LEU HG . 7 . HG 1 1
166 1 1 1 1 8 LEU HA . 7 . HA 1 1
166 1 2 1 1 9 LEU H . 8 . HN 1 1
167 1 1 1 1 8 LEU HA . 7 . HA 1 1
167 1 2 1 1 9 LEU HA . 8 . HA 1 1
168 1 1 1 1 8 LEU HA . 7 . HA 1 1
168 1 2 1 1 10 GLN H . 9 . HN 1 1
169 1 1 1 1 8 LEU HA . 7 . HA 1 1
169 1 2 1 1 11 ASP H . 10 . HN 1 1
170 1 1 1 1 8 LEU HA . 7 . HA 1 1
170 1 2 1 1 11 ASP QB . 10 . HB1 1 1
171 1 1 1 1 8 LEU HA . 7 . HA 1 1
171 1 2 1 1 12 SER H . 11 . HN 1 1
172 1 1 1 1 8 LEU QB . 7 . HB1 1 1
172 1 2 1 1 8 LEU QD . 7 . HD1# 1 1
173 1 1 1 1 8 LEU QB . 7 . HB1 1 1
173 1 2 1 1 8 LEU HG . 7 . HG 1 1
174 1 1 1 1 8 LEU QB . 7 . HB1 1 1
174 1 2 1 1 9 LEU H . 8 . HN 1 1
175 1 1 1 1 8 LEU QB . 7 . HB1 1 1
175 1 2 1 1 9 LEU HA . 8 . HA 1 1
176 1 1 1 1 8 LEU QB . 7 . HB1 1 1
176 1 2 1 1 9 LEU QD . 8 . HD1# 1 1
177 1 1 1 1 8 LEU QB . 7 . HB1 1 1
177 1 2 1 1 9 LEU HG . 8 . HG 1 1
178 1 1 1 1 8 LEU MD1 . 7 . HD1# 1 1
178 1 2 1 1 8 LEU MD2 . 7 . HD2# 1 1
179 1 1 1 1 8 LEU QD . 7 . HD1# 1 1
179 1 2 1 1 8 LEU HG . 7 . HG 1 1
180 1 1 1 1 8 LEU QD . 7 . HD1# 1 1
180 1 2 1 1 9 LEU H . 8 . HN 1 1
181 1 1 1 1 8 LEU QD . 7 . HD2# 1 1
181 1 2 1 1 9 LEU HA . 8 . HA 1 1
182 1 1 1 1 8 LEU QD . 7 . HD2# 1 1
182 1 2 1 1 9 LEU QD . 8 . HD1# 1 1
183 1 1 1 1 8 LEU QD . 7 . HD1# 1 1
183 1 2 1 1 11 ASP QB . 10 . HB1 1 1
184 1 1 1 1 8 LEU QD . 7 . HD1# 1 1
184 1 2 1 1 12 SER H . 11 . HN 1 1
185 1 1 1 1 8 LEU HG . 7 . HG 1 1
185 1 2 1 1 9 LEU H . 8 . HN 1 1
186 1 1 1 1 8 LEU HG . 7 . HG 1 1
186 1 2 1 1 9 LEU HA . 8 . HA 1 1
187 1 1 1 1 8 LEU HG . 7 . HG 1 1
187 1 2 1 1 9 LEU QD . 8 . HD2# 1 1
188 1 1 1 1 8 LEU HG . 7 . HG 1 1
188 1 2 1 1 12 SER QB . 11 . HB1 1 1
189 1 1 1 1 9 LEU H . 8 . HN 1 1
189 1 2 1 1 9 LEU HA . 8 . HA 1 1
190 1 1 1 1 9 LEU H . 8 . HN 1 1
190 1 2 1 1 9 LEU QB . 8 . HB1 1 1
191 1 1 1 1 9 LEU H . 8 . HN 1 1
191 1 2 1 1 9 LEU QD . 8 . HD1# 1 1
192 1 1 1 1 9 LEU H . 8 . HN 1 1
192 1 2 1 1 9 LEU HG . 8 . HG 1 1
193 1 1 1 1 9 LEU H . 8 . HN 1 1
193 1 2 1 1 10 GLN H . 9 . HN 1 1
194 1 1 1 1 9 LEU H . 8 . HN 1 1
194 1 2 1 1 10 GLN HB2 . 9 . HB2 1 1
195 1 1 1 1 9 LEU H . 8 . HN 1 1
195 1 2 1 1 10 GLN QG . 9 . HG# 1 1
196 1 1 1 1 9 LEU H . 8 . HN 1 1
196 1 2 1 1 11 ASP H . 10 . HN 1 1
197 1 1 1 1 9 LEU H . 8 . HN 1 1
197 1 2 1 1 12 SER H . 11 . HN 1 1
198 1 1 1 1 9 LEU HA . 8 . HA 1 1
198 1 2 1 1 9 LEU QB . 8 . HB1 1 1
199 1 1 1 1 9 LEU HA . 8 . HA 1 1
199 1 2 1 1 9 LEU QD . 8 . HD1# 1 1
200 1 1 1 1 9 LEU HA . 8 . HA 1 1
200 1 2 1 1 9 LEU HG . 8 . HG 1 1
201 1 1 1 1 9 LEU HA . 8 . HA 1 1
201 1 2 1 1 10 GLN H . 9 . HN 1 1
202 1 1 1 1 9 LEU HA . 8 . HA 1 1
202 1 2 1 1 11 ASP H . 10 . HN 1 1
203 1 1 1 1 9 LEU HA . 8 . HA 1 1
203 1 2 1 1 12 SER H . 11 . HN 1 1
204 1 1 1 1 9 LEU HA . 8 . HA 1 1
204 1 2 1 1 12 SER QB . 11 . HB1 1 1
205 1 1 1 1 9 LEU HA . 8 . HA 1 1
205 1 2 1 1 13 NH2 HN1 . 12 . HN1 1 1
206 1 1 1 1 9 LEU QB . 8 . HB1 1 1
206 1 2 1 1 9 LEU QD . 8 . HD1# 1 1
207 1 1 1 1 9 LEU QB . 8 . HB1 1 1
207 1 2 1 1 9 LEU HG . 8 . HG 1 1
208 1 1 1 1 9 LEU QB . 8 . HB1 1 1
208 1 2 1 1 10 GLN H . 9 . HN 1 1
209 1 1 1 1 9 LEU QB . 8 . HB1 1 1
209 1 2 1 1 10 GLN HA . 9 . HA 1 1
210 1 1 1 1 9 LEU QB . 8 . HB1 1 1
210 1 2 1 1 10 GLN QG . 9 . HG# 1 1
211 1 1 1 1 9 LEU MD1 . 8 . HD1# 1 1
211 1 2 1 1 9 LEU MD2 . 8 . HD2# 1 1
212 1 1 1 1 9 LEU QD . 8 . HD1# 1 1
212 1 2 1 1 9 LEU HG . 8 . HG 1 1
213 1 1 1 1 9 LEU QD . 8 . HD1# 1 1
213 1 2 1 1 10 GLN H . 9 . HN 1 1
214 1 1 1 1 9 LEU QD . 8 . HD1# 1 1
214 1 2 1 1 10 GLN QG . 9 . HG# 1 1
215 1 1 1 1 9 LEU QD . 8 . HD2# 1 1
215 1 2 1 1 12 SER QB . 11 . HB2 1 1
216 1 1 1 1 9 LEU HG . 8 . HG 1 1
216 1 2 1 1 10 GLN H . 9 . HN 1 1
217 1 1 1 1 10 GLN H . 9 . HN 1 1
217 1 2 1 1 10 GLN HA . 9 . HA 1 1
218 1 1 1 1 10 GLN H . 9 . HN 1 1
218 1 2 1 1 10 GLN HB2 . 9 . HB2 1 1
219 1 1 1 1 10 GLN H . 9 . HN 1 1
219 1 2 1 1 10 GLN HB3 . 9 . HB1 1 1
220 1 1 1 1 10 GLN H . 9 . HN 1 1
220 1 2 1 1 10 GLN QE . 9 . HE21 1 1
221 1 1 1 1 10 GLN H . 9 . HN 1 1
221 1 2 1 1 10 GLN QG . 9 . HG# 1 1
222 1 1 1 1 10 GLN H . 9 . HN 1 1
222 1 2 1 1 11 ASP H . 10 . HN 1 1
223 1 1 1 1 10 GLN H . 9 . HN 1 1
223 1 2 1 1 11 ASP QB . 10 . HB1 1 1
224 1 1 1 1 10 GLN H . 9 . HN 1 1
224 1 2 1 1 12 SER H . 11 . HN 1 1
225 1 1 1 1 10 GLN H . 9 . HN 1 1
225 1 2 1 1 13 NH2 HN1 . 12 . HN1 1 1
226 1 1 1 1 10 GLN HA . 9 . HA 1 1
226 1 2 1 1 10 GLN HB2 . 9 . HB2 1 1
227 1 1 1 1 10 GLN HA . 9 . HA 1 1
227 1 2 1 1 10 GLN HB3 . 9 . HB1 1 1
228 1 1 1 1 10 GLN HA . 9 . HA 1 1
228 1 2 1 1 10 GLN QE . 9 . HE21 1 1
229 1 1 1 1 10 GLN HA . 9 . HA 1 1
229 1 2 1 1 10 GLN QG . 9 . HG# 1 1
230 1 1 1 1 10 GLN HA . 9 . HA 1 1
230 1 2 1 1 11 ASP H . 10 . HN 1 1
231 1 1 1 1 10 GLN HA . 9 . HA 1 1
231 1 2 1 1 11 ASP HA . 10 . HA 1 1
232 1 1 1 1 10 GLN HA . 9 . HA 1 1
232 1 2 1 1 12 SER H . 11 . HN 1 1
233 1 1 1 1 10 GLN HA . 9 . HA 1 1
233 1 2 1 1 13 NH2 HN1 . 12 . HN1 1 1
234 1 1 1 1 10 GLN HA . 9 . HA 1 1
234 1 2 1 1 13 NH2 HN2 . 12 . HN2 1 1
235 1 1 1 1 10 GLN HB2 . 9 . HB2 1 1
235 1 2 1 1 10 GLN QE . 9 . HE21 1 1
236 1 1 1 1 10 GLN HB2 . 9 . HB2 1 1
236 1 2 1 1 10 GLN QG . 9 . HG# 1 1
237 1 1 1 1 10 GLN HB2 . 9 . HB2 1 1
237 1 2 1 1 11 ASP H . 10 . HN 1 1
238 1 1 1 1 10 GLN HB2 . 9 . HB2 1 1
238 1 2 1 1 11 ASP HA . 10 . HA 1 1
239 1 1 1 1 10 GLN HB2 . 9 . HB2 1 1
239 1 2 1 1 11 ASP QB . 10 . HB2 1 1
240 1 1 1 1 10 GLN HB3 . 9 . HB1 1 1
240 1 2 1 1 10 GLN QE . 9 . HE21 1 1
241 1 1 1 1 10 GLN HB3 . 9 . HB1 1 1
241 1 2 1 1 10 GLN QG . 9 . HG# 1 1
242 1 1 1 1 10 GLN HB3 . 9 . HB1 1 1
242 1 2 1 1 11 ASP H . 10 . HN 1 1
243 1 1 1 1 10 GLN HB3 . 9 . HB1 1 1
243 1 2 1 1 11 ASP HA . 10 . HA 1 1
244 1 1 1 1 10 GLN QG . 9 . HG# 1 1
244 1 2 1 1 11 ASP H . 10 . HN 1 1
245 1 1 1 1 11 ASP H . 10 . HN 1 1
245 1 2 1 1 11 ASP HA . 10 . HA 1 1
246 1 1 1 1 11 ASP H . 10 . HN 1 1
246 1 2 1 1 11 ASP QB . 10 . HB1 1 1
247 1 1 1 1 11 ASP H . 10 . HN 1 1
247 1 2 1 1 12 SER H . 11 . HN 1 1
248 1 1 1 1 11 ASP H . 10 . HN 1 1
248 1 2 1 1 12 SER QB . 11 . HB2 1 1
249 1 1 1 1 11 ASP H . 10 . HN 1 1
249 1 2 1 1 13 NH2 HN1 . 12 . HN1 1 1
250 1 1 1 1 11 ASP HA . 10 . HA 1 1
250 1 2 1 1 11 ASP QB . 10 . HB1 1 1
251 1 1 1 1 11 ASP HA . 10 . HA 1 1
251 1 2 1 1 12 SER H . 11 . HN 1 1
252 1 1 1 1 11 ASP HA . 10 . HA 1 1
252 1 2 1 1 12 SER HA . 11 . HA 1 1
253 1 1 1 1 11 ASP HA . 10 . HA 1 1
253 1 2 1 1 13 NH2 HN1 . 12 . HN1 1 1
254 1 1 1 1 11 ASP QB . 10 . HB1 1 1
254 1 2 1 1 12 SER H . 11 . HN 1 1
255 1 1 1 1 11 ASP QB . 10 . HB1 1 1
255 1 2 1 1 12 SER HA . 11 . HA 1 1
256 1 1 1 1 11 ASP QB . 10 . HB1 1 1
256 1 2 1 1 12 SER QB . 11 . HB1 1 1
257 1 1 1 1 11 ASP QB . 10 . HB1 1 1
257 1 2 1 1 13 NH2 HN1 . 12 . HN1 1 1
258 1 1 1 1 12 SER H . 11 . HN 1 1
258 1 2 1 1 12 SER HA . 11 . HA 1 1
259 1 1 1 1 12 SER H . 11 . HN 1 1
259 1 2 1 1 12 SER QB . 11 . HB1 1 1
260 1 1 1 1 12 SER H . 11 . HN 1 1
260 1 2 1 1 13 NH2 HN1 . 12 . HN1 1 1
261 1 1 1 1 12 SER H . 11 . HN 1 1
261 1 2 1 1 13 NH2 HN2 . 12 . HN2 1 1
262 1 1 1 1 12 SER HA . 11 . HA 1 1
262 1 2 1 1 12 SER QB . 11 . HB1 1 1
263 1 1 1 1 12 SER HA . 11 . HA 1 1
263 1 2 1 1 13 NH2 HN1 . 12 . HN1 1 1
264 1 1 1 1 12 SER HA . 11 . HA 1 1
264 1 2 1 1 13 NH2 HN2 . 12 . HN2 1 1
265 1 1 1 1 12 SER QB . 11 . HB1 1 1
265 1 2 1 1 13 NH2 HN1 . 12 . HN1 1 1
266 1 1 1 1 12 SER QB . 11 . HB1 1 1
266 1 2 1 1 13 NH2 HN2 . 12 . HN2 1 1
267 1 1 1 1 13 NH2 HN1 . 12 . HN1 1 1
267 1 2 1 1 13 NH2 HN2 . 12 . HN2 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 . . . . . 0.0 -1.8 2.97383 1 1
2 1 . . . . . 0.0 -1.8 2.6294 1 1
3 1 . . . . . 0.0 -1.8 4.72369 1 1
4 1 . . . . . 0.0 -1.8 4.2726 1 1
5 1 . . . . . 0.0 -1.8 3.49699 1 1
6 1 . . . . . 0.0 -1.8 4.41045 1 1
7 1 . . . . . 0.0 -1.8 2.57594 1 1
8 1 . . . . . 0.0 -1.8 4.09519 1 1
9 1 . . . . . 0.0 -1.8 4.82976 1 1
10 1 . . . . . 0.0 -1.8 3.49125 1 1
11 1 . . . . . 0.0 -1.8 3.90545 1 1
12 1 . . . . . 0.0 -1.8 4.79486 1 1
13 1 . . . . . 0.0 -1.8 3.82917 1 1
14 1 . . . . . 0.0 -1.8 4.35001 1 1
15 1 . . . . . 0.0 -1.8 3.42529 1 1
16 1 . . . . . 0.0 -1.8 3.34145 1 1
17 1 . . . . . 0.0 -1.8 3.10774 1 1
18 1 . . . . . 0.0 -1.8 4.48513 1 1
19 1 . . . . . 0.0 -1.8 4.78494 1 1
20 1 . . . . . 0.0 -1.8 2.78873 1 1
21 1 . . . . . 0.0 -1.8 4.56077 1 1
22 1 . . . . . 0.0 -1.8 3.42812 1 1
23 1 . . . . . 0.0 -1.8 4.90926 1 1
24 1 . . . . . 0.0 -1.8 4.761 1 1
25 1 . . . . . 0.0 -1.8 4.51676 1 1
26 1 . . . . . 0.0 -1.8 2.8779 1 1
27 1 . . . . . 0.0 -1.8 2.73908 1 1
28 1 . . . . . 0.0 -1.8 4.6336 1 1
29 1 . . . . . 0.0 -1.8 3.44439 1 1
30 1 . . . . . 0.0 -1.8 4.97141 1 1
31 1 . . . . . 0.0 -1.8 4.75179 1 1
32 1 . . . . . 0.0 -1.8 3.4671 1 1
33 1 . . . . . 0.0 -1.8 4.99293 1 1
34 1 . . . . . 0.0 -1.8 4.81273 1 1
35 1 . . . . . 0.0 -1.8 4.46709 1 1
36 1 . . . . . 0.0 -1.8 4.7369 1 1
37 1 . . . . . 0.0 -1.8 3.58381 1 1
38 1 . . . . . 0.0 -1.8 2.96734 1 1
39 1 . . . . . 0.0 -1.8 3.17155 1 1
40 1 . . . . . 0.0 -1.8 4.20096 1 1
41 1 . . . . . 0.0 -1.8 4.96202 1 1
42 1 . . . . . 0.0 -1.8 2.91509 1 1
43 1 . . . . . 0.0 -1.8 3.05074 1 1
44 1 . . . . . 0.0 -1.8 2.43012 1 1
45 1 . . . . . 0.0 -1.8 2.56952 1 1
46 1 . . . . . 0.0 -1.8 3.81933 1 1
47 1 . . . . . 0.0 -1.8 2.76362 1 1
48 1 . . . . . 0.0 -1.8 4.47025 1 1
49 1 . . . . . 0.0 -1.8 3.03386 1 1
50 1 . . . . . 0.0 -1.8 3.49659 1 1
51 1 . . . . . 0.0 -1.8 2.97576 1 1
52 1 . . . . . 0.0 -1.8 2.54794 1 1
53 1 . . . . . 0.0 -1.8 3.61883 1 1
54 1 . . . . . 0.0 -1.8 4.2452 1 1
55 1 . . . . . 0.0 -1.8 3.61599 1 1
56 1 . . . . . 0.0 -1.8 4.41169 1 1
57 1 . . . . . 0.0 -1.8 3.44935 1 1
58 1 . . . . . 0.0 -1.8 2.59088 1 1
59 1 . . . . . 0.0 -1.8 2.18075 1 1
60 1 . . . . . 0.0 -1.8 2.69706 1 1
61 1 . . . . . 0.0 -1.8 3.83212 1 1
62 1 . . . . . 0.0 -1.8 4.57126 1 1
63 1 . . . . . 0.0 -1.8 2.20283 1 1
64 1 . . . . . 0.0 -1.8 2.84177 1 1
65 1 . . . . . 0.0 -1.8 4.69255 1 1
66 1 . . . . . 0.0 -1.8 4.95147 1 1
67 1 . . . . . 0.0 -1.8 2.66559 1 1
68 1 . . . . . 0.0 -1.8 4.2106 1 1
69 1 . . . . . 0.0 -1.8 4.97003 1 1
70 1 . . . . . 0.0 -1.8 3.90958 1 1
71 1 . . . . . 0.0 -1.8 4.29602 1 1
72 1 . . . . . 0.0 -1.8 4.90562 1 1
73 1 . . . . . 0.0 -1.8 4.4054 1 1
74 1 . . . . . 0.0 -1.8 4.08144 1 1
75 1 . . . . . 0.0 -1.8 2.89939 1 1
76 1 . . . . . 0.0 -1.8 2.47739 1 1
77 1 . . . . . 0.0 -1.8 3.82025 1 1
78 1 . . . . . 0.0 -1.8 3.32741 1 1
79 1 . . . . . 0.0 -1.8 2.69733 1 1
80 1 . . . . . 0.0 -1.8 4.72731 1 1
81 1 . . . . . 0.0 -1.8 4.58239 1 1
82 1 . . . . . 0.0 -1.8 2.60569 1 1
83 1 . . . . . 0.0 -1.8 3.36436 1 1
84 1 . . . . . 0.0 -1.8 2.65362 1 1
85 1 . . . . . 0.0 -1.8 3.62866 1 1
86 1 . . . . . 0.0 -1.8 4.92095 1 1
87 1 . . . . . 0.0 -1.8 4.53455 1 1
88 1 . . . . . 0.0 -1.8 4.15603 1 1
89 1 . . . . . 0.0 -1.8 2.94861 1 1
90 1 . . . . . 0.0 -1.8 3.68652 1 1
91 1 . . . . . 0.0 -1.8 4.77266 1 1
92 1 . . . . . 0.0 -1.8 4.98284 1 1
93 1 . . . . . 0.0 -1.8 4.67607 1 1
94 1 . . . . . 0.0 -1.8 4.55454 1 1
95 1 . . . . . 0.0 -1.8 2.30352 1 1
96 1 . . . . . 0.0 -1.8 2.63335 1 1
97 1 . . . . . 0.0 -1.8 4.21973 1 1
98 1 . . . . . 0.0 -1.8 4.06825 1 1
99 1 . . . . . 0.0 -1.8 4.70447 1 1
100 1 . . . . . 0.0 -1.8 4.41365 1 1
101 1 . . . . . 0.0 -1.8 2.19457 1 1
102 1 . . . . . 0.0 -1.8 2.57335 1 1
103 1 . . . . . 0.0 -1.8 3.13505 1 1
104 1 . . . . . 0.0 -1.8 3.09425 1 1
105 1 . . . . . 0.0 -1.8 3.61414 1 1
106 1 . . . . . 0.0 -1.8 4.77376 1 1
107 1 . . . . . 0.0 -1.8 4.23899 1 1
108 1 . . . . . 0.0 -1.8 4.30075 1 1
109 1 . . . . . 0.0 -1.8 4.59607 1 1
110 1 . . . . . 0.0 -1.8 2.93457 1 1
111 1 . . . . . 0.0 -1.8 3.03273 1 1
112 1 . . . . . 0.0 -1.8 4.7272 1 1
113 1 . . . . . 0.0 -1.8 4.89102 1 1
114 1 . . . . . 0.0 -1.8 4.88977 1 1
115 1 . . . . . 0.0 -1.8 3.89704 1 1
116 1 . . . . . 0.0 -1.8 2.94311 1 1
117 1 . . . . . 0.0 -1.8 2.24846 1 1
118 1 . . . . . 0.0 -1.8 3.46426 1 1
119 1 . . . . . 0.0 -1.8 2.94351 1 1
120 1 . . . . . 0.0 -1.8 3.81961 1 1
121 1 . . . . . 0.0 -1.8 4.96283 1 1
122 1 . . . . . 0.0 -1.8 4.87899 1 1
123 1 . . . . . 0.0 -1.8 4.11587 1 1
124 1 . . . . . 0.0 -1.8 3.93169 1 1
125 1 . . . . . 0.0 -1.8 4.71796 1 1
126 1 . . . . . 0.0 -1.8 3.6851 1 1
127 1 . . . . . 0.0 -1.8 3.75926 1 1
128 1 . . . . . 0.0 -1.8 4.73648 1 1
129 1 . . . . . 0.0 -1.8 3.43456 1 1
130 1 . . . . . 0.0 -1.8 3.15561 1 1
131 1 . . . . . 0.0 -1.8 3.00653 1 1
132 1 . . . . . 0.0 -1.8 3.36978 1 1
133 1 . . . . . 0.0 -1.8 4.10238 1 1
134 1 . . . . . 0.0 -1.8 3.72826 1 1
135 1 . . . . . 0.0 -1.8 2.99574 1 1
136 1 . . . . . 0.0 -1.8 4.91715 1 1
137 1 . . . . . 0.0 -1.8 3.00666 1 1
138 1 . . . . . 0.0 -1.8 4.76858 1 1
139 1 . . . . . 0.0 -1.8 4.5818 1 1
140 1 . . . . . 0.0 -1.8 4.77542 1 1
141 1 . . . . . 0.0 -1.8 4.92905 1 1
142 1 . . . . . 0.0 -1.8 4.49762 1 1
143 1 . . . . . 0.0 -1.8 3.66276 1 1
144 1 . . . . . 0.0 -1.8 4.27719 1 1
145 1 . . . . . 0.0 -1.8 4.23713 1 1
146 1 . . . . . 0.0 -1.8 4.72552 1 1
147 1 . . . . . 0.0 -1.8 4.53228 1 1
148 1 . . . . . 0.0 -1.8 2.93594 1 1
149 1 . . . . . 0.0 -1.8 4.75104 1 1
150 1 . . . . . 0.0 -1.8 4.32601 1 1
151 1 . . . . . 0.0 -1.8 4.90736 1 1
152 1 . . . . . 0.0 -1.8 4.65541 1 1
153 1 . . . . . 0.0 -1.8 2.94953 1 1
154 1 . . . . . 0.0 -1.8 2.45734 1 1
155 1 . . . . . 0.0 -1.8 3.4585 1 1
156 1 . . . . . 0.0 -1.8 4.62234 1 1
157 1 . . . . . 0.0 -1.8 2.93037 1 1
158 1 . . . . . 0.0 -1.8 4.20548 1 1
159 1 . . . . . 0.0 -1.8 4.19029 1 1
160 1 . . . . . 0.0 -1.8 3.92949 1 1
161 1 . . . . . 0.0 -1.8 4.97732 1 1
162 1 . . . . . 0.0 -1.8 4.88429 1 1
163 1 . . . . . 0.0 -1.8 2.72655 1 1
164 1 . . . . . 0.0 -1.8 2.59389 1 1
165 1 . . . . . 0.0 -1.8 3.42352 1 1
166 1 . . . . . 0.0 -1.8 3.65233 1 1
167 1 . . . . . 0.0 -1.8 4.95915 1 1
168 1 . . . . . 0.0 -1.8 4.69834 1 1
169 1 . . . . . 0.0 -1.8 3.93075 1 1
170 1 . . . . . 0.0 -1.8 3.36601 1 1
171 1 . . . . . 0.0 -1.8 4.2877 1 1
172 1 . . . . . 0.0 -1.8 2.10422 1 1
173 1 . . . . . 0.0 -1.8 2.52837 1 1
174 1 . . . . . 0.0 -1.8 2.79707 1 1
175 1 . . . . . 0.0 -1.8 4.14778 1 1
176 1 . . . . . 0.0 -1.8 3.16283 1 1
177 1 . . . . . 0.0 -1.8 3.1506 1 1
178 1 . . . . . 0.0 -1.8 2.09325 1 1
179 1 . . . . . 0.0 -1.8 2.20286 1 1
180 1 . . . . . 0.0 -1.8 4.2015 1 1
181 1 . . . . . 0.0 -1.8 4.60681 1 1
182 1 . . . . . 0.0 -1.8 3.4396 1 1
183 1 . . . . . 0.0 -1.8 4.25079 1 1
184 1 . . . . . 0.0 -1.8 4.76285 1 1
185 1 . . . . . 0.0 -1.8 4.38594 1 1
186 1 . . . . . 0.0 -1.8 4.38979 1 1
187 1 . . . . . 0.0 -1.8 4.25444 1 1
188 1 . . . . . 0.0 -1.8 4.41775 1 1
189 1 . . . . . 0.0 -1.8 2.95899 1 1
190 1 . . . . . 0.0 -1.8 2.5513 1 1
191 1 . . . . . 0.0 -1.8 2.68565 1 1
192 1 . . . . . 0.0 -1.8 2.65577 1 1
193 1 . . . . . 0.0 -1.8 2.66329 1 1
194 1 . . . . . 0.0 -1.8 4.8435 1 1
195 1 . . . . . 0.0 -1.8 4.21025 1 1
196 1 . . . . . 0.0 -1.8 4.08244 1 1
197 1 . . . . . 0.0 -1.8 4.73736 1 1
198 1 . . . . . 0.0 -1.8 2.74098 1 1
199 1 . . . . . 0.0 -1.8 2.53234 1 1
200 1 . . . . . 0.0 -1.8 3.05909 1 1
201 1 . . . . . 0.0 -1.8 3.60646 1 1
202 1 . . . . . 0.0 -1.8 4.46617 1 1
203 1 . . . . . 0.0 -1.8 3.82689 1 1
204 1 . . . . . 0.0 -1.8 3.94276 1 1
205 1 . . . . . 0.0 -1.8 4.51585 1 1
206 1 . . . . . 0.0 -1.8 2.27694 1 1
207 1 . . . . . 0.0 -1.8 2.69066 1 1
208 1 . . . . . 0.0 -1.8 2.75993 1 1
209 1 . . . . . 0.0 -1.8 4.25598 1 1
210 1 . . . . . 0.0 -1.8 3.12771 1 1
211 1 . . . . . 0.0 -1.8 2.15425 1 1
212 1 . . . . . 0.0 -1.8 2.21655 1 1
213 1 . . . . . 0.0 -1.8 4.34131 1 1
214 1 . . . . . 0.0 -1.8 4.13907 1 1
215 1 . . . . . 0.0 -1.8 4.83401 1 1
216 1 . . . . . 0.0 -1.8 4.35302 1 1
217 1 . . . . . 0.0 -1.8 2.9561 1 1
218 1 . . . . . 0.0 -1.8 2.68495 1 1
219 1 . . . . . 0.0 -1.8 3.69322 1 1
220 1 . . . . . 0.0 -1.8 4.7167 1 1
221 1 . . . . . 0.0 -1.8 2.72862 1 1
222 1 . . . . . 0.0 -1.8 2.76451 1 1
223 1 . . . . . 0.0 -1.8 4.81175 1 1
224 1 . . . . . 0.0 -1.8 4.11482 1 1
225 1 . . . . . 0.0 -1.8 4.74263 1 1
226 1 . . . . . 0.0 -1.8 3.11924 1 1
227 1 . . . . . 0.0 -1.8 2.65104 1 1
228 1 . . . . . 0.0 -1.8 4.71931 1 1
229 1 . . . . . 0.0 -1.8 2.79726 1 1
230 1 . . . . . 0.0 -1.8 3.60765 1 1
231 1 . . . . . 0.0 -1.8 4.94468 1 1
232 1 . . . . . 0.0 -1.8 4.61837 1 1
233 1 . . . . . 0.0 -1.8 3.92002 1 1
234 1 . . . . . 0.0 -1.8 4.57091 1 1
235 1 . . . . . 0.0 -1.8 4.13931 1 1
236 1 . . . . . 0.0 -1.8 2.42848 1 1
237 1 . . . . . 0.0 -1.8 2.92969 1 1
238 1 . . . . . 0.0 -1.8 4.43244 1 1
239 1 . . . . . 0.0 -1.8 4.35432 1 1
240 1 . . . . . 0.0 -1.8 4.02369 1 1
241 1 . . . . . 0.0 -1.8 2.47098 1 1
242 1 . . . . . 0.0 -1.8 3.88644 1 1
243 1 . . . . . 0.0 -1.8 4.70337 1 1
244 1 . . . . . 0.0 -1.8 4.13103 1 1
245 1 . . . . . 0.0 -1.8 2.93075 1 1
246 1 . . . . . 0.0 -1.8 2.65247 1 1
247 1 . . . . . 0.0 -1.8 2.82227 1 1
248 1 . . . . . 0.0 -1.8 4.64749 1 1
249 1 . . . . . 0.0 -1.8 3.93055 1 1
250 1 . . . . . 0.0 -1.8 2.64136 1 1
251 1 . . . . . 0.0 -1.8 3.63603 1 1
252 1 . . . . . 0.0 -1.8 4.98132 1 1
253 1 . . . . . 0.0 -1.8 4.49081 1 1
254 1 . . . . . 0.0 -1.8 3.12277 1 1
255 1 . . . . . 0.0 -1.8 4.20901 1 1
256 1 . . . . . 0.0 -1.8 4.24903 1 1
257 1 . . . . . 0.0 -1.8 4.84149 1 1
258 1 . . . . . 0.0 -1.8 2.87782 1 1
259 1 . . . . . 0.0 -1.8 3.24768 1 1
260 1 . . . . . 0.0 -1.8 2.91237 1 1
261 1 . . . . . 0.0 -1.8 4.3174 1 1
262 1 . . . . . 0.0 -1.8 2.77841 1 1
263 1 . . . . . 0.0 -1.8 3.59233 1 1
264 1 . . . . . 0.0 -1.8 4.15873 1 1
265 1 . . . . . 0.0 -1.8 3.65112 1 1
266 1 . . . . . 0.0 -1.8 3.94481 1 1
267 1 . . . . . 0.0 -1.8 1.89077 1 1
stop_
save_
save_conformer_family_coord_set_1
_Conformer_family_coord_set.Sf_category conformer_family_coord_set
_Conformer_family_coord_set.Entry_ID 1
_Conformer_family_coord_set.ID 1
loop_
_Atom_site.Model_ID
_Atom_site.ID
_Atom_site.Label_entity_assembly_ID
_Atom_site.Label_entity_ID
_Atom_site.Label_comp_index_ID
_Atom_site.Label_comp_ID
_Atom_site.Label_atom_ID
_Atom_site.Type_symbol
_Atom_site.Cartn_x
_Atom_site.Cartn_y
_Atom_site.Cartn_z
_Atom_site.Occupancy
_Atom_site.Uncertainty
_Atom_site.PDBX_label_asym_ID
_Atom_site.PDB_strand_ID
_Atom_site.PDB_ins_code
_Atom_site.PDB_residue_no
_Atom_site.PDB_residue_name
_Atom_site.PDB_atom_name
_Atom_site.Entry_ID
_Atom_site.Conformer_family_coord_set_ID
1 1 1 1 1 ACE C C -3.378 -3.101 7.021 1.00 . A A . 0 ACE C 1 1
1 2 1 1 1 ACE CH3 C -3.064 -4.022 8.182 1.00 . A A . 0 ACE CH3 1 1
1 3 1 1 1 ACE H1 H -3.375 -5.019 7.927 1.00 . A A . 0 ACE H1 1 1
1 4 1 1 1 ACE H2 H -3.600 -3.691 9.061 1.00 . A A . 0 ACE H2 1 1
1 5 1 1 1 ACE H3 H -2.000 -4.010 8.374 1.00 . A A . 0 ACE H3 1 1
1 6 1 1 1 ACE O O -4.015 -3.545 6.043 1.00 . A A . 0 ACE O 1 1
1 7 1 1 2 HIS C C -1.878 -0.504 5.305 1.00 . A A . 1 HIS C 1 1
1 8 1 1 2 HIS CA C -3.127 -0.743 6.152 1.00 . A A . 1 HIS CA 1 1
1 9 1 1 2 HIS CB C -3.532 0.569 6.834 1.00 . A A . 1 HIS CB 1 1
1 10 1 1 2 HIS CD2 C -3.992 2.610 5.322 1.00 . A A . 1 HIS CD2 1 1
1 11 1 1 2 HIS CE1 C -6.116 2.256 4.943 1.00 . A A . 1 HIS CE1 1 1
1 12 1 1 2 HIS CG C -4.338 1.483 5.973 1.00 . A A . 1 HIS CG 1 1
1 13 1 1 2 HIS H H -2.437 -1.577 7.986 1.00 . A A . 1 HIS H 1 1
1 14 1 1 2 HIS HA H -3.929 -1.054 5.498 1.00 . A A . 1 HIS HA 1 1
1 15 1 1 2 HIS HB2 H -4.118 0.351 7.706 1.00 . A A . 1 HIS HB2 1 1
1 16 1 1 2 HIS HB3 H -2.640 1.098 7.130 1.00 . A A . 1 HIS HB3 1 1
1 17 1 1 2 HIS HD1 H -6.218 0.552 6.051 1.00 . A A . 1 HIS HD1 1 1
1 18 1 1 2 HIS HD2 H -3.012 3.063 5.316 1.00 . A A . 1 HIS HD2 1 1
1 19 1 1 2 HIS HE1 H -7.134 2.366 4.591 1.00 . A A . 1 HIS HE1 1 1
1 20 1 1 2 HIS HE2 H -5.195 3.941 4.245 1.00 . A A . 1 HIS HE2 1 1
1 21 1 1 2 HIS N N -2.922 -1.807 7.159 1.00 . A A . 1 HIS N 1 1
1 22 1 1 2 HIS ND1 N -5.673 1.286 5.714 1.00 . A A . 1 HIS ND1 1 1
1 23 1 1 2 HIS NE2 N -5.114 3.074 4.686 1.00 . A A . 1 HIS NE2 1 1
1 24 1 1 2 HIS O O -2.019 -0.101 4.139 1.00 . A A . 1 HIS O 1 1
1 25 1 1 3 . C C 0.696 -1.140 3.788 1.00 . A A . 2 MK8 C 1 1
1 26 1 1 3 . CA C 0.682 -0.502 5.234 1.00 . A A . 2 MK8 CA 1 1
1 27 1 1 3 . CB C 1.866 -1.088 6.054 1.00 . A A . 2 MK8 CB 1 1
1 28 1 1 3 . CB1 C 0.933 1.022 5.233 1.00 . A A . 2 MK8 CB1 1 1
1 29 1 1 3 . CD C 2.192 -3.547 5.313 1.00 . A A . 2 MK8 CD 1 1
1 30 1 1 3 . CE C 3.674 -3.677 4.882 1.00 . A A . 2 MK8 CE 1 1
1 31 1 1 3 . CG C 1.806 -2.579 6.444 1.00 . A A . 2 MK8 CG 1 1
1 32 1 1 3 . HB H 1.954 -0.512 6.966 1.00 . A A . 2 MK8 HB 1 1
1 33 1 1 3 . HB1 H 0.063 1.541 4.851 1.00 . A A . 2 MK8 HB1 1 1
1 34 1 1 3 . HB1A H 1.783 1.232 4.604 1.00 . A A . 2 MK8 HB1A 1 1
1 35 1 1 3 . HB1B H 1.143 1.353 6.243 1.00 . A A . 2 MK8 HB1B 1 1
1 36 1 1 3 . HBA H 2.772 -0.952 5.485 1.00 . A A . 2 MK8 HBA 1 1
1 37 1 1 3 . HD H 1.614 -3.256 4.456 1.00 . A A . 2 MK8 HD 1 1
1 38 1 1 3 . HDA H 1.874 -4.531 5.611 1.00 . A A . 2 MK8 HDA 1 1
1 39 1 1 3 . HE H 4.361 -3.867 5.673 1.00 . A A . 2 MK8 HE 1 1
1 40 1 1 3 . HG H 0.817 -2.805 6.772 1.00 . A A . 2 MK8 HG 1 1
1 41 1 1 3 . HGA H 2.489 -2.739 7.257 1.00 . A A . 2 MK8 HGA 1 1
1 42 1 1 3 . HN H -0.631 -1.006 6.854 1.00 . A A . 2 MK8 HN 1 1
1 43 1 1 3 . N N -0.639 -0.722 5.916 1.00 . A A . 2 MK8 N 1 1
1 44 1 1 3 . O O 1.338 -0.619 2.843 1.00 . A A . 2 MK8 O 1 1
1 45 1 1 4 ILE C C -0.777 -2.376 1.360 1.00 . A A . 3 ILE C 1 1
1 46 1 1 4 ILE CA C -0.067 -3.168 2.455 1.00 . A A . 3 ILE CA 1 1
1 47 1 1 4 ILE CB C -0.791 -4.570 2.668 1.00 . A A . 3 ILE CB 1 1
1 48 1 1 4 ILE CD1 C -1.204 -4.721 5.212 1.00 . A A . 3 ILE CD1 1 1
1 49 1 1 4 ILE CG1 C -0.466 -5.266 4.012 1.00 . A A . 3 ILE CG1 1 1
1 50 1 1 4 ILE CG2 C -0.388 -5.547 1.563 1.00 . A A . 3 ILE CG2 1 1
1 51 1 1 4 ILE H H -0.422 -2.671 4.489 1.00 . A A . 3 ILE H 1 1
1 52 1 1 4 ILE HA H 0.958 -3.361 2.144 1.00 . A A . 3 ILE HA 1 1
1 53 1 1 4 ILE HB H -1.866 -4.415 2.606 1.00 . A A . 3 ILE HB 1 1
1 54 1 1 4 ILE HD11 H -0.540 -4.696 6.055 1.00 . A A . 3 ILE HD11 1 1
1 55 1 1 4 ILE HD12 H -2.049 -5.356 5.437 1.00 . A A . 3 ILE HD12 1 1
1 56 1 1 4 ILE HD13 H -1.549 -3.723 4.991 1.00 . A A . 3 ILE HD13 1 1
1 57 1 1 4 ILE HG12 H -0.724 -6.299 3.930 1.00 . A A . 3 ILE HG12 1 1
1 58 1 1 4 ILE HG13 H 0.591 -5.180 4.205 1.00 . A A . 3 ILE HG13 1 1
1 59 1 1 4 ILE HG21 H -0.780 -6.528 1.797 1.00 . A A . 3 ILE HG21 1 1
1 60 1 1 4 ILE HG22 H 0.686 -5.590 1.508 1.00 . A A . 3 ILE HG22 1 1
1 61 1 1 4 ILE HG23 H -0.788 -5.208 0.620 1.00 . A A . 3 ILE HG23 1 1
1 62 1 1 4 ILE N N 0.003 -2.330 3.686 1.00 . A A . 3 ILE N 1 1
1 63 1 1 4 ILE O O -0.318 -2.347 0.207 1.00 . A A . 3 ILE O 1 1
1 64 1 1 5 LEU C C -1.893 0.220 0.220 1.00 . A A . 4 LEU C 1 1
1 65 1 1 5 LEU CA C -2.746 -0.851 0.920 1.00 . A A . 4 LEU CA 1 1
1 66 1 1 5 LEU CB C -3.847 -0.213 1.798 1.00 . A A . 4 LEU CB 1 1
1 67 1 1 5 LEU CD1 C -6.185 0.644 1.974 1.00 . A A . 4 LEU CD1 1 1
1 68 1 1 5 LEU CD2 C -4.478 2.027 0.822 1.00 . A A . 4 LEU CD2 1 1
1 69 1 1 5 LEU CG C -4.949 0.605 1.099 1.00 . A A . 4 LEU CG 1 1
1 70 1 1 5 LEU H H -2.145 -1.787 2.721 1.00 . A A . 4 LEU H 1 1
1 71 1 1 5 LEU HA H -3.203 -1.482 0.175 1.00 . A A . 4 LEU HA 1 1
1 72 1 1 5 LEU HB2 H -4.328 -1.006 2.341 1.00 . A A . 4 LEU HB2 1 1
1 73 1 1 5 LEU HB3 H -3.366 0.430 2.517 1.00 . A A . 4 LEU HB3 1 1
1 74 1 1 5 LEU HD11 H -6.101 -0.096 2.756 1.00 . A A . 4 LEU HD11 1 1
1 75 1 1 5 LEU HD12 H -7.055 0.435 1.375 1.00 . A A . 4 LEU HD12 1 1
1 76 1 1 5 LEU HD13 H -6.279 1.625 2.419 1.00 . A A . 4 LEU HD13 1 1
1 77 1 1 5 LEU HD21 H -3.492 2.004 0.387 1.00 . A A . 4 LEU HD21 1 1
1 78 1 1 5 LEU HD22 H -4.447 2.583 1.754 1.00 . A A . 4 LEU HD22 1 1
1 79 1 1 5 LEU HD23 H -5.159 2.508 0.145 1.00 . A A . 4 LEU HD23 1 1
1 80 1 1 5 LEU HG H -5.205 0.136 0.163 1.00 . A A . 4 LEU HG 1 1
1 81 1 1 5 LEU N N -1.899 -1.704 1.779 1.00 . A A . 4 LEU N 1 1
1 82 1 1 5 LEU O O -2.190 0.587 -0.928 1.00 . A A . 4 LEU O 1 1
1 83 1 1 6 HIS C C 1.195 1.116 -0.395 1.00 . A A . 5 HIS C 1 1
1 84 1 1 6 HIS CA C 0.116 1.706 0.506 1.00 . A A . 5 HIS CA 1 1
1 85 1 1 6 HIS CB C 0.723 2.397 1.715 1.00 . A A . 5 HIS CB 1 1
1 86 1 1 6 HIS CD2 C -0.780 4.180 2.852 1.00 . A A . 5 HIS CD2 1 1
1 87 1 1 6 HIS CE1 C -0.209 5.907 1.629 1.00 . A A . 5 HIS CE1 1 1
1 88 1 1 6 HIS CG C 0.148 3.756 1.956 1.00 . A A . 5 HIS CG 1 1
1 89 1 1 6 HIS H H -0.715 0.315 1.860 1.00 . A A . 5 HIS H 1 1
1 90 1 1 6 HIS HA H -0.442 2.436 -0.065 1.00 . A A . 5 HIS HA 1 1
1 91 1 1 6 HIS HB2 H 0.520 1.797 2.591 1.00 . A A . 5 HIS HB2 1 1
1 92 1 1 6 HIS HB3 H 1.794 2.496 1.581 1.00 . A A . 5 HIS HB3 1 1
1 93 1 1 6 HIS HD1 H 1.134 4.890 0.457 1.00 . A A . 5 HIS HD1 1 1
1 94 1 1 6 HIS HD2 H -1.286 3.577 3.597 1.00 . A A . 5 HIS HD2 1 1
1 95 1 1 6 HIS HE1 H -0.158 6.907 1.236 1.00 . A A . 5 HIS HE1 1 1
1 96 1 1 6 HIS HE2 H -1.563 6.102 3.156 1.00 . A A . 5 HIS HE2 1 1
1 97 1 1 6 HIS N N -0.839 0.685 0.961 1.00 . A A . 5 HIS N 1 1
1 98 1 1 6 HIS ND1 N 0.484 4.867 1.200 1.00 . A A . 5 HIS ND1 1 1
1 99 1 1 6 HIS NE2 N -0.983 5.514 2.625 1.00 . A A . 5 HIS NE2 1 1
1 100 1 1 6 HIS O O 1.392 1.628 -1.495 1.00 . A A . 5 HIS O 1 1
1 101 1 1 7 . C C 2.406 -1.155 -2.071 1.00 . A A . 6 MK8 C 1 1
1 102 1 1 7 . CA C 2.975 -0.721 -0.682 1.00 . A A . 6 MK8 CA 1 1
1 103 1 1 7 . CB C 3.402 -2.042 0.058 1.00 . A A . 6 MK8 CB 1 1
1 104 1 1 7 . CB1 C 4.217 0.210 -0.878 1.00 . A A . 6 MK8 CB1 1 1
1 105 1 1 7 . CD C 3.482 -3.328 2.261 1.00 . A A . 6 MK8 CD 1 1
1 106 1 1 7 . CE C 4.216 -3.588 3.604 1.00 . A A . 6 MK8 CE 1 1
1 107 1 1 7 . CG C 3.643 -1.968 1.584 1.00 . A A . 6 MK8 CG 1 1
1 108 1 1 7 . HB H 4.320 -2.388 -0.394 1.00 . A A . 6 MK8 HB 1 1
1 109 1 1 7 . HB1 H 4.118 1.071 -0.234 1.00 . A A . 6 MK8 HB1 1 1
1 110 1 1 7 . HB1A H 4.265 0.535 -1.905 1.00 . A A . 6 MK8 HB1A 1 1
1 111 1 1 7 . HB1B H 5.114 -0.332 -0.625 1.00 . A A . 6 MK8 HB1B 1 1
1 112 1 1 7 . HBA H 2.638 -2.789 -0.114 1.00 . A A . 6 MK8 HBA 1 1
1 113 1 1 7 . HD H 3.806 -4.080 1.548 1.00 . A A . 6 MK8 HD 1 1
1 114 1 1 7 . HDA H 2.436 -3.476 2.445 1.00 . A A . 6 MK8 HDA 1 1
1 115 1 1 7 . HE H 5.276 -3.713 3.527 1.00 . A A . 6 MK8 HE 1 1
1 116 1 1 7 . HG H 2.935 -1.276 2.012 1.00 . A A . 6 MK8 HG 1 1
1 117 1 1 7 . HGA H 4.645 -1.613 1.754 1.00 . A A . 6 MK8 HGA 1 1
1 118 1 1 7 . HN H 1.647 -0.324 0.970 1.00 . A A . 6 MK8 HN 1 1
1 119 1 1 7 . N N 1.888 0.009 0.084 1.00 . A A . 6 MK8 N 1 1
1 120 1 1 7 . O O 3.179 -1.564 -2.980 1.00 . A A . 6 MK8 O 1 1
1 121 1 1 8 LEU C C 0.120 -0.277 -4.353 1.00 . A A . 7 LEU C 1 1
1 122 1 1 8 LEU CA C 0.279 -1.467 -3.407 1.00 . A A . 7 LEU CA 1 1
1 123 1 1 8 LEU CB C -1.113 -2.048 -3.037 1.00 . A A . 7 LEU CB 1 1
1 124 1 1 8 LEU CD1 C -1.371 -4.247 -4.300 1.00 . A A . 7 LEU CD1 1 1
1 125 1 1 8 LEU CD2 C -3.358 -2.792 -3.914 1.00 . A A . 7 LEU CD2 1 1
1 126 1 1 8 LEU CG C -1.855 -2.802 -4.164 1.00 . A A . 7 LEU CG 1 1
1 127 1 1 8 LEU H H 0.520 -0.783 -1.415 1.00 . A A . 7 LEU H 1 1
1 128 1 1 8 LEU HA H 0.859 -2.235 -3.911 1.00 . A A . 7 LEU HA 1 1
1 129 1 1 8 LEU HB2 H -0.991 -2.725 -2.202 1.00 . A A . 7 LEU HB2 1 1
1 130 1 1 8 LEU HB3 H -1.747 -1.234 -2.721 1.00 . A A . 7 LEU HB3 1 1
1 131 1 1 8 LEU HD11 H -1.980 -4.758 -5.029 1.00 . A A . 7 LEU HD11 1 1
1 132 1 1 8 LEU HD12 H -1.457 -4.750 -3.349 1.00 . A A . 7 LEU HD12 1 1
1 133 1 1 8 LEU HD13 H -0.344 -4.256 -4.618 1.00 . A A . 7 LEU HD13 1 1
1 134 1 1 8 LEU HD21 H -3.615 -1.985 -3.239 1.00 . A A . 7 LEU HD21 1 1
1 135 1 1 8 LEU HD22 H -3.647 -3.731 -3.478 1.00 . A A . 7 LEU HD22 1 1
1 136 1 1 8 LEU HD23 H -3.881 -2.654 -4.852 1.00 . A A . 7 LEU HD23 1 1
1 137 1 1 8 LEU HG H -1.667 -2.295 -5.108 1.00 . A A . 7 LEU HG 1 1
1 138 1 1 8 LEU N N 1.030 -1.089 -2.192 1.00 . A A . 7 LEU N 1 1
1 139 1 1 8 LEU O O 0.229 -0.458 -5.587 1.00 . A A . 7 LEU O 1 1
1 140 1 1 9 LEU C C 0.930 2.823 -4.964 1.00 . A A . 8 LEU C 1 1
1 141 1 1 9 LEU CA C -0.376 2.198 -4.488 1.00 . A A . 8 LEU CA 1 1
1 142 1 1 9 LEU CB C -1.137 3.220 -3.615 1.00 . A A . 8 LEU CB 1 1
1 143 1 1 9 LEU CD1 C -2.785 3.626 -1.783 1.00 . A A . 8 LEU CD1 1 1
1 144 1 1 9 LEU CD2 C -3.628 2.752 -3.934 1.00 . A A . 8 LEU CD2 1 1
1 145 1 1 9 LEU CG C -2.452 2.738 -2.961 1.00 . A A . 8 LEU CG 1 1
1 146 1 1 9 LEU H H -0.228 0.956 -2.769 1.00 . A A . 8 LEU H 1 1
1 147 1 1 9 LEU HA H -0.980 1.972 -5.343 1.00 . A A . 8 LEU HA 1 1
1 148 1 1 9 LEU HB2 H -0.476 3.550 -2.827 1.00 . A A . 8 LEU HB2 1 1
1 149 1 1 9 LEU HB3 H -1.371 4.076 -4.237 1.00 . A A . 8 LEU HB3 1 1
1 150 1 1 9 LEU HD11 H -2.659 3.073 -0.866 1.00 . A A . 8 LEU HD11 1 1
1 151 1 1 9 LEU HD12 H -3.808 3.963 -1.865 1.00 . A A . 8 LEU HD12 1 1
1 152 1 1 9 LEU HD13 H -2.125 4.480 -1.784 1.00 . A A . 8 LEU HD13 1 1
1 153 1 1 9 LEU HD21 H -4.558 2.842 -3.387 1.00 . A A . 8 LEU HD21 1 1
1 154 1 1 9 LEU HD22 H -3.631 1.834 -4.499 1.00 . A A . 8 LEU HD22 1 1
1 155 1 1 9 LEU HD23 H -3.521 3.587 -4.605 1.00 . A A . 8 LEU HD23 1 1
1 156 1 1 9 LEU HG H -2.326 1.724 -2.595 1.00 . A A . 8 LEU HG 1 1
1 157 1 1 9 LEU N N -0.161 0.933 -3.747 1.00 . A A . 8 LEU N 1 1
1 158 1 1 9 LEU O O 0.968 3.409 -6.058 1.00 . A A . 8 LEU O 1 1
1 159 1 1 10 GLN C C 4.099 2.456 -5.364 1.00 . A A . 9 GLN C 1 1
1 160 1 1 10 GLN CA C 3.340 3.250 -4.329 1.00 . A A . 9 GLN CA 1 1
1 161 1 1 10 GLN CB C 4.133 3.279 -3.015 1.00 . A A . 9 GLN CB 1 1
1 162 1 1 10 GLN CD C 4.324 4.130 -0.644 1.00 . A A . 9 GLN CD 1 1
1 163 1 1 10 GLN CG C 3.491 4.115 -1.909 1.00 . A A . 9 GLN CG 1 1
1 164 1 1 10 GLN H H 1.834 2.212 -3.260 1.00 . A A . 9 GLN H 1 1
1 165 1 1 10 GLN HA H 3.232 4.257 -4.691 1.00 . A A . 9 GLN HA 1 1
1 166 1 1 10 GLN HB2 H 4.237 2.265 -2.653 1.00 . A A . 9 GLN HB2 1 1
1 167 1 1 10 GLN HB3 H 5.115 3.680 -3.211 1.00 . A A . 9 GLN HB3 1 1
1 168 1 1 10 GLN HE21 H 4.530 6.103 -0.757 1.00 . A A . 9 GLN HE21 1 1
1 169 1 1 10 GLN HE22 H 5.288 5.353 0.593 1.00 . A A . 9 GLN HE22 1 1
1 170 1 1 10 GLN HG2 H 3.370 5.131 -2.260 1.00 . A A . 9 GLN HG2 1 1
1 171 1 1 10 GLN HG3 H 2.520 3.694 -1.675 1.00 . A A . 9 GLN HG3 1 1
1 172 1 1 10 GLN N N 1.989 2.693 -4.095 1.00 . A A . 9 GLN N 1 1
1 173 1 1 10 GLN NE2 N 4.759 5.315 -0.231 1.00 . A A . 9 GLN NE2 1 1
1 174 1 1 10 GLN O O 4.905 3.038 -6.119 1.00 . A A . 9 GLN O 1 1
1 175 1 1 10 GLN OE1 O 4.585 3.083 -0.049 1.00 . A A . 9 GLN OE1 1 1
1 176 1 1 11 ASP C C 3.933 0.355 -7.714 1.00 . A A . 10 ASP C 1 1
1 177 1 1 11 ASP CA C 4.436 0.145 -6.292 1.00 . A A . 10 ASP CA 1 1
1 178 1 1 11 ASP CB C 4.117 -1.272 -5.833 1.00 . A A . 10 ASP CB 1 1
1 179 1 1 11 ASP CG C 4.921 -2.316 -6.582 1.00 . A A . 10 ASP CG 1 1
1 180 1 1 11 ASP H H 3.161 0.780 -4.729 1.00 . A A . 10 ASP H 1 1
1 181 1 1 11 ASP HA H 5.513 0.291 -6.262 1.00 . A A . 10 ASP HA 1 1
1 182 1 1 11 ASP HB2 H 4.346 -1.356 -4.786 1.00 . A A . 10 ASP HB2 1 1
1 183 1 1 11 ASP HB3 H 3.063 -1.471 -5.998 1.00 . A A . 10 ASP HB3 1 1
1 184 1 1 11 ASP N N 3.819 1.115 -5.371 1.00 . A A . 10 ASP N 1 1
1 185 1 1 11 ASP O O 4.740 0.412 -8.655 1.00 . A A . 10 ASP O 1 1
1 186 1 1 11 ASP OD1 O 4.780 -2.399 -7.821 1.00 . A A . 10 ASP OD1 1 1
1 187 1 1 11 ASP OD2 O 5.694 -3.047 -5.933 1.00 . A A . 10 ASP OD2 1 1
1 188 1 1 12 SER C C 2.343 1.975 -9.775 1.00 . A A . 11 SER C 1 1
1 189 1 1 12 SER CA C 1.847 0.706 -9.093 1.00 . A A . 11 SER CA 1 1
1 190 1 1 12 SER CB C 0.343 0.812 -8.849 1.00 . A A . 11 SER CB 1 1
1 191 1 1 12 SER H H 2.035 0.436 -7.001 1.00 . A A . 11 SER H 1 1
1 192 1 1 12 SER HA H 2.041 -0.136 -9.744 1.00 . A A . 11 SER HA 1 1
1 193 1 1 12 SER HB2 H -0.144 0.983 -9.788 1.00 . A A . 11 SER HB2 1 1
1 194 1 1 12 SER HB3 H -0.014 -0.104 -8.423 1.00 . A A . 11 SER HB3 1 1
1 195 1 1 12 SER HG H -0.609 2.474 -8.401 1.00 . A A . 11 SER HG 1 1
1 196 1 1 12 SER N N 2.563 0.481 -7.823 1.00 . A A . 11 SER N 1 1
1 197 1 1 12 SER O O 2.856 1.926 -10.887 1.00 . A A . 11 SER O 1 1
1 198 1 1 12 SER OG O 0.018 1.880 -7.972 1.00 . A A . 11 SER OG 1 1
1 199 1 1 13 NH2 HN1 H 2.068 2.995 -8.087 1.00 . A A . 12 NH2 HN1 1 1
1 200 1 1 13 NH2 HN2 H 2.680 3.900 -9.433 1.00 . A A . 12 NH2 HN2 1 1
1 201 1 1 13 NH2 N N 2.365 3.068 -9.022 1.00 . A A . 12 NH2 N 1 1
2 202 1 1 1 ACE C C -3.166 -2.498 6.924 1.00 . A A . 0 ACE C 1 1
2 203 1 1 1 ACE CH3 C -2.951 -3.305 8.187 1.00 . A A . 0 ACE CH3 1 1
2 204 1 1 1 ACE H1 H -3.891 -3.723 8.509 1.00 . A A . 0 ACE H1 1 1
2 205 1 1 1 ACE H2 H -2.572 -2.656 8.954 1.00 . A A . 0 ACE H2 1 1
2 206 1 1 1 ACE H3 H -2.240 -4.107 7.999 1.00 . A A . 0 ACE H3 1 1
2 207 1 1 1 ACE O O -3.517 -3.082 5.878 1.00 . A A . 0 ACE O 1 1
2 208 1 1 2 HIS C C -1.823 -0.096 5.113 1.00 . A A . 1 HIS C 1 1
2 209 1 1 2 HIS CA C -3.108 -0.174 5.923 1.00 . A A . 1 HIS CA 1 1
2 210 1 1 2 HIS CB C -3.466 1.209 6.456 1.00 . A A . 1 HIS CB 1 1
2 211 1 1 2 HIS CD2 C -3.783 3.147 4.770 1.00 . A A . 1 HIS CD2 1 1
2 212 1 1 2 HIS CE1 C -5.877 2.772 4.219 1.00 . A A . 1 HIS CE1 1 1
2 213 1 1 2 HIS CG C -4.194 2.066 5.467 1.00 . A A . 1 HIS CG 1 1
2 214 1 1 2 HIS H H -2.676 -0.787 7.905 1.00 . A A . 1 HIS H 1 1
2 215 1 1 2 HIS HA H -3.902 -0.531 5.287 1.00 . A A . 1 HIS HA 1 1
2 216 1 1 2 HIS HB2 H -4.097 1.093 7.316 1.00 . A A . 1 HIS HB2 1 1
2 217 1 1 2 HIS HB3 H -2.557 1.718 6.741 1.00 . A A . 1 HIS HB3 1 1
2 218 1 1 2 HIS HD1 H -6.097 1.144 5.445 1.00 . A A . 1 HIS HD1 1 1
2 219 1 1 2 HIS HD2 H -2.804 3.600 4.816 1.00 . A A . 1 HIS HD2 1 1
2 220 1 1 2 HIS HE1 H -6.859 2.867 3.765 1.00 . A A . 1 HIS HE1 1 1
2 221 1 1 2 HIS HE2 H -4.815 4.292 3.339 1.00 . A A . 1 HIS HE2 1 1
2 222 1 1 2 HIS N N -2.951 -1.136 7.037 1.00 . A A . 1 HIS N 1 1
2 223 1 1 2 HIS ND1 N -5.514 1.853 5.104 1.00 . A A . 1 HIS ND1 1 1
2 224 1 1 2 HIS NE2 N -4.843 3.569 3.999 1.00 . A A . 1 HIS NE2 1 1
2 225 1 1 2 HIS O O -1.839 0.327 3.950 1.00 . A A . 1 HIS O 1 1
2 226 1 1 3 . C C 0.635 -1.295 3.779 1.00 . A A . 2 MK8 C 1 1
2 227 1 1 3 . CA C 0.688 -0.556 5.183 1.00 . A A . 2 MK8 CA 1 1
2 228 1 1 3 . CB C 1.568 -1.327 6.238 1.00 . A A . 2 MK8 CB 1 1
2 229 1 1 3 . CB1 C 1.224 0.903 5.129 1.00 . A A . 2 MK8 CB1 1 1
2 230 1 1 3 . CD C 2.868 -3.184 5.101 1.00 . A A . 2 MK8 CD 1 1
2 231 1 1 3 . CE C 4.122 -3.803 4.438 1.00 . A A . 2 MK8 CE 1 1
2 232 1 1 3 . CG C 2.979 -1.867 5.847 1.00 . A A . 2 MK8 CG 1 1
2 233 1 1 3 . HB H 0.986 -2.165 6.577 1.00 . A A . 2 MK8 HB 1 1
2 234 1 1 3 . HB1 H 0.392 1.593 5.126 1.00 . A A . 2 MK8 HB1 1 1
2 235 1 1 3 . HB1A H 1.812 1.045 4.235 1.00 . A A . 2 MK8 HB1A 1 1
2 236 1 1 3 . HB1B H 1.841 1.087 5.997 1.00 . A A . 2 MK8 HB1B 1 1
2 237 1 1 3 . HBA H 1.711 -0.666 7.078 1.00 . A A . 2 MK8 HBA 1 1
2 238 1 1 3 . HD H 2.111 -3.052 4.338 1.00 . A A . 2 MK8 HD 1 1
2 239 1 1 3 . HDA H 2.505 -3.910 5.806 1.00 . A A . 2 MK8 HDA 1 1
2 240 1 1 3 . HE H 4.911 -4.071 5.107 1.00 . A A . 2 MK8 HE 1 1
2 241 1 1 3 . HG H 3.542 -2.025 6.751 1.00 . A A . 2 MK8 HG 1 1
2 242 1 1 3 . HGA H 3.488 -1.142 5.225 1.00 . A A . 2 MK8 HGA 1 1
2 243 1 1 3 . HN H -0.777 -0.849 6.691 1.00 . A A . 2 MK8 HN 1 1
2 244 1 1 3 . N N -0.683 -0.529 5.768 1.00 . A A . 2 MK8 N 1 1
2 245 1 1 3 . O O 0.999 -0.746 2.719 1.00 . A A . 2 MK8 O 1 1
2 246 1 1 4 ILE C C -0.675 -2.904 1.546 1.00 . A A . 3 ILE C 1 1
2 247 1 1 4 ILE CA C 0.120 -3.551 2.703 1.00 . A A . 3 ILE CA 1 1
2 248 1 1 4 ILE CB C -0.504 -4.970 3.070 1.00 . A A . 3 ILE CB 1 1
2 249 1 1 4 ILE CD1 C -0.678 -4.968 5.651 1.00 . A A . 3 ILE CD1 1 1
2 250 1 1 4 ILE CG1 C -0.007 -5.541 4.421 1.00 . A A . 3 ILE CG1 1 1
2 251 1 1 4 ILE CG2 C -0.176 -6.022 2.007 1.00 . A A . 3 ILE CG2 1 1
2 252 1 1 4 ILE H H -0.017 -2.951 4.743 1.00 . A A . 3 ILE H 1 1
2 253 1 1 4 ILE HA H 1.137 -3.708 2.364 1.00 . A A . 3 ILE HA 1 1
2 254 1 1 4 ILE HB H -1.581 -4.861 3.110 1.00 . A A . 3 ILE HB 1 1
2 255 1 1 4 ILE HD11 H -0.070 -4.174 6.042 1.00 . A A . 3 ILE HD11 1 1
2 256 1 1 4 ILE HD12 H -0.780 -5.745 6.396 1.00 . A A . 3 ILE HD12 1 1
2 257 1 1 4 ILE HD13 H -1.653 -4.585 5.389 1.00 . A A . 3 ILE HD13 1 1
2 258 1 1 4 ILE HG12 H -0.174 -6.607 4.433 1.00 . A A . 3 ILE HG12 1 1
2 259 1 1 4 ILE HG13 H 1.052 -5.354 4.507 1.00 . A A . 3 ILE HG13 1 1
2 260 1 1 4 ILE HG21 H -0.061 -5.543 1.047 1.00 . A A . 3 ILE HG21 1 1
2 261 1 1 4 ILE HG22 H -0.976 -6.746 1.957 1.00 . A A . 3 ILE HG22 1 1
2 262 1 1 4 ILE HG23 H 0.746 -6.525 2.276 1.00 . A A . 3 ILE HG23 1 1
2 263 1 1 4 ILE N N 0.204 -2.606 3.857 1.00 . A A . 3 ILE N 1 1
2 264 1 1 4 ILE O O -0.341 -3.117 0.365 1.00 . A A . 3 ILE O 1 1
2 265 1 1 5 LEU C C -1.792 -0.357 0.239 1.00 . A A . 4 LEU C 1 1
2 266 1 1 5 LEU CA C -2.606 -1.365 1.038 1.00 . A A . 4 LEU CA 1 1
2 267 1 1 5 LEU CB C -3.709 -0.663 1.866 1.00 . A A . 4 LEU CB 1 1
2 268 1 1 5 LEU CD1 C -6.054 0.173 2.017 1.00 . A A . 4 LEU CD1 1 1
2 269 1 1 5 LEU CD2 C -4.472 1.375 0.536 1.00 . A A . 4 LEU CD2 1 1
2 270 1 1 5 LEU CG C -4.864 0.003 1.097 1.00 . A A . 4 LEU CG 1 1
2 271 1 1 5 LEU H H -1.864 -2.005 2.911 1.00 . A A . 4 LEU H 1 1
2 272 1 1 5 LEU HA H -3.059 -2.069 0.355 1.00 . A A . 4 LEU HA 1 1
2 273 1 1 5 LEU HB2 H -4.138 -1.393 2.531 1.00 . A A . 4 LEU HB2 1 1
2 274 1 1 5 LEU HB3 H -3.226 0.095 2.470 1.00 . A A . 4 LEU HB3 1 1
2 275 1 1 5 LEU HD11 H -6.508 -0.790 2.198 1.00 . A A . 4 LEU HD11 1 1
2 276 1 1 5 LEU HD12 H -6.769 0.831 1.552 1.00 . A A . 4 LEU HD12 1 1
2 277 1 1 5 LEU HD13 H -5.727 0.598 2.954 1.00 . A A . 4 LEU HD13 1 1
2 278 1 1 5 LEU HD21 H -5.190 1.681 -0.208 1.00 . A A . 4 LEU HD21 1 1
2 279 1 1 5 LEU HD22 H -3.490 1.315 0.088 1.00 . A A . 4 LEU HD22 1 1
2 280 1 1 5 LEU HD23 H -4.450 2.098 1.342 1.00 . A A . 4 LEU HD23 1 1
2 281 1 1 5 LEU HG H -5.159 -0.634 0.275 1.00 . A A . 4 LEU HG 1 1
2 282 1 1 5 LEU N N -1.715 -2.104 1.952 1.00 . A A . 4 LEU N 1 1
2 283 1 1 5 LEU O O -1.891 -0.311 -0.995 1.00 . A A . 4 LEU O 1 1
2 284 1 1 6 HIS C C 0.975 0.958 -0.427 1.00 . A A . 5 HIS C 1 1
2 285 1 1 6 HIS CA C -0.110 1.506 0.481 1.00 . A A . 5 HIS CA 1 1
2 286 1 1 6 HIS CB C 0.508 2.264 1.646 1.00 . A A . 5 HIS CB 1 1
2 287 1 1 6 HIS CD2 C -0.955 4.041 2.810 1.00 . A A . 5 HIS CD2 1 1
2 288 1 1 6 HIS CE1 C -0.511 5.742 1.493 1.00 . A A . 5 HIS CE1 1 1
2 289 1 1 6 HIS CG C -0.101 3.606 1.854 1.00 . A A . 5 HIS CG 1 1
2 290 1 1 6 HIS H H -1.006 0.311 1.979 1.00 . A A . 5 HIS H 1 1
2 291 1 1 6 HIS HA H -0.725 2.194 -0.086 1.00 . A A . 5 HIS HA 1 1
2 292 1 1 6 HIS HB2 H 0.366 1.691 2.547 1.00 . A A . 5 HIS HB2 1 1
2 293 1 1 6 HIS HB3 H 1.557 2.394 1.474 1.00 . A A . 5 HIS HB3 1 1
2 294 1 1 6 HIS HD1 H 0.732 4.698 0.246 1.00 . A A . 5 HIS HD1 1 1
2 295 1 1 6 HIS HD2 H -1.385 3.446 3.610 1.00 . A A . 5 HIS HD2 1 1
2 296 1 1 6 HIS HE1 H -0.467 6.740 1.080 1.00 . A A . 5 HIS HE1 1 1
2 297 1 1 6 HIS HE2 H -1.692 5.982 3.148 1.00 . A A . 5 HIS HE2 1 1
2 298 1 1 6 HIS N N -0.989 0.449 1.006 1.00 . A A . 5 HIS N 1 1
2 299 1 1 6 HIS ND1 N 0.154 4.693 1.039 1.00 . A A . 5 HIS ND1 1 1
2 300 1 1 6 HIS NE2 N -1.192 5.371 2.564 1.00 . A A . 5 HIS NE2 1 1
2 301 1 1 6 HIS O O 1.252 1.562 -1.477 1.00 . A A . 5 HIS O 1 1
2 302 1 1 7 . C C 2.247 -1.165 -2.217 1.00 . A A . 6 MK8 C 1 1
2 303 1 1 7 . CA C 2.732 -0.883 -0.758 1.00 . A A . 6 MK8 CA 1 1
2 304 1 1 7 . CB C 3.065 -2.269 -0.115 1.00 . A A . 6 MK8 CB 1 1
2 305 1 1 7 . CB1 C 4.012 0.012 -0.754 1.00 . A A . 6 MK8 CB1 1 1
2 306 1 1 7 . CD C 3.411 -3.789 1.884 1.00 . A A . 6 MK8 CD 1 1
2 307 1 1 7 . CE C 4.352 -4.056 3.093 1.00 . A A . 6 MK8 CE 1 1
2 308 1 1 7 . CG C 3.149 -2.358 1.433 1.00 . A A . 6 MK8 CG 1 1
2 309 1 1 7 . HB H 4.012 -2.607 -0.517 1.00 . A A . 6 MK8 HB 1 1
2 310 1 1 7 . HB1 H 4.855 -0.582 -0.452 1.00 . A A . 6 MK8 HB1 1 1
2 311 1 1 7 . HB1A H 3.876 0.828 -0.059 1.00 . A A . 6 MK8 HB1A 1 1
2 312 1 1 7 . HB1B H 4.179 0.412 -1.743 1.00 . A A . 6 MK8 HB1B 1 1
2 313 1 1 7 . HBA H 2.308 -2.973 -0.429 1.00 . A A . 6 MK8 HBA 1 1
2 314 1 1 7 . HD H 3.815 -4.323 1.029 1.00 . A A . 6 MK8 HD 1 1
2 315 1 1 7 . HDA H 2.461 -4.228 2.127 1.00 . A A . 6 MK8 HDA 1 1
2 316 1 1 7 . HE H 5.300 -4.497 2.853 1.00 . A A . 6 MK8 HE 1 1
2 317 1 1 7 . HG H 2.219 -2.026 1.855 1.00 . A A . 6 MK8 HG 1 1
2 318 1 1 7 . HGA H 3.955 -1.722 1.779 1.00 . A A . 6 MK8 HGA 1 1
2 319 1 1 7 . HN H 1.344 -0.596 0.848 1.00 . A A . 6 MK8 HN 1 1
2 320 1 1 7 . N N 1.620 -0.199 -0.001 1.00 . A A . 6 MK8 N 1 1
2 321 1 1 7 . O O 3.060 -1.446 -3.131 1.00 . A A . 6 MK8 O 1 1
2 322 1 1 8 LEU C C 0.095 -0.133 -4.542 1.00 . A A . 7 LEU C 1 1
2 323 1 1 8 LEU CA C 0.171 -1.391 -3.662 1.00 . A A . 7 LEU CA 1 1
2 324 1 1 8 LEU CB C -1.246 -1.960 -3.384 1.00 . A A . 7 LEU CB 1 1
2 325 1 1 8 LEU CD1 C -1.543 -3.981 -4.911 1.00 . A A . 7 LEU CD1 1 1
2 326 1 1 8 LEU CD2 C -3.508 -2.537 -4.356 1.00 . A A . 7 LEU CD2 1 1
2 327 1 1 8 LEU CG C -2.002 -2.560 -4.599 1.00 . A A . 7 LEU CG 1 1
2 328 1 1 8 LEU H H 0.319 -0.952 -1.592 1.00 . A A . 7 LEU H 1 1
2 329 1 1 8 LEU HA H 0.741 -2.137 -4.184 1.00 . A A . 7 LEU HA 1 1
2 330 1 1 8 LEU HB2 H -1.158 -2.729 -2.627 1.00 . A A . 7 LEU HB2 1 1
2 331 1 1 8 LEU HB3 H -1.853 -1.166 -2.979 1.00 . A A . 7 LEU HB3 1 1
2 332 1 1 8 LEU HD11 H -2.374 -4.550 -5.300 1.00 . A A . 7 LEU HD11 1 1
2 333 1 1 8 LEU HD12 H -1.171 -4.442 -4.004 1.00 . A A . 7 LEU HD12 1 1
2 334 1 1 8 LEU HD13 H -0.754 -3.945 -5.647 1.00 . A A . 7 LEU HD13 1 1
2 335 1 1 8 LEU HD21 H -3.923 -3.517 -4.553 1.00 . A A . 7 LEU HD21 1 1
2 336 1 1 8 LEU HD22 H -3.973 -1.815 -5.008 1.00 . A A . 7 LEU HD22 1 1
2 337 1 1 8 LEU HD23 H -3.705 -2.266 -3.326 1.00 . A A . 7 LEU HD23 1 1
2 338 1 1 8 LEU HG H -1.790 -1.955 -5.472 1.00 . A A . 7 LEU HG 1 1
2 339 1 1 8 LEU N N 0.871 -1.129 -2.383 1.00 . A A . 7 LEU N 1 1
2 340 1 1 8 LEU O O 0.268 -0.225 -5.771 1.00 . A A . 7 LEU O 1 1
2 341 1 1 9 LEU C C 1.038 2.974 -4.875 1.00 . A A . 8 LEU C 1 1
2 342 1 1 9 LEU CA C -0.320 2.363 -4.505 1.00 . A A . 8 LEU CA 1 1
2 343 1 1 9 LEU CB C -1.047 3.323 -3.512 1.00 . A A . 8 LEU CB 1 1
2 344 1 1 9 LEU CD1 C -3.439 3.557 -4.489 1.00 . A A . 8 LEU CD1 1 1
2 345 1 1 9 LEU CD2 C -3.057 1.846 -2.687 1.00 . A A . 8 LEU CD2 1 1
2 346 1 1 9 LEU CG C -2.600 3.208 -3.251 1.00 . A A . 8 LEU CG 1 1
2 347 1 1 9 LEU H H -0.326 0.986 -2.909 1.00 . A A . 8 LEU H 1 1
2 348 1 1 9 LEU HA H -0.930 2.259 -5.385 1.00 . A A . 8 LEU HA 1 1
2 349 1 1 9 LEU HB2 H -0.565 3.209 -2.555 1.00 . A A . 8 LEU HB2 1 1
2 350 1 1 9 LEU HB3 H -0.854 4.335 -3.853 1.00 . A A . 8 LEU HB3 1 1
2 351 1 1 9 LEU HD11 H -2.777 3.796 -5.300 1.00 . A A . 8 LEU HD11 1 1
2 352 1 1 9 LEU HD12 H -4.073 4.405 -4.270 1.00 . A A . 8 LEU HD12 1 1
2 353 1 1 9 LEU HD13 H -4.046 2.710 -4.752 1.00 . A A . 8 LEU HD13 1 1
2 354 1 1 9 LEU HD21 H -2.949 1.840 -1.616 1.00 . A A . 8 LEU HD21 1 1
2 355 1 1 9 LEU HD22 H -2.458 1.057 -3.121 1.00 . A A . 8 LEU HD22 1 1
2 356 1 1 9 LEU HD23 H -4.093 1.697 -2.944 1.00 . A A . 8 LEU HD23 1 1
2 357 1 1 9 LEU HG H -2.837 3.946 -2.501 1.00 . A A . 8 LEU HG 1 1
2 358 1 1 9 LEU N N -0.186 1.034 -3.871 1.00 . A A . 8 LEU N 1 1
2 359 1 1 9 LEU O O 1.151 3.654 -5.913 1.00 . A A . 8 LEU O 1 1
2 360 1 1 10 GLN C C 4.191 2.429 -5.216 1.00 . A A . 9 GLN C 1 1
2 361 1 1 10 GLN CA C 3.441 3.205 -4.129 1.00 . A A . 9 GLN CA 1 1
2 362 1 1 10 GLN CB C 4.175 3.097 -2.786 1.00 . A A . 9 GLN CB 1 1
2 363 1 1 10 GLN CD C 3.789 5.417 -1.813 1.00 . A A . 9 GLN CD 1 1
2 364 1 1 10 GLN CG C 3.541 3.931 -1.662 1.00 . A A . 9 GLN CG 1 1
2 365 1 1 10 GLN H H 1.844 2.171 -3.202 1.00 . A A . 9 GLN H 1 1
2 366 1 1 10 GLN HA H 3.398 4.252 -4.413 1.00 . A A . 9 GLN HA 1 1
2 367 1 1 10 GLN HB2 H 4.189 2.066 -2.482 1.00 . A A . 9 GLN HB2 1 1
2 368 1 1 10 GLN HB3 H 5.193 3.433 -2.921 1.00 . A A . 9 GLN HB3 1 1
2 369 1 1 10 GLN HE21 H 4.637 5.509 -0.003 1.00 . A A . 9 GLN HE21 1 1
2 370 1 1 10 GLN HE22 H 4.569 6.996 -0.882 1.00 . A A . 9 GLN HE22 1 1
2 371 1 1 10 GLN HG2 H 2.477 3.762 -1.673 1.00 . A A . 9 GLN HG2 1 1
2 372 1 1 10 GLN HG3 H 3.941 3.602 -0.719 1.00 . A A . 9 GLN HG3 1 1
2 373 1 1 10 GLN N N 2.053 2.715 -3.985 1.00 . A A . 9 GLN N 1 1
2 374 1 1 10 GLN NE2 N 4.390 6.035 -0.796 1.00 . A A . 9 GLN NE2 1 1
2 375 1 1 10 GLN O O 5.003 3.039 -5.951 1.00 . A A . 9 GLN O 1 1
2 376 1 1 10 GLN OE1 O 3.440 6.015 -2.830 1.00 . A A . 9 GLN OE1 1 1
2 377 1 1 11 ASP C C 3.973 0.459 -7.667 1.00 . A A . 10 ASP C 1 1
2 378 1 1 11 ASP CA C 4.491 0.164 -6.264 1.00 . A A . 10 ASP CA 1 1
2 379 1 1 11 ASP CB C 4.168 -1.279 -5.890 1.00 . A A . 10 ASP CB 1 1
2 380 1 1 11 ASP CG C 4.968 -2.281 -6.699 1.00 . A A . 10 ASP CG 1 1
2 381 1 1 11 ASP H H 3.234 0.720 -4.664 1.00 . A A . 10 ASP H 1 1
2 382 1 1 11 ASP HA H 5.562 0.302 -6.244 1.00 . A A . 10 ASP HA 1 1
2 383 1 1 11 ASP HB2 H 4.384 -1.429 -4.846 1.00 . A A . 10 ASP HB2 1 1
2 384 1 1 11 ASP HB3 H 3.125 -1.469 -6.061 1.00 . A A . 10 ASP HB3 1 1
2 385 1 1 11 ASP N N 3.891 1.086 -5.291 1.00 . A A . 10 ASP N 1 1
2 386 1 1 11 ASP O O 4.778 0.539 -8.625 1.00 . A A . 10 ASP O 1 1
2 387 1 1 11 ASP OD1 O 6.217 -2.227 -6.669 1.00 . A A . 10 ASP OD1 1 1
2 388 1 1 11 ASP OD2 O 4.341 -3.125 -7.361 1.00 . A A . 10 ASP OD2 1 1
2 389 1 1 12 SER C C 2.325 2.181 -9.622 1.00 . A A . 11 SER C 1 1
2 390 1 1 12 SER CA C 1.884 0.866 -8.998 1.00 . A A . 11 SER CA 1 1
2 391 1 1 12 SER CB C 0.380 0.883 -8.748 1.00 . A A . 11 SER CB 1 1
2 392 1 1 12 SER H H 2.077 0.510 -6.934 1.00 . A A . 11 SER H 1 1
2 393 1 1 12 SER HA H 2.111 0.064 -9.687 1.00 . A A . 11 SER HA 1 1
2 394 1 1 12 SER HB2 H 0.160 1.573 -7.949 1.00 . A A . 11 SER HB2 1 1
2 395 1 1 12 SER HB3 H -0.121 1.204 -9.647 1.00 . A A . 11 SER HB3 1 1
2 396 1 1 12 SER HG H 0.055 -1.014 -9.096 1.00 . A A . 11 SER HG 1 1
2 397 1 1 12 SER N N 2.605 0.599 -7.754 1.00 . A A . 11 SER N 1 1
2 398 1 1 12 SER O O 2.195 2.359 -10.830 1.00 . A A . 11 SER O 1 1
2 399 1 1 12 SER OG O -0.097 -0.396 -8.379 1.00 . A A . 11 SER OG 1 1
2 400 1 1 13 NH2 HN1 H 2.578 2.999 -7.825 1.00 . A A . 12 NH2 HN1 1 1
2 401 1 1 13 NH2 HN2 H 2.902 4.025 -9.154 1.00 . A A . 12 NH2 HN2 1 1
2 402 1 1 13 NH2 N N 2.640 3.168 -8.782 1.00 . A A . 12 NH2 N 1 1
3 403 1 1 1 ACE C C -3.269 -2.772 6.874 1.00 . A A . 0 ACE C 1 1
3 404 1 1 1 ACE CH3 C -3.084 -3.730 8.036 1.00 . A A . 0 ACE CH3 1 1
3 405 1 1 1 ACE H1 H -2.095 -3.607 8.453 1.00 . A A . 0 ACE H1 1 1
3 406 1 1 1 ACE H2 H -3.205 -4.743 7.689 1.00 . A A . 0 ACE H2 1 1
3 407 1 1 1 ACE H3 H -3.824 -3.521 8.797 1.00 . A A . 0 ACE H3 1 1
3 408 1 1 1 ACE O O -3.755 -3.200 5.806 1.00 . A A . 0 ACE O 1 1
3 409 1 1 2 HIS C C -1.726 -0.280 5.287 1.00 . A A . 1 HIS C 1 1
3 410 1 1 2 HIS CA C -2.995 -0.382 6.119 1.00 . A A . 1 HIS CA 1 1
3 411 1 1 2 HIS CB C -3.274 0.955 6.820 1.00 . A A . 1 HIS CB 1 1
3 412 1 1 2 HIS CD2 C -3.439 3.080 5.358 1.00 . A A . 1 HIS CD2 1 1
3 413 1 1 2 HIS CE1 C -5.557 2.954 4.815 1.00 . A A . 1 HIS CE1 1 1
3 414 1 1 2 HIS CG C -3.939 1.974 5.948 1.00 . A A . 1 HIS CG 1 1
3 415 1 1 2 HIS H H -2.524 -1.243 7.989 1.00 . A A . 1 HIS H 1 1
3 416 1 1 2 HIS HA H -3.809 -0.614 5.463 1.00 . A A . 1 HIS HA 1 1
3 417 1 1 2 HIS HB2 H -3.918 0.777 7.660 1.00 . A A . 1 HIS HB2 1 1
3 418 1 1 2 HIS HB3 H -2.342 1.375 7.166 1.00 . A A . 1 HIS HB3 1 1
3 419 1 1 2 HIS HD1 H -5.908 1.220 5.842 1.00 . A A . 1 HIS HD1 1 1
3 420 1 1 2 HIS HD2 H -2.424 3.432 5.424 1.00 . A A . 1 HIS HD2 1 1
3 421 1 1 2 HIS HE1 H -6.525 3.196 4.406 1.00 . A A . 1 HIS HE1 1 1
3 422 1 1 2 HIS HE2 H -4.393 4.486 4.126 1.00 . A A . 1 HIS HE2 1 1
3 423 1 1 2 HIS N N -2.885 -1.466 7.106 1.00 . A A . 1 HIS N 1 1
3 424 1 1 2 HIS ND1 N -5.273 1.917 5.587 1.00 . A A . 1 HIS ND1 1 1
3 425 1 1 2 HIS NE2 N -4.462 3.670 4.662 1.00 . A A . 1 HIS NE2 1 1
3 426 1 1 2 HIS O O -1.759 0.298 4.191 1.00 . A A . 1 HIS O 1 1
3 427 1 1 3 . C C 0.607 -1.419 3.696 1.00 . A A . 2 MK8 C 1 1
3 428 1 1 3 . CA C 0.763 -0.861 5.179 1.00 . A A . 2 MK8 CA 1 1
3 429 1 1 3 . CB C 1.662 -1.826 6.056 1.00 . A A . 2 MK8 CB 1 1
3 430 1 1 3 . CB1 C 1.350 0.592 5.274 1.00 . A A . 2 MK8 CB1 1 1
3 431 1 1 3 . CD C 3.192 -3.760 5.393 1.00 . A A . 2 MK8 CD 1 1
3 432 1 1 3 . CE C 2.802 -4.475 4.064 1.00 . A A . 2 MK8 CE 1 1
3 433 1 1 3 . CG C 3.066 -2.256 5.535 1.00 . A A . 2 MK8 CG 1 1
3 434 1 1 3 . HB H 1.090 -2.727 6.248 1.00 . A A . 2 MK8 HB 1 1
3 435 1 1 3 . HB1 H 1.113 1.142 4.373 1.00 . A A . 2 MK8 HB1 1 1
3 436 1 1 3 . HB1A H 2.423 0.545 5.394 1.00 . A A . 2 MK8 HB1A 1 1
3 437 1 1 3 . HB1B H 0.919 1.091 6.131 1.00 . A A . 2 MK8 HB1B 1 1
3 438 1 1 3 . HBA H 1.832 -1.340 6.999 1.00 . A A . 2 MK8 HBA 1 1
3 439 1 1 3 . HD H 2.594 -4.190 6.180 1.00 . A A . 2 MK8 HD 1 1
3 440 1 1 3 . HDA H 4.206 -4.015 5.585 1.00 . A A . 2 MK8 HDA 1 1
3 441 1 1 3 . HE H 2.148 -5.324 4.171 1.00 . A A . 2 MK8 HE 1 1
3 442 1 1 3 . HG H 3.801 -1.912 6.230 1.00 . A A . 2 MK8 HG 1 1
3 443 1 1 3 . HGA H 3.238 -1.789 4.581 1.00 . A A . 2 MK8 HGA 1 1
3 444 1 1 3 . HN H -0.652 -1.288 6.706 1.00 . A A . 2 MK8 HN 1 1
3 445 1 1 3 . N N -0.584 -0.853 5.828 1.00 . A A . 2 MK8 N 1 1
3 446 1 1 3 . O O 0.911 -0.747 2.695 1.00 . A A . 2 MK8 O 1 1
3 447 1 1 4 ILE C C -0.868 -2.683 1.336 1.00 . A A . 3 ILE C 1 1
3 448 1 1 4 ILE CA C -0.112 -3.490 2.381 1.00 . A A . 3 ILE CA 1 1
3 449 1 1 4 ILE CB C -0.867 -4.877 2.545 1.00 . A A . 3 ILE CB 1 1
3 450 1 1 4 ILE CD1 C -0.268 -5.373 5.134 1.00 . A A . 3 ILE CD1 1 1
3 451 1 1 4 ILE CG1 C -1.315 -5.303 4.004 1.00 . A A . 3 ILE CG1 1 1
3 452 1 1 4 ILE CG2 C -0.058 -5.986 1.856 1.00 . A A . 3 ILE CG2 1 1
3 453 1 1 4 ILE H H -0.091 -3.141 4.486 1.00 . A A . 3 ILE H 1 1
3 454 1 1 4 ILE HA H 0.860 -3.706 1.983 1.00 . A A . 3 ILE HA 1 1
3 455 1 1 4 ILE HB H -1.775 -4.769 1.953 1.00 . A A . 3 ILE HB 1 1
3 456 1 1 4 ILE HD11 H -0.776 -5.349 6.089 1.00 . A A . 3 ILE HD11 1 1
3 457 1 1 4 ILE HD12 H 0.398 -4.524 5.058 1.00 . A A . 3 ILE HD12 1 1
3 458 1 1 4 ILE HD13 H 0.301 -6.288 5.044 1.00 . A A . 3 ILE HD13 1 1
3 459 1 1 4 ILE HG12 H -2.070 -4.611 4.336 1.00 . A A . 3 ILE HG12 1 1
3 460 1 1 4 ILE HG13 H -1.760 -6.277 3.923 1.00 . A A . 3 ILE HG13 1 1
3 461 1 1 4 ILE HG21 H -0.387 -6.096 0.834 1.00 . A A . 3 ILE HG21 1 1
3 462 1 1 4 ILE HG22 H -0.202 -6.918 2.384 1.00 . A A . 3 ILE HG22 1 1
3 463 1 1 4 ILE HG23 H 0.990 -5.727 1.866 1.00 . A A . 3 ILE HG23 1 1
3 464 1 1 4 ILE N N 0.113 -2.707 3.636 1.00 . A A . 3 ILE N 1 1
3 465 1 1 4 ILE O O -0.601 -2.824 0.126 1.00 . A A . 3 ILE O 1 1
3 466 1 1 5 LEU C C -1.782 0.033 0.257 1.00 . A A . 4 LEU C 1 1
3 467 1 1 5 LEU CA C -2.664 -0.944 1.033 1.00 . A A . 4 LEU CA 1 1
3 468 1 1 5 LEU CB C -3.647 -0.189 1.948 1.00 . A A . 4 LEU CB 1 1
3 469 1 1 5 LEU CD1 C -5.938 0.788 2.227 1.00 . A A . 4 LEU CD1 1 1
3 470 1 1 5 LEU CD2 C -4.258 2.003 0.846 1.00 . A A . 4 LEU CD2 1 1
3 471 1 1 5 LEU CG C -4.765 0.624 1.267 1.00 . A A . 4 LEU CG 1 1
3 472 1 1 5 LEU H H -1.929 -1.804 2.821 1.00 . A A . 4 LEU H 1 1
3 473 1 1 5 LEU HA H -3.222 -1.560 0.341 1.00 . A A . 4 LEU HA 1 1
3 474 1 1 5 LEU HB2 H -4.111 -0.914 2.593 1.00 . A A . 4 LEU HB2 1 1
3 475 1 1 5 LEU HB3 H -3.071 0.495 2.567 1.00 . A A . 4 LEU HB3 1 1
3 476 1 1 5 LEU HD11 H -6.565 1.600 1.897 1.00 . A A . 4 LEU HD11 1 1
3 477 1 1 5 LEU HD12 H -5.560 1.003 3.217 1.00 . A A . 4 LEU HD12 1 1
3 478 1 1 5 LEU HD13 H -6.517 -0.127 2.256 1.00 . A A . 4 LEU HD13 1 1
3 479 1 1 5 LEU HD21 H -3.918 2.535 1.720 1.00 . A A . 4 LEU HD21 1 1
3 480 1 1 5 LEU HD22 H -5.056 2.552 0.378 1.00 . A A . 4 LEU HD22 1 1
3 481 1 1 5 LEU HD23 H -3.440 1.890 0.148 1.00 . A A . 4 LEU HD23 1 1
3 482 1 1 5 LEU HG H -5.111 0.099 0.389 1.00 . A A . 4 LEU HG 1 1
3 483 1 1 5 LEU N N -1.814 -1.827 1.846 1.00 . A A . 4 LEU N 1 1
3 484 1 1 5 LEU O O -1.867 0.090 -0.981 1.00 . A A . 4 LEU O 1 1
3 485 1 1 6 HIS C C 1.059 1.195 -0.396 1.00 . A A . 5 HIS C 1 1
3 486 1 1 6 HIS CA C -0.004 1.793 0.530 1.00 . A A . 5 HIS CA 1 1
3 487 1 1 6 HIS CB C 0.663 2.510 1.697 1.00 . A A . 5 HIS CB 1 1
3 488 1 1 6 HIS CD2 C -0.720 4.260 2.999 1.00 . A A . 5 HIS CD2 1 1
3 489 1 1 6 HIS CE1 C -0.389 5.970 1.665 1.00 . A A . 5 HIS CE1 1 1
3 490 1 1 6 HIS CG C 0.073 3.846 1.981 1.00 . A A . 5 HIS CG 1 1
3 491 1 1 6 HIS H H -0.958 0.652 2.011 1.00 . A A . 5 HIS H 1 1
3 492 1 1 6 HIS HA H -0.590 2.515 -0.029 1.00 . A A . 5 HIS HA 1 1
3 493 1 1 6 HIS HB2 H 0.558 1.910 2.586 1.00 . A A . 5 HIS HB2 1 1
3 494 1 1 6 HIS HB3 H 1.710 2.646 1.478 1.00 . A A . 5 HIS HB3 1 1
3 495 1 1 6 HIS HD1 H 0.813 4.966 0.356 1.00 . A A . 5 HIS HD1 1 1
3 496 1 1 6 HIS HD2 H -1.082 3.655 3.817 1.00 . A A . 5 HIS HD2 1 1
3 497 1 1 6 HIS HE1 H -0.463 6.943 1.216 1.00 . A A . 5 HIS HE1 1 1
3 498 1 1 6 HIS HE2 H -1.549 6.152 3.357 1.00 . A A . 5 HIS HE2 1 1
3 499 1 1 6 HIS N N -0.935 0.792 1.040 1.00 . A A . 5 HIS N 1 1
3 500 1 1 6 HIS ND1 N 0.262 4.943 1.168 1.00 . A A . 5 HIS ND1 1 1
3 501 1 1 6 HIS NE2 N -0.992 5.582 2.782 1.00 . A A . 5 HIS NE2 1 1
3 502 1 1 6 HIS O O 1.238 1.692 -1.516 1.00 . A A . 5 HIS O 1 1
3 503 1 1 7 . C C 2.344 -1.054 -2.038 1.00 . A A . 6 MK8 C 1 1
3 504 1 1 7 . CA C 2.886 -0.584 -0.642 1.00 . A A . 6 MK8 CA 1 1
3 505 1 1 7 . CB C 3.357 -1.866 0.131 1.00 . A A . 6 MK8 CB 1 1
3 506 1 1 7 . CB1 C 4.117 0.374 -0.818 1.00 . A A . 6 MK8 CB1 1 1
3 507 1 1 7 . CD C 4.124 -3.008 2.295 1.00 . A A . 6 MK8 CD 1 1
3 508 1 1 7 . CE C 3.192 -4.167 2.766 1.00 . A A . 6 MK8 CE 1 1
3 509 1 1 7 . CG C 3.514 -1.760 1.676 1.00 . A A . 6 MK8 CG 1 1
3 510 1 1 7 . HB H 4.315 -2.163 -0.272 1.00 . A A . 6 MK8 HB 1 1
3 511 1 1 7 . HB1 H 4.768 0.274 0.042 1.00 . A A . 6 MK8 HB1 1 1
3 512 1 1 7 . HB1A H 3.776 1.400 -0.892 1.00 . A A . 6 MK8 HB1A 1 1
3 513 1 1 7 . HB1B H 4.654 0.110 -1.709 1.00 . A A . 6 MK8 HB1B 1 1
3 514 1 1 7 . HBA H 2.648 -2.652 -0.073 1.00 . A A . 6 MK8 HBA 1 1
3 515 1 1 7 . HD H 4.717 -2.688 3.142 1.00 . A A . 6 MK8 HD 1 1
3 516 1 1 7 . HDA H 4.788 -3.425 1.567 1.00 . A A . 6 MK8 HDA 1 1
3 517 1 1 7 . HE H 2.802 -4.811 1.991 1.00 . A A . 6 MK8 HE 1 1
3 518 1 1 7 . HG H 2.542 -1.594 2.115 1.00 . A A . 6 MK8 HG 1 1
3 519 1 1 7 . HGA H 4.157 -0.923 1.895 1.00 . A A . 6 MK8 HGA 1 1
3 520 1 1 7 . HN H 1.584 -0.187 0.998 1.00 . A A . 6 MK8 HN 1 1
3 521 1 1 7 . N N 1.787 0.123 0.101 1.00 . A A . 6 MK8 N 1 1
3 522 1 1 7 . O O 3.144 -1.425 -2.933 1.00 . A A . 6 MK8 O 1 1
3 523 1 1 8 LEU C C 0.100 -0.262 -4.385 1.00 . A A . 7 LEU C 1 1
3 524 1 1 8 LEU CA C 0.245 -1.446 -3.407 1.00 . A A . 7 LEU CA 1 1
3 525 1 1 8 LEU CB C -1.150 -2.015 -3.043 1.00 . A A . 7 LEU CB 1 1
3 526 1 1 8 LEU CD1 C -1.439 -4.229 -4.251 1.00 . A A . 7 LEU CD1 1 1
3 527 1 1 8 LEU CD2 C -3.403 -2.697 -3.930 1.00 . A A . 7 LEU CD2 1 1
3 528 1 1 8 LEU CG C -1.897 -2.773 -4.159 1.00 . A A . 7 LEU CG 1 1
3 529 1 1 8 LEU H H 0.431 -0.745 -1.411 1.00 . A A . 7 LEU H 1 1
3 530 1 1 8 LEU HA H 0.825 -2.227 -3.881 1.00 . A A . 7 LEU HA 1 1
3 531 1 1 8 LEU HB2 H -1.028 -2.688 -2.210 1.00 . A A . 7 LEU HB2 1 1
3 532 1 1 8 LEU HB3 H -1.782 -1.196 -2.719 1.00 . A A . 7 LEU HB3 1 1
3 533 1 1 8 LEU HD11 H -0.673 -4.324 -5.013 1.00 . A A . 7 LEU HD11 1 1
3 534 1 1 8 LEU HD12 H -2.279 -4.850 -4.503 1.00 . A A . 7 LEU HD12 1 1
3 535 1 1 8 LEU HD13 H -1.039 -4.533 -3.297 1.00 . A A . 7 LEU HD13 1 1
3 536 1 1 8 LEU HD21 H -3.608 -2.023 -3.111 1.00 . A A . 7 LEU HD21 1 1
3 537 1 1 8 LEU HD22 H -3.777 -3.679 -3.687 1.00 . A A . 7 LEU HD22 1 1
3 538 1 1 8 LEU HD23 H -3.892 -2.339 -4.826 1.00 . A A . 7 LEU HD23 1 1
3 539 1 1 8 LEU HG H -1.683 -2.295 -5.100 1.00 . A A . 7 LEU HG 1 1
3 540 1 1 8 LEU N N 0.964 -1.040 -2.180 1.00 . A A . 7 LEU N 1 1
3 541 1 1 8 LEU O O 0.256 -0.453 -5.605 1.00 . A A . 7 LEU O 1 1
3 542 1 1 9 LEU C C 0.891 2.846 -5.009 1.00 . A A . 8 LEU C 1 1
3 543 1 1 9 LEU CA C -0.427 2.209 -4.564 1.00 . A A . 8 LEU CA 1 1
3 544 1 1 9 LEU CB C -1.200 3.207 -3.653 1.00 . A A . 8 LEU CB 1 1
3 545 1 1 9 LEU CD1 C -3.513 3.497 -4.755 1.00 . A A . 8 LEU CD1 1 1
3 546 1 1 9 LEU CD2 C -3.310 1.772 -2.950 1.00 . A A . 8 LEU CD2 1 1
3 547 1 1 9 LEU CG C -2.770 3.116 -3.488 1.00 . A A . 8 LEU CG 1 1
3 548 1 1 9 LEU H H -0.338 0.976 -2.838 1.00 . A A . 8 LEU H 1 1
3 549 1 1 9 LEU HA H -1.026 1.990 -5.432 1.00 . A A . 8 LEU HA 1 1
3 550 1 1 9 LEU HB2 H -0.773 3.132 -2.666 1.00 . A A . 8 LEU HB2 1 1
3 551 1 1 9 LEU HB3 H -0.978 4.202 -4.020 1.00 . A A . 8 LEU HB3 1 1
3 552 1 1 9 LEU HD11 H -2.884 3.301 -5.608 1.00 . A A . 8 LEU HD11 1 1
3 553 1 1 9 LEU HD12 H -3.752 4.545 -4.720 1.00 . A A . 8 LEU HD12 1 1
3 554 1 1 9 LEU HD13 H -4.425 2.920 -4.835 1.00 . A A . 8 LEU HD13 1 1
3 555 1 1 9 LEU HD21 H -2.876 0.962 -3.516 1.00 . A A . 8 LEU HD21 1 1
3 556 1 1 9 LEU HD22 H -4.388 1.737 -3.047 1.00 . A A . 8 LEU HD22 1 1
3 557 1 1 9 LEU HD23 H -3.043 1.675 -1.912 1.00 . A A . 8 LEU HD23 1 1
3 558 1 1 9 LEU HG H -3.038 3.856 -2.758 1.00 . A A . 8 LEU HG 1 1
3 559 1 1 9 LEU N N -0.218 0.948 -3.815 1.00 . A A . 8 LEU N 1 1
3 560 1 1 9 LEU O O 0.959 3.426 -6.109 1.00 . A A . 8 LEU O 1 1
3 561 1 1 10 GLN C C 4.086 2.475 -5.329 1.00 . A A . 9 GLN C 1 1
3 562 1 1 10 GLN CA C 3.282 3.303 -4.315 1.00 . A A . 9 GLN CA 1 1
3 563 1 1 10 GLN CB C 4.034 3.370 -2.973 1.00 . A A . 9 GLN CB 1 1
3 564 1 1 10 GLN CD C 4.118 4.255 -0.598 1.00 . A A . 9 GLN CD 1 1
3 565 1 1 10 GLN CG C 3.336 4.197 -1.899 1.00 . A A . 9 GLN CG 1 1
3 566 1 1 10 GLN H H 1.732 2.272 -3.279 1.00 . A A . 9 GLN H 1 1
3 567 1 1 10 GLN HA H 3.172 4.305 -4.709 1.00 . A A . 9 GLN HA 1 1
3 568 1 1 10 GLN HB2 H 4.153 2.363 -2.594 1.00 . A A . 9 GLN HB2 1 1
3 569 1 1 10 GLN HB3 H 5.007 3.795 -3.143 1.00 . A A . 9 GLN HB3 1 1
3 570 1 1 10 GLN HE21 H 4.139 6.248 -0.683 1.00 . A A . 9 GLN HE21 1 1
3 571 1 1 10 GLN HE22 H 4.950 5.553 0.675 1.00 . A A . 9 GLN HE22 1 1
3 572 1 1 10 GLN HG2 H 3.207 5.206 -2.263 1.00 . A A . 9 GLN HG2 1 1
3 573 1 1 10 GLN HG3 H 2.365 3.763 -1.702 1.00 . A A . 9 GLN HG3 1 1
3 574 1 1 10 GLN N N 1.919 2.740 -4.113 1.00 . A A . 9 GLN N 1 1
3 575 1 1 10 GLN NE2 N 4.433 5.476 -0.155 1.00 . A A . 9 GLN NE2 1 1
3 576 1 1 10 GLN O O 4.889 3.049 -6.101 1.00 . A A . 9 GLN O 1 1
3 577 1 1 10 GLN OE1 O 4.427 3.222 0.003 1.00 . A A . 9 GLN OE1 1 1
3 578 1 1 11 ASP C C 3.991 0.330 -7.621 1.00 . A A . 10 ASP C 1 1
3 579 1 1 11 ASP CA C 4.485 0.140 -6.197 1.00 . A A . 10 ASP CA 1 1
3 580 1 1 11 ASP CB C 4.196 -1.283 -5.721 1.00 . A A . 10 ASP CB 1 1
3 581 1 1 11 ASP CG C 4.985 -2.341 -6.477 1.00 . A A . 10 ASP CG 1 1
3 582 1 1 11 ASP H H 3.181 0.786 -4.652 1.00 . A A . 10 ASP H 1 1
3 583 1 1 11 ASP HA H 5.547 0.314 -6.170 1.00 . A A . 10 ASP HA 1 1
3 584 1 1 11 ASP HB2 H 4.446 -1.359 -4.675 1.00 . A A . 10 ASP HB2 1 1
3 585 1 1 11 ASP HB3 H 3.142 -1.483 -5.851 1.00 . A A . 10 ASP HB3 1 1
3 586 1 1 11 ASP N N 3.835 1.122 -5.303 1.00 . A A . 10 ASP N 1 1
3 587 1 1 11 ASP O O 4.809 0.325 -8.555 1.00 . A A . 10 ASP O 1 1
3 588 1 1 11 ASP OD1 O 4.784 -2.448 -7.697 1.00 . A A . 10 ASP OD1 1 1
3 589 1 1 11 ASP OD2 O 5.796 -3.058 -5.852 1.00 . A A . 10 ASP OD2 1 1
3 590 1 1 12 SER C C 2.424 1.975 -9.691 1.00 . A A . 11 SER C 1 1
3 591 1 1 12 SER CA C 1.936 0.707 -9.021 1.00 . A A . 11 SER CA 1 1
3 592 1 1 12 SER CB C 0.427 0.789 -8.803 1.00 . A A . 11 SER CB 1 1
3 593 1 1 12 SER H H 2.094 0.490 -6.934 1.00 . A A . 11 SER H 1 1
3 594 1 1 12 SER HA H 2.154 -0.134 -9.658 1.00 . A A . 11 SER HA 1 1
3 595 1 1 12 SER HB2 H -0.051 0.961 -9.746 1.00 . A A . 11 SER HB2 1 1
3 596 1 1 12 SER HB3 H 0.076 -0.128 -8.395 1.00 . A A . 11 SER HB3 1 1
3 597 1 1 12 SER HG H -0.802 1.701 -7.588 1.00 . A A . 11 SER HG 1 1
3 598 1 1 12 SER N N 2.630 0.501 -7.747 1.00 . A A . 11 SER N 1 1
3 599 1 1 12 SER O O 2.821 1.969 -10.858 1.00 . A A . 11 SER O 1 1
3 600 1 1 12 SER OG O 0.087 1.839 -7.929 1.00 . A A . 11 SER OG 1 1
3 601 1 1 13 NH2 HN1 H 2.080 2.992 -8.031 1.00 . A A . 12 NH2 HN1 1 1
3 602 1 1 13 NH2 HN2 H 2.681 3.890 -9.318 1.00 . A A . 12 NH2 HN2 1 1
3 603 1 1 13 NH2 N N 2.399 3.064 -8.937 1.00 . A A . 12 NH2 N 1 1
4 604 1 1 1 ACE C C -3.290 -2.872 7.516 1.00 . A A . 0 ACE C 1 1
4 605 1 1 1 ACE CH3 C -2.947 -3.388 8.894 1.00 . A A . 0 ACE CH3 1 1
4 606 1 1 1 ACE H1 H -2.742 -4.443 8.840 1.00 . A A . 0 ACE H1 1 1
4 607 1 1 1 ACE H2 H -3.782 -3.215 9.560 1.00 . A A . 0 ACE H2 1 1
4 608 1 1 1 ACE H3 H -2.075 -2.867 9.260 1.00 . A A . 0 ACE H3 1 1
4 609 1 1 1 ACE O O -3.905 -3.617 6.728 1.00 . A A . 0 ACE O 1 1
4 610 1 1 2 HIS C C -1.843 -0.675 5.165 1.00 . A A . 1 HIS C 1 1
4 611 1 1 2 HIS CA C -3.138 -0.885 5.966 1.00 . A A . 1 HIS CA 1 1
4 612 1 1 2 HIS CB C -3.881 0.453 6.203 1.00 . A A . 1 HIS CB 1 1
4 613 1 1 2 HIS CD2 C -2.611 2.607 6.884 1.00 . A A . 1 HIS CD2 1 1
4 614 1 1 2 HIS CE1 C -2.489 2.260 9.042 1.00 . A A . 1 HIS CE1 1 1
4 615 1 1 2 HIS CG C -3.216 1.430 7.139 1.00 . A A . 1 HIS CG 1 1
4 616 1 1 2 HIS H H -2.432 -1.086 7.947 1.00 . A A . 1 HIS H 1 1
4 617 1 1 2 HIS HA H -3.781 -1.519 5.381 1.00 . A A . 1 HIS HA 1 1
4 618 1 1 2 HIS HB2 H -3.998 0.947 5.257 1.00 . A A . 1 HIS HB2 1 1
4 619 1 1 2 HIS HB3 H -4.855 0.231 6.606 1.00 . A A . 1 HIS HB3 1 1
4 620 1 1 2 HIS HD1 H -3.464 0.462 8.997 1.00 . A A . 1 HIS HD1 1 1
4 621 1 1 2 HIS HD2 H -2.492 3.065 5.911 1.00 . A A . 1 HIS HD2 1 1
4 622 1 1 2 HIS HE1 H -2.257 2.372 10.087 1.00 . A A . 1 HIS HE1 1 1
4 623 1 1 2 HIS HE2 H -1.653 3.935 8.205 1.00 . A A . 1 HIS HE2 1 1
4 624 1 1 2 HIS N N -2.895 -1.579 7.246 1.00 . A A . 1 HIS N 1 1
4 625 1 1 2 HIS ND1 N -3.122 1.237 8.501 1.00 . A A . 1 HIS ND1 1 1
4 626 1 1 2 HIS NE2 N -2.167 3.106 8.083 1.00 . A A . 1 HIS NE2 1 1
4 627 1 1 2 HIS O O -1.906 -0.187 4.034 1.00 . A A . 1 HIS O 1 1
4 628 1 1 3 . C C 0.699 -1.442 3.669 1.00 . A A . 2 MK8 C 1 1
4 629 1 1 3 . CA C 0.722 -0.873 5.165 1.00 . A A . 2 MK8 CA 1 1
4 630 1 1 3 . CB C 1.804 -1.571 6.092 1.00 . A A . 2 MK8 CB 1 1
4 631 1 1 3 . CB1 C 1.085 0.632 5.198 1.00 . A A . 2 MK8 CB1 1 1
4 632 1 1 3 . CD C 2.920 -3.442 4.827 1.00 . A A . 2 MK8 CD 1 1
4 633 1 1 3 . CE C 2.549 -4.637 3.897 1.00 . A A . 2 MK8 CE 1 1
4 634 1 1 3 . CG C 2.030 -3.104 6.021 1.00 . A A . 2 MK8 CG 1 1
4 635 1 1 3 . HB H 1.564 -1.326 7.121 1.00 . A A . 2 MK8 HB 1 1
4 636 1 1 3 . HB1 H 0.257 1.213 4.811 1.00 . A A . 2 MK8 HB1 1 1
4 637 1 1 3 . HB1A H 1.963 0.806 4.595 1.00 . A A . 2 MK8 HB1A 1 1
4 638 1 1 3 . HB1B H 1.296 0.929 6.215 1.00 . A A . 2 MK8 HB1B 1 1
4 639 1 1 3 . HBA H 2.750 -1.121 5.863 1.00 . A A . 2 MK8 HBA 1 1
4 640 1 1 3 . HD H 3.917 -3.617 5.207 1.00 . A A . 2 MK8 HD 1 1
4 641 1 1 3 . HDA H 2.948 -2.566 4.208 1.00 . A A . 2 MK8 HDA 1 1
4 642 1 1 3 . HE H 2.056 -5.462 4.371 1.00 . A A . 2 MK8 HE 1 1
4 643 1 1 3 . HG H 1.085 -3.594 5.910 1.00 . A A . 2 MK8 HG 1 1
4 644 1 1 3 . HGA H 2.511 -3.430 6.926 1.00 . A A . 2 MK8 HGA 1 1
4 645 1 1 3 . HN H -0.699 -1.396 6.695 1.00 . A A . 2 MK8 HN 1 1
4 646 1 1 3 . N N -0.646 -1.033 5.787 1.00 . A A . 2 MK8 N 1 1
4 647 1 1 3 . O O 1.386 -0.947 2.742 1.00 . A A . 2 MK8 O 1 1
4 648 1 1 4 ILE C C -0.941 -2.412 1.231 1.00 . A A . 3 ILE C 1 1
4 649 1 1 4 ILE CA C -0.298 -3.318 2.277 1.00 . A A . 3 ILE CA 1 1
4 650 1 1 4 ILE CB C -1.216 -4.609 2.425 1.00 . A A . 3 ILE CB 1 1
4 651 1 1 4 ILE CD1 C -1.810 -4.714 4.930 1.00 . A A . 3 ILE CD1 1 1
4 652 1 1 4 ILE CG1 C -1.077 -5.363 3.776 1.00 . A A . 3 ILE CG1 1 1
4 653 1 1 4 ILE CG2 C -0.919 -5.603 1.300 1.00 . A A . 3 ILE CG2 1 1
4 654 1 1 4 ILE H H -0.567 -2.861 4.334 1.00 . A A . 3 ILE H 1 1
4 655 1 1 4 ILE HA H 0.675 -3.625 1.914 1.00 . A A . 3 ILE HA 1 1
4 656 1 1 4 ILE HB H -2.238 -4.288 2.312 1.00 . A A . 3 ILE HB 1 1
4 657 1 1 4 ILE HD11 H -2.754 -5.217 5.082 1.00 . A A . 3 ILE HD11 1 1
4 658 1 1 4 ILE HD12 H -1.987 -3.672 4.698 1.00 . A A . 3 ILE HD12 1 1
4 659 1 1 4 ILE HD13 H -1.215 -4.788 5.821 1.00 . A A . 3 ILE HD13 1 1
4 660 1 1 4 ILE HG12 H -1.480 -6.353 3.660 1.00 . A A . 3 ILE HG12 1 1
4 661 1 1 4 ILE HG13 H -0.042 -5.432 4.033 1.00 . A A . 3 ILE HG13 1 1
4 662 1 1 4 ILE HG21 H -1.020 -5.095 0.354 1.00 . A A . 3 ILE HG21 1 1
4 663 1 1 4 ILE HG22 H -1.621 -6.424 1.347 1.00 . A A . 3 ILE HG22 1 1
4 664 1 1 4 ILE HG23 H 0.091 -5.979 1.402 1.00 . A A . 3 ILE HG23 1 1
4 665 1 1 4 ILE N N -0.107 -2.547 3.536 1.00 . A A . 3 ILE N 1 1
4 666 1 1 4 ILE O O -0.504 -2.391 0.068 1.00 . A A . 3 ILE O 1 1
4 667 1 1 5 LEU C C -1.888 0.283 0.188 1.00 . A A . 4 LEU C 1 1
4 668 1 1 5 LEU CA C -2.805 -0.736 0.878 1.00 . A A . 4 LEU CA 1 1
4 669 1 1 5 LEU CB C -3.846 -0.050 1.809 1.00 . A A . 4 LEU CB 1 1
4 670 1 1 5 LEU CD1 C -6.077 1.065 2.093 1.00 . A A . 4 LEU CD1 1 1
4 671 1 1 5 LEU CD2 C -4.229 2.309 1.004 1.00 . A A . 4 LEU CD2 1 1
4 672 1 1 5 LEU CG C -4.863 0.938 1.189 1.00 . A A . 4 LEU CG 1 1
4 673 1 1 5 LEU H H -2.265 -1.796 2.634 1.00 . A A . 4 LEU H 1 1
4 674 1 1 5 LEU HA H -3.329 -1.309 0.122 1.00 . A A . 4 LEU HA 1 1
4 675 1 1 5 LEU HB2 H -4.407 -0.831 2.302 1.00 . A A . 4 LEU HB2 1 1
4 676 1 1 5 LEU HB3 H -3.293 0.485 2.574 1.00 . A A . 4 LEU HB3 1 1
4 677 1 1 5 LEU HD11 H -6.810 0.323 1.818 1.00 . A A . 4 LEU HD11 1 1
4 678 1 1 5 LEU HD12 H -6.503 2.052 1.982 1.00 . A A . 4 LEU HD12 1 1
4 679 1 1 5 LEU HD13 H -5.778 0.914 3.120 1.00 . A A . 4 LEU HD13 1 1
4 680 1 1 5 LEU HD21 H -4.658 3.009 1.705 1.00 . A A . 4 LEU HD21 1 1
4 681 1 1 5 LEU HD22 H -4.397 2.657 -0.005 1.00 . A A . 4 LEU HD22 1 1
4 682 1 1 5 LEU HD23 H -3.170 2.235 1.180 1.00 . A A . 4 LEU HD23 1 1
4 683 1 1 5 LEU HG H -5.193 0.577 0.231 1.00 . A A . 4 LEU HG 1 1
4 684 1 1 5 LEU N N -2.009 -1.679 1.696 1.00 . A A . 4 LEU N 1 1
4 685 1 1 5 LEU O O -2.073 0.566 -1.008 1.00 . A A . 4 LEU O 1 1
4 686 1 1 6 HIS C C 1.161 1.203 -0.372 1.00 . A A . 5 HIS C 1 1
4 687 1 1 6 HIS CA C 0.091 1.801 0.552 1.00 . A A . 5 HIS CA 1 1
4 688 1 1 6 HIS CB C 0.720 2.457 1.767 1.00 . A A . 5 HIS CB 1 1
4 689 1 1 6 HIS CD2 C -0.748 4.169 3.060 1.00 . A A . 5 HIS CD2 1 1
4 690 1 1 6 HIS CE1 C -0.278 5.944 1.866 1.00 . A A . 5 HIS CE1 1 1
4 691 1 1 6 HIS CG C 0.129 3.794 2.094 1.00 . A A . 5 HIS CG 1 1
4 692 1 1 6 HIS H H -0.864 0.501 1.918 1.00 . A A . 5 HIS H 1 1
4 693 1 1 6 HIS HA H -0.443 2.562 -0.001 1.00 . A A . 5 HIS HA 1 1
4 694 1 1 6 HIS HB2 H 0.573 1.821 2.625 1.00 . A A . 5 HIS HB2 1 1
4 695 1 1 6 HIS HB3 H 1.774 2.587 1.595 1.00 . A A . 5 HIS HB3 1 1
4 696 1 1 6 HIS HD1 H 1.004 4.983 0.598 1.00 . A A . 5 HIS HD1 1 1
4 697 1 1 6 HIS HD2 H -1.172 3.535 3.823 1.00 . A A . 5 HIS HD2 1 1
4 698 1 1 6 HIS HE1 H -0.240 6.964 1.504 1.00 . A A . 5 HIS HE1 1 1
4 699 1 1 6 HIS HE2 H -1.667 6.027 3.377 1.00 . A A . 5 HIS HE2 1 1
4 700 1 1 6 HIS N N -0.904 0.806 0.989 1.00 . A A . 5 HIS N 1 1
4 701 1 1 6 HIS ND1 N 0.400 4.928 1.366 1.00 . A A . 5 HIS ND1 1 1
4 702 1 1 6 HIS NE2 N -0.986 5.509 2.895 1.00 . A A . 5 HIS NE2 1 1
4 703 1 1 6 HIS O O 1.286 1.668 -1.517 1.00 . A A . 5 HIS O 1 1
4 704 1 1 7 . C C 2.465 -1.093 -2.025 1.00 . A A . 6 MK8 C 1 1
4 705 1 1 7 . CA C 3.024 -0.552 -0.680 1.00 . A A . 6 MK8 CA 1 1
4 706 1 1 7 . CB C 3.635 -1.713 0.126 1.00 . A A . 6 MK8 CB 1 1
4 707 1 1 7 . CB1 C 4.201 0.424 -0.931 1.00 . A A . 6 MK8 CB1 1 1
4 708 1 1 7 . CD C 3.483 -3.730 1.574 1.00 . A A . 6 MK8 CD 1 1
4 709 1 1 7 . CE C 2.784 -4.756 2.522 1.00 . A A . 6 MK8 CE 1 1
4 710 1 1 7 . CG C 2.674 -2.723 0.753 1.00 . A A . 6 MK8 CG 1 1
4 711 1 1 7 . HB H 4.228 -1.290 0.920 1.00 . A A . 6 MK8 HB 1 1
4 712 1 1 7 . HB1 H 4.684 0.663 0.008 1.00 . A A . 6 MK8 HB1 1 1
4 713 1 1 7 . HB1A H 3.827 1.331 -1.382 1.00 . A A . 6 MK8 HB1A 1 1
4 714 1 1 7 . HB1B H 4.914 -0.039 -1.596 1.00 . A A . 6 MK8 HB1B 1 1
4 715 1 1 7 . HBA H 4.288 -2.271 -0.529 1.00 . A A . 6 MK8 HBA 1 1
4 716 1 1 7 . HD H 4.179 -3.150 2.175 1.00 . A A . 6 MK8 HD 1 1
4 717 1 1 7 . HDA H 4.064 -4.315 0.881 1.00 . A A . 6 MK8 HDA 1 1
4 718 1 1 7 . HE H 2.446 -5.671 2.058 1.00 . A A . 6 MK8 HE 1 1
4 719 1 1 7 . HG H 2.147 -3.245 -0.028 1.00 . A A . 6 MK8 HG 1 1
4 720 1 1 7 . HGA H 1.976 -2.210 1.396 1.00 . A A . 6 MK8 HGA 1 1
4 721 1 1 7 . HN H 1.766 -0.168 1.026 1.00 . A A . 6 MK8 HN 1 1
4 722 1 1 7 . N N 1.939 0.145 0.112 1.00 . A A . 6 MK8 N 1 1
4 723 1 1 7 . O O 3.239 -1.572 -2.872 1.00 . A A . 6 MK8 O 1 1
4 724 1 1 8 LEU C C 0.203 -0.250 -4.366 1.00 . A A . 7 LEU C 1 1
4 725 1 1 8 LEU CA C 0.353 -1.421 -3.386 1.00 . A A . 7 LEU CA 1 1
4 726 1 1 8 LEU CB C -1.047 -1.959 -2.999 1.00 . A A . 7 LEU CB 1 1
4 727 1 1 8 LEU CD1 C -1.379 -4.189 -4.197 1.00 . A A . 7 LEU CD1 1 1
4 728 1 1 8 LEU CD2 C -3.315 -2.629 -3.864 1.00 . A A . 7 LEU CD2 1 1
4 729 1 1 8 LEU CG C -1.820 -2.726 -4.103 1.00 . A A . 7 LEU CG 1 1
4 730 1 1 8 LEU H H 0.589 -0.598 -1.440 1.00 . A A . 7 LEU H 1 1
4 731 1 1 8 LEU HA H 0.914 -2.207 -3.862 1.00 . A A . 7 LEU HA 1 1
4 732 1 1 8 LEU HB2 H -0.926 -2.613 -2.152 1.00 . A A . 7 LEU HB2 1 1
4 733 1 1 8 LEU HB3 H -1.654 -1.119 -2.695 1.00 . A A . 7 LEU HB3 1 1
4 734 1 1 8 LEU HD11 H -1.967 -4.794 -3.517 1.00 . A A . 7 LEU HD11 1 1
4 735 1 1 8 LEU HD12 H -0.340 -4.257 -3.931 1.00 . A A . 7 LEU HD12 1 1
4 736 1 1 8 LEU HD13 H -1.518 -4.547 -5.209 1.00 . A A . 7 LEU HD13 1 1
4 737 1 1 8 LEU HD21 H -3.527 -2.775 -2.816 1.00 . A A . 7 LEU HD21 1 1
4 738 1 1 8 LEU HD22 H -3.826 -3.388 -4.446 1.00 . A A . 7 LEU HD22 1 1
4 739 1 1 8 LEU HD23 H -3.661 -1.658 -4.172 1.00 . A A . 7 LEU HD23 1 1
4 740 1 1 8 LEU HG H -1.611 -2.258 -5.052 1.00 . A A . 7 LEU HG 1 1
4 741 1 1 8 LEU N N 1.094 -0.991 -2.182 1.00 . A A . 7 LEU N 1 1
4 742 1 1 8 LEU O O 0.326 -0.455 -5.586 1.00 . A A . 7 LEU O 1 1
4 743 1 1 9 LEU C C 0.978 2.855 -5.038 1.00 . A A . 8 LEU C 1 1
4 744 1 1 9 LEU CA C -0.307 2.217 -4.538 1.00 . A A . 8 LEU CA 1 1
4 745 1 1 9 LEU CB C -1.069 3.230 -3.621 1.00 . A A . 8 LEU CB 1 1
4 746 1 1 9 LEU CD1 C -3.208 3.860 -4.909 1.00 . A A . 8 LEU CD1 1 1
4 747 1 1 9 LEU CD2 C -3.372 1.986 -3.252 1.00 . A A . 8 LEU CD2 1 1
4 748 1 1 9 LEU CG C -2.641 3.297 -3.608 1.00 . A A . 8 LEU CG 1 1
4 749 1 1 9 LEU H H -0.179 1.018 -2.813 1.00 . A A . 8 LEU H 1 1
4 750 1 1 9 LEU HA H -0.926 1.982 -5.384 1.00 . A A . 8 LEU HA 1 1
4 751 1 1 9 LEU HB2 H -0.755 3.047 -2.606 1.00 . A A . 8 LEU HB2 1 1
4 752 1 1 9 LEU HB3 H -0.711 4.212 -3.892 1.00 . A A . 8 LEU HB3 1 1
4 753 1 1 9 LEU HD11 H -3.936 4.621 -4.681 1.00 . A A . 8 LEU HD11 1 1
4 754 1 1 9 LEU HD12 H -3.674 3.069 -5.475 1.00 . A A . 8 LEU HD12 1 1
4 755 1 1 9 LEU HD13 H -2.403 4.296 -5.486 1.00 . A A . 8 LEU HD13 1 1
4 756 1 1 9 LEU HD21 H -3.771 2.060 -2.252 1.00 . A A . 8 LEU HD21 1 1
4 757 1 1 9 LEU HD22 H -2.678 1.161 -3.301 1.00 . A A . 8 LEU HD22 1 1
4 758 1 1 9 LEU HD23 H -4.181 1.819 -3.950 1.00 . A A . 8 LEU HD23 1 1
4 759 1 1 9 LEU HG H -2.894 3.996 -2.838 1.00 . A A . 8 LEU HG 1 1
4 760 1 1 9 LEU N N -0.088 0.971 -3.788 1.00 . A A . 8 LEU N 1 1
4 761 1 1 9 LEU O O 1.001 3.331 -6.194 1.00 . A A . 8 LEU O 1 1
4 762 1 1 10 GLN C C 4.134 2.619 -5.386 1.00 . A A . 9 GLN C 1 1
4 763 1 1 10 GLN CA C 3.339 3.474 -4.429 1.00 . A A . 9 GLN CA 1 1
4 764 1 1 10 GLN CB C 4.129 3.710 -3.147 1.00 . A A . 9 GLN CB 1 1
4 765 1 1 10 GLN CD C 4.455 5.476 -1.368 1.00 . A A . 9 GLN CD 1 1
4 766 1 1 10 GLN CG C 3.459 4.700 -2.210 1.00 . A A . 9 GLN CG 1 1
4 767 1 1 10 GLN H H 1.873 2.482 -3.245 1.00 . A A . 9 GLN H 1 1
4 768 1 1 10 GLN HA H 3.169 4.433 -4.901 1.00 . A A . 9 GLN HA 1 1
4 769 1 1 10 GLN HB2 H 4.238 2.772 -2.627 1.00 . A A . 9 GLN HB2 1 1
4 770 1 1 10 GLN HB3 H 5.109 4.086 -3.405 1.00 . A A . 9 GLN HB3 1 1
4 771 1 1 10 GLN HE21 H 3.485 4.976 0.290 1.00 . A A . 9 GLN HE21 1 1
4 772 1 1 10 GLN HE22 H 4.890 5.941 0.506 1.00 . A A . 9 GLN HE22 1 1
4 773 1 1 10 GLN HG2 H 2.870 5.393 -2.793 1.00 . A A . 9 GLN HG2 1 1
4 774 1 1 10 GLN HG3 H 2.804 4.146 -1.551 1.00 . A A . 9 GLN HG3 1 1
4 775 1 1 10 GLN N N 2.019 2.873 -4.135 1.00 . A A . 9 GLN N 1 1
4 776 1 1 10 GLN NE2 N 4.255 5.467 -0.058 1.00 . A A . 9 GLN NE2 1 1
4 777 1 1 10 GLN O O 4.917 3.174 -6.177 1.00 . A A . 9 GLN O 1 1
4 778 1 1 10 GLN OE1 O 5.379 6.093 -1.889 1.00 . A A . 9 GLN OE1 1 1
4 779 1 1 11 ASP C C 4.022 0.375 -7.583 1.00 . A A . 10 ASP C 1 1
4 780 1 1 11 ASP CA C 4.557 0.264 -6.163 1.00 . A A . 10 ASP CA 1 1
4 781 1 1 11 ASP CB C 4.314 -1.132 -5.598 1.00 . A A . 10 ASP CB 1 1
4 782 1 1 11 ASP CG C 5.152 -2.205 -6.264 1.00 . A A . 10 ASP CG 1 1
4 783 1 1 11 ASP H H 3.237 0.949 -4.655 1.00 . A A . 10 ASP H 1 1
4 784 1 1 11 ASP HA H 5.613 0.480 -6.169 1.00 . A A . 10 ASP HA 1 1
4 785 1 1 11 ASP HB2 H 4.541 -1.122 -4.544 1.00 . A A . 10 ASP HB2 1 1
4 786 1 1 11 ASP HB3 H 3.276 -1.389 -5.727 1.00 . A A . 10 ASP HB3 1 1
4 787 1 1 11 ASP N N 3.898 1.265 -5.307 1.00 . A A . 10 ASP N 1 1
4 788 1 1 11 ASP O O 4.805 0.467 -8.549 1.00 . A A . 10 ASP O 1 1
4 789 1 1 11 ASP OD1 O 6.396 -2.124 -6.189 1.00 . A A . 10 ASP OD1 1 1
4 790 1 1 11 ASP OD2 O 4.559 -3.133 -6.850 1.00 . A A . 10 ASP OD2 1 1
4 791 1 1 12 SER C C 2.233 1.704 -9.717 1.00 . A A . 11 SER C 1 1
4 792 1 1 12 SER CA C 1.885 0.448 -8.930 1.00 . A A . 11 SER CA 1 1
4 793 1 1 12 SER CB C 0.381 0.422 -8.639 1.00 . A A . 11 SER CB 1 1
4 794 1 1 12 SER H H 2.144 0.275 -6.830 1.00 . A A . 11 SER H 1 1
4 795 1 1 12 SER HA H 2.141 -0.415 -9.532 1.00 . A A . 11 SER HA 1 1
4 796 1 1 12 SER HB2 H 0.140 1.188 -7.923 1.00 . A A . 11 SER HB2 1 1
4 797 1 1 12 SER HB3 H -0.170 0.594 -9.542 1.00 . A A . 11 SER HB3 1 1
4 798 1 1 12 SER HG H -0.947 -0.883 -8.053 1.00 . A A . 11 SER HG 1 1
4 799 1 1 12 SER N N 2.649 0.357 -7.668 1.00 . A A . 11 SER N 1 1
4 800 1 1 12 SER O O 1.930 1.789 -10.906 1.00 . A A . 11 SER O 1 1
4 801 1 1 12 SER OG O 0.007 -0.832 -8.113 1.00 . A A . 11 SER OG 1 1
4 802 1 1 13 NH2 HN1 H 2.672 2.654 -8.038 1.00 . A A . 12 NH2 HN1 1 1
4 803 1 1 13 NH2 HN2 H 2.853 3.585 -9.506 1.00 . A A . 12 NH2 HN2 1 1
4 804 1 1 13 NH2 N N 2.627 2.749 -9.015 1.00 . A A . 12 NH2 N 1 1
5 805 1 1 1 ACE C C -2.757 -2.786 7.770 1.00 . A A . 0 ACE C 1 1
5 806 1 1 1 ACE CH3 C -2.176 -3.521 8.956 1.00 . A A . 0 ACE CH3 1 1
5 807 1 1 1 ACE H1 H -1.370 -4.154 8.631 1.00 . A A . 0 ACE H1 1 1
5 808 1 1 1 ACE H2 H -2.952 -4.119 9.412 1.00 . A A . 0 ACE H2 1 1
5 809 1 1 1 ACE H3 H -1.805 -2.809 9.681 1.00 . A A . 0 ACE H3 1 1
5 810 1 1 1 ACE O O -3.527 -3.395 6.998 1.00 . A A . 0 ACE O 1 1
5 811 1 1 2 HIS C C -1.792 -0.348 5.522 1.00 . A A . 1 HIS C 1 1
5 812 1 1 2 HIS CA C -2.862 -0.564 6.587 1.00 . A A . 1 HIS CA 1 1
5 813 1 1 2 HIS CB C -3.244 0.800 7.182 1.00 . A A . 1 HIS CB 1 1
5 814 1 1 2 HIS CD2 C -4.046 2.709 5.630 1.00 . A A . 1 HIS CD2 1 1
5 815 1 1 2 HIS CE1 C -6.188 2.238 5.593 1.00 . A A . 1 HIS CE1 1 1
5 816 1 1 2 HIS CG C -4.233 1.606 6.390 1.00 . A A . 1 HIS CG 1 1
5 817 1 1 2 HIS H H -1.777 -1.094 8.329 1.00 . A A . 1 HIS H 1 1
5 818 1 1 2 HIS HA H -3.731 -1.015 6.133 1.00 . A A . 1 HIS HA 1 1
5 819 1 1 2 HIS HB2 H -3.657 0.655 8.160 1.00 . A A . 1 HIS HB2 1 1
5 820 1 1 2 HIS HB3 H -2.347 1.393 7.269 1.00 . A A . 1 HIS HB3 1 1
5 821 1 1 2 HIS HD1 H -6.036 0.588 6.788 1.00 . A A . 1 HIS HD1 1 1
5 822 1 1 2 HIS HD2 H -3.108 3.197 5.431 1.00 . A A . 1 HIS HD2 1 1
5 823 1 1 2 HIS HE1 H -7.251 2.292 5.393 1.00 . A A . 1 HIS HE1 1 1
5 824 1 1 2 HIS HE2 H -5.453 3.910 4.643 1.00 . A A . 1 HIS HE2 1 1
5 825 1 1 2 HIS N N -2.386 -1.462 7.655 1.00 . A A . 1 HIS N 1 1
5 826 1 1 2 HIS ND1 N -5.587 1.332 6.344 1.00 . A A . 1 HIS ND1 1 1
5 827 1 1 2 HIS NE2 N -5.271 3.084 5.144 1.00 . A A . 1 HIS NE2 1 1
5 828 1 1 2 HIS O O -2.134 -0.046 4.369 1.00 . A A . 1 HIS O 1 1
5 829 1 1 3 . C C 0.534 -1.034 3.674 1.00 . A A . 2 MK8 C 1 1
5 830 1 1 3 . CA C 0.726 -0.233 5.035 1.00 . A A . 2 MK8 CA 1 1
5 831 1 1 3 . CB C 2.069 -0.617 5.774 1.00 . A A . 2 MK8 CB 1 1
5 832 1 1 3 . CB1 C 0.854 1.295 4.803 1.00 . A A . 2 MK8 CB1 1 1
5 833 1 1 3 . CD C 3.079 -2.675 4.727 1.00 . A A . 2 MK8 CD 1 1
5 834 1 1 3 . CE C 2.818 -4.161 4.362 1.00 . A A . 2 MK8 CE 1 1
5 835 1 1 3 . CG C 2.437 -2.104 5.987 1.00 . A A . 2 MK8 CG 1 1
5 836 1 1 3 . HB H 2.058 -0.145 6.748 1.00 . A A . 2 MK8 HB 1 1
5 837 1 1 3 . HB1 H 0.019 1.649 4.223 1.00 . A A . 2 MK8 HB1 1 1
5 838 1 1 3 . HB1A H 1.769 1.495 4.272 1.00 . A A . 2 MK8 HB1A 1 1
5 839 1 1 3 . HB1B H 0.878 1.801 5.762 1.00 . A A . 2 MK8 HB1B 1 1
5 840 1 1 3 . HBA H 2.877 -0.183 5.211 1.00 . A A . 2 MK8 HBA 1 1
5 841 1 1 3 . HD H 4.143 -2.537 4.815 1.00 . A A . 2 MK8 HD 1 1
5 842 1 1 3 . HDA H 2.743 -2.081 3.897 1.00 . A A . 2 MK8 HDA 1 1
5 843 1 1 3 . HE H 2.538 -4.819 5.171 1.00 . A A . 2 MK8 HE 1 1
5 844 1 1 3 . HG H 1.554 -2.666 6.222 1.00 . A A . 2 MK8 HG 1 1
5 845 1 1 3 . HGA H 3.139 -2.171 6.802 1.00 . A A . 2 MK8 HGA 1 1
5 846 1 1 3 . HN H -0.289 -0.669 6.878 1.00 . A A . 2 MK8 HN 1 1
5 847 1 1 3 . N N -0.461 -0.460 5.939 1.00 . A A . 2 MK8 N 1 1
5 848 1 1 3 . O O 1.005 -0.627 2.587 1.00 . A A . 2 MK8 O 1 1
5 849 1 1 4 ILE C C -0.962 -2.563 1.475 1.00 . A A . 3 ILE C 1 1
5 850 1 1 4 ILE CA C -0.384 -3.215 2.726 1.00 . A A . 3 ILE CA 1 1
5 851 1 1 4 ILE CB C -1.321 -4.433 3.110 1.00 . A A . 3 ILE CB 1 1
5 852 1 1 4 ILE CD1 C -0.242 -5.028 5.527 1.00 . A A . 3 ILE CD1 1 1
5 853 1 1 4 ILE CG1 C -1.493 -4.766 4.656 1.00 . A A . 3 ILE CG1 1 1
5 854 1 1 4 ILE CG2 C -0.898 -5.670 2.314 1.00 . A A . 3 ILE CG2 1 1
5 855 1 1 4 ILE H H -0.419 -2.498 4.721 1.00 . A A . 3 ILE H 1 1
5 856 1 1 4 ILE HA H 0.571 -3.624 2.457 1.00 . A A . 3 ILE HA 1 1
5 857 1 1 4 ILE HB H -2.298 -4.176 2.724 1.00 . A A . 3 ILE HB 1 1
5 858 1 1 4 ILE HD11 H -0.550 -5.224 6.545 1.00 . A A . 3 ILE HD11 1 1
5 859 1 1 4 ILE HD12 H 0.402 -4.165 5.510 1.00 . A A . 3 ILE HD12 1 1
5 860 1 1 4 ILE HD13 H 0.288 -5.885 5.144 1.00 . A A . 3 ILE HD13 1 1
5 861 1 1 4 ILE HG12 H -2.022 -3.949 5.109 1.00 . A A . 3 ILE HG12 1 1
5 862 1 1 4 ILE HG13 H -2.111 -5.643 4.728 1.00 . A A . 3 ILE HG13 1 1
5 863 1 1 4 ILE HG21 H -1.702 -6.394 2.313 1.00 . A A . 3 ILE HG21 1 1
5 864 1 1 4 ILE HG22 H -0.022 -6.106 2.769 1.00 . A A . 3 ILE HG22 1 1
5 865 1 1 4 ILE HG23 H -0.675 -5.380 1.295 1.00 . A A . 3 ILE HG23 1 1
5 866 1 1 4 ILE N N -0.129 -2.240 3.824 1.00 . A A . 3 ILE N 1 1
5 867 1 1 4 ILE O O -0.330 -2.650 0.398 1.00 . A A . 3 ILE O 1 1
5 868 1 1 5 LEU C C -2.045 -0.207 -0.147 1.00 . A A . 4 LEU C 1 1
5 869 1 1 5 LEU CA C -2.922 -1.268 0.517 1.00 . A A . 4 LEU CA 1 1
5 870 1 1 5 LEU CB C -4.269 -0.673 1.007 1.00 . A A . 4 LEU CB 1 1
5 871 1 1 5 LEU CD1 C -3.883 1.764 1.593 1.00 . A A . 4 LEU CD1 1 1
5 872 1 1 5 LEU CD2 C -5.569 0.420 2.822 1.00 . A A . 4 LEU CD2 1 1
5 873 1 1 5 LEU CG C -4.230 0.382 2.125 1.00 . A A . 4 LEU CG 1 1
5 874 1 1 5 LEU H H -2.597 -1.941 2.514 1.00 . A A . 4 LEU H 1 1
5 875 1 1 5 LEU HA H -3.135 -2.035 -0.216 1.00 . A A . 4 LEU HA 1 1
5 876 1 1 5 LEU HB2 H -4.763 -0.227 0.160 1.00 . A A . 4 LEU HB2 1 1
5 877 1 1 5 LEU HB3 H -4.876 -1.494 1.357 1.00 . A A . 4 LEU HB3 1 1
5 878 1 1 5 LEU HD11 H -2.817 1.902 1.629 1.00 . A A . 4 LEU HD11 1 1
5 879 1 1 5 LEU HD12 H -4.369 2.516 2.197 1.00 . A A . 4 LEU HD12 1 1
5 880 1 1 5 LEU HD13 H -4.222 1.846 0.572 1.00 . A A . 4 LEU HD13 1 1
5 881 1 1 5 LEU HD21 H -5.810 1.442 3.070 1.00 . A A . 4 LEU HD21 1 1
5 882 1 1 5 LEU HD22 H -5.526 -0.170 3.721 1.00 . A A . 4 LEU HD22 1 1
5 883 1 1 5 LEU HD23 H -6.323 0.021 2.160 1.00 . A A . 4 LEU HD23 1 1
5 884 1 1 5 LEU HG H -3.486 0.108 2.848 1.00 . A A . 4 LEU HG 1 1
5 885 1 1 5 LEU N N -2.187 -1.935 1.628 1.00 . A A . 4 LEU N 1 1
5 886 1 1 5 LEU O O -2.158 0.024 -1.364 1.00 . A A . 4 LEU O 1 1
5 887 1 1 6 HIS C C 0.930 0.882 -0.505 1.00 . A A . 5 HIS C 1 1
5 888 1 1 6 HIS CA C -0.222 1.458 0.321 1.00 . A A . 5 HIS CA 1 1
5 889 1 1 6 HIS CB C 0.322 2.141 1.564 1.00 . A A . 5 HIS CB 1 1
5 890 1 1 6 HIS CD2 C -1.080 3.996 2.683 1.00 . A A . 5 HIS CD2 1 1
5 891 1 1 6 HIS CE1 C -0.482 5.666 1.402 1.00 . A A . 5 HIS CE1 1 1
5 892 1 1 6 HIS CG C -0.207 3.519 1.766 1.00 . A A . 5 HIS CG 1 1
5 893 1 1 6 HIS H H -1.187 0.148 1.654 1.00 . A A . 5 HIS H 1 1
5 894 1 1 6 HIS HA H -0.751 2.189 -0.273 1.00 . A A . 5 HIS HA 1 1
5 895 1 1 6 HIS HB2 H 0.051 1.558 2.424 1.00 . A A . 5 HIS HB2 1 1
5 896 1 1 6 HIS HB3 H 1.395 2.199 1.499 1.00 . A A . 5 HIS HB3 1 1
5 897 1 1 6 HIS HD1 H 0.759 4.569 0.208 1.00 . A A . 5 HIS HD1 1 1
5 898 1 1 6 HIS HD2 H -1.571 3.428 3.460 1.00 . A A . 5 HIS HD2 1 1
5 899 1 1 6 HIS HE1 H -0.388 6.654 0.985 1.00 . A A . 5 HIS HE1 1 1
5 900 1 1 6 HIS HE2 H -1.880 5.922 2.877 1.00 . A A . 5 HIS HE2 1 1
5 901 1 1 6 HIS N N -1.173 0.415 0.712 1.00 . A A . 5 HIS N 1 1
5 902 1 1 6 HIS ND1 N 0.147 4.592 0.975 1.00 . A A . 5 HIS ND1 1 1
5 903 1 1 6 HIS NE2 N -1.234 5.331 2.435 1.00 . A A . 5 HIS NE2 1 1
5 904 1 1 6 HIS O O 1.370 1.531 -1.458 1.00 . A A . 5 HIS O 1 1
5 905 1 1 7 . C C 2.182 -1.264 -2.297 1.00 . A A . 6 MK8 C 1 1
5 906 1 1 7 . CA C 2.562 -1.077 -0.786 1.00 . A A . 6 MK8 CA 1 1
5 907 1 1 7 . CB C 2.761 -2.516 -0.202 1.00 . A A . 6 MK8 CB 1 1
5 908 1 1 7 . CB1 C 3.898 -0.292 -0.614 1.00 . A A . 6 MK8 CB1 1 1
5 909 1 1 7 . CD C 3.266 -4.082 1.729 1.00 . A A . 6 MK8 CD 1 1
5 910 1 1 7 . CE C 2.895 -4.744 3.104 1.00 . A A . 6 MK8 CE 1 1
5 911 1 1 7 . CG C 2.676 -2.724 1.328 1.00 . A A . 6 MK8 CG 1 1
5 912 1 1 7 . HB H 3.732 -2.870 -0.524 1.00 . A A . 6 MK8 HB 1 1
5 913 1 1 7 . HB1 H 4.607 -0.633 -1.349 1.00 . A A . 6 MK8 HB1 1 1
5 914 1 1 7 . HB1A H 4.288 -0.470 0.376 1.00 . A A . 6 MK8 HB1A 1 1
5 915 1 1 7 . HB1B H 3.719 0.767 -0.744 1.00 . A A . 6 MK8 HB1B 1 1
5 916 1 1 7 . HBA H 2.014 -3.161 -0.646 1.00 . A A . 6 MK8 HBA 1 1
5 917 1 1 7 . HD H 4.345 -3.985 1.689 1.00 . A A . 6 MK8 HD 1 1
5 918 1 1 7 . HDA H 2.973 -4.784 0.968 1.00 . A A . 6 MK8 HDA 1 1
5 919 1 1 7 . HE H 2.674 -5.800 3.066 1.00 . A A . 6 MK8 HE 1 1
5 920 1 1 7 . HG H 1.640 -2.689 1.629 1.00 . A A . 6 MK8 HG 1 1
5 921 1 1 7 . HGA H 3.228 -1.941 1.825 1.00 . A A . 6 MK8 HGA 1 1
5 922 1 1 7 . HN H 1.025 -0.781 0.671 1.00 . A A . 6 MK8 HN 1 1
5 923 1 1 7 . N N 1.431 -0.357 -0.105 1.00 . A A . 6 MK8 N 1 1
5 924 1 1 7 . O O 3.063 -1.448 -3.182 1.00 . A A . 6 MK8 O 1 1
5 925 1 1 8 LEU C C 0.171 -0.198 -4.716 1.00 . A A . 7 LEU C 1 1
5 926 1 1 8 LEU CA C 0.213 -1.490 -3.884 1.00 . A A . 7 LEU CA 1 1
5 927 1 1 8 LEU CB C -1.218 -2.050 -3.721 1.00 . A A . 7 LEU CB 1 1
5 928 1 1 8 LEU CD1 C -1.446 -4.113 -5.169 1.00 . A A . 7 LEU CD1 1 1
5 929 1 1 8 LEU CD2 C -3.376 -2.554 -4.903 1.00 . A A . 7 LEU CD2 1 1
5 930 1 1 8 LEU CG C -1.866 -2.661 -4.977 1.00 . A A . 7 LEU CG 1 1
5 931 1 1 8 LEU H H 0.219 -1.181 -1.788 1.00 . A A . 7 LEU H 1 1
5 932 1 1 8 LEU HA H 0.812 -2.226 -4.406 1.00 . A A . 7 LEU HA 1 1
5 933 1 1 8 LEU HB2 H -1.197 -2.811 -2.956 1.00 . A A . 7 LEU HB2 1 1
5 934 1 1 8 LEU HB3 H -1.851 -1.246 -3.384 1.00 . A A . 7 LEU HB3 1 1
5 935 1 1 8 LEU HD11 H -0.432 -4.238 -4.827 1.00 . A A . 7 LEU HD11 1 1
5 936 1 1 8 LEU HD12 H -1.512 -4.375 -6.215 1.00 . A A . 7 LEU HD12 1 1
5 937 1 1 8 LEU HD13 H -2.104 -4.750 -4.596 1.00 . A A . 7 LEU HD13 1 1
5 938 1 1 8 LEU HD21 H -3.786 -2.531 -5.904 1.00 . A A . 7 LEU HD21 1 1
5 939 1 1 8 LEU HD22 H -3.648 -1.653 -4.380 1.00 . A A . 7 LEU HD22 1 1
5 940 1 1 8 LEU HD23 H -3.774 -3.414 -4.377 1.00 . A A . 7 LEU HD23 1 1
5 941 1 1 8 LEU HG H -1.537 -2.101 -5.841 1.00 . A A . 7 LEU HG 1 1
5 942 1 1 8 LEU N N 0.824 -1.278 -2.549 1.00 . A A . 7 LEU N 1 1
5 943 1 1 8 LEU O O 0.413 -0.253 -5.941 1.00 . A A . 7 LEU O 1 1
5 944 1 1 9 LEU C C 1.023 2.896 -4.946 1.00 . A A . 8 LEU C 1 1
5 945 1 1 9 LEU CA C -0.325 2.273 -4.642 1.00 . A A . 8 LEU CA 1 1
5 946 1 1 9 LEU CB C -1.142 3.222 -3.729 1.00 . A A . 8 LEU CB 1 1
5 947 1 1 9 LEU CD1 C -2.930 3.485 -1.991 1.00 . A A . 8 LEU CD1 1 1
5 948 1 1 9 LEU CD2 C -3.609 2.787 -4.280 1.00 . A A . 8 LEU CD2 1 1
5 949 1 1 9 LEU CG C -2.505 2.700 -3.217 1.00 . A A . 8 LEU CG 1 1
5 950 1 1 9 LEU H H -0.381 0.860 -3.070 1.00 . A A . 8 LEU H 1 1
5 951 1 1 9 LEU HA H -0.861 2.138 -5.564 1.00 . A A . 8 LEU HA 1 1
5 952 1 1 9 LEU HB2 H -0.538 3.462 -2.865 1.00 . A A . 8 LEU HB2 1 1
5 953 1 1 9 LEU HB3 H -1.318 4.136 -4.283 1.00 . A A . 8 LEU HB3 1 1
5 954 1 1 9 LEU HD11 H -3.873 3.099 -1.640 1.00 . A A . 8 LEU HD11 1 1
5 955 1 1 9 LEU HD12 H -3.043 4.525 -2.253 1.00 . A A . 8 LEU HD12 1 1
5 956 1 1 9 LEU HD13 H -2.185 3.382 -1.211 1.00 . A A . 8 LEU HD13 1 1
5 957 1 1 9 LEU HD21 H -4.359 2.037 -4.079 1.00 . A A . 8 LEU HD21 1 1
5 958 1 1 9 LEU HD22 H -3.180 2.614 -5.257 1.00 . A A . 8 LEU HD22 1 1
5 959 1 1 9 LEU HD23 H -4.057 3.768 -4.254 1.00 . A A . 8 LEU HD23 1 1
5 960 1 1 9 LEU HG H -2.394 1.666 -2.925 1.00 . A A . 8 LEU HG 1 1
5 961 1 1 9 LEU N N -0.180 0.944 -4.020 1.00 . A A . 8 LEU N 1 1
5 962 1 1 9 LEU O O 1.160 3.595 -5.968 1.00 . A A . 8 LEU O 1 1
5 963 1 1 10 GLN C C 4.197 2.428 -5.155 1.00 . A A . 9 GLN C 1 1
5 964 1 1 10 GLN CA C 3.374 3.145 -4.088 1.00 . A A . 9 GLN CA 1 1
5 965 1 1 10 GLN CB C 4.051 3.009 -2.718 1.00 . A A . 9 GLN CB 1 1
5 966 1 1 10 GLN CD C 4.022 3.632 -0.259 1.00 . A A . 9 GLN CD 1 1
5 967 1 1 10 GLN CG C 3.361 3.802 -1.615 1.00 . A A . 9 GLN CG 1 1
5 968 1 1 10 GLN H H 1.759 2.073 -3.257 1.00 . A A . 9 GLN H 1 1
5 969 1 1 10 GLN HA H 3.307 4.193 -4.339 1.00 . A A . 9 GLN HA 1 1
5 970 1 1 10 GLN HB2 H 4.057 1.966 -2.432 1.00 . A A . 9 GLN HB2 1 1
5 971 1 1 10 GLN HB3 H 5.069 3.357 -2.798 1.00 . A A . 9 GLN HB3 1 1
5 972 1 1 10 GLN HE21 H 4.422 5.574 -0.173 1.00 . A A . 9 GLN HE21 1 1
5 973 1 1 10 GLN HE22 H 4.931 4.646 1.187 1.00 . A A . 9 GLN HE22 1 1
5 974 1 1 10 GLN HG2 H 3.370 4.854 -1.879 1.00 . A A . 9 GLN HG2 1 1
5 975 1 1 10 GLN HG3 H 2.339 3.460 -1.543 1.00 . A A . 9 GLN HG3 1 1
5 976 1 1 10 GLN N N 1.997 2.631 -4.023 1.00 . A A . 9 GLN N 1 1
5 977 1 1 10 GLN NE2 N 4.512 4.728 0.306 1.00 . A A . 9 GLN NE2 1 1
5 978 1 1 10 GLN O O 5.003 3.083 -5.852 1.00 . A A . 9 GLN O 1 1
5 979 1 1 10 GLN OE1 O 4.078 2.534 0.280 1.00 . A A . 9 GLN OE1 1 1
5 980 1 1 11 ASP C C 4.182 0.494 -7.642 1.00 . A A . 10 ASP C 1 1
5 981 1 1 11 ASP CA C 4.666 0.189 -6.231 1.00 . A A . 10 ASP CA 1 1
5 982 1 1 11 ASP CB C 4.398 -1.276 -5.898 1.00 . A A . 10 ASP CB 1 1
5 983 1 1 11 ASP CG C 5.247 -2.238 -6.722 1.00 . A A . 10 ASP CG 1 1
5 984 1 1 11 ASP H H 3.323 0.655 -4.660 1.00 . A A . 10 ASP H 1 1
5 985 1 1 11 ASP HA H 5.722 0.386 -6.171 1.00 . A A . 10 ASP HA 1 1
5 986 1 1 11 ASP HB2 H 4.608 -1.438 -4.852 1.00 . A A . 10 ASP HB2 1 1
5 987 1 1 11 ASP HB3 H 3.356 -1.489 -6.088 1.00 . A A . 10 ASP HB3 1 1
5 988 1 1 11 ASP N N 3.977 1.066 -5.262 1.00 . A A . 10 ASP N 1 1
5 989 1 1 11 ASP O O 5.004 0.575 -8.576 1.00 . A A . 10 ASP O 1 1
5 990 1 1 11 ASP OD1 O 5.105 -2.249 -7.964 1.00 . A A . 10 ASP OD1 1 1
5 991 1 1 11 ASP OD2 O 6.063 -2.972 -6.132 1.00 . A A . 10 ASP OD2 1 1
5 992 1 1 12 SER C C 2.603 2.321 -9.589 1.00 . A A . 11 SER C 1 1
5 993 1 1 12 SER CA C 2.126 0.992 -9.015 1.00 . A A . 11 SER CA 1 1
5 994 1 1 12 SER CB C 0.608 1.028 -8.790 1.00 . A A . 11 SER CB 1 1
5 995 1 1 12 SER H H 2.283 0.599 -6.939 1.00 . A A . 11 SER H 1 1
5 996 1 1 12 SER HA H 2.359 0.214 -9.722 1.00 . A A . 11 SER HA 1 1
5 997 1 1 12 SER HB2 H 0.372 1.682 -7.964 1.00 . A A . 11 SER HB2 1 1
5 998 1 1 12 SER HB3 H 0.124 1.390 -9.683 1.00 . A A . 11 SER HB3 1 1
5 999 1 1 12 SER HG H -0.377 -0.584 -9.246 1.00 . A A . 11 SER HG 1 1
5 1000 1 1 12 SER N N 2.826 0.676 -7.754 1.00 . A A . 11 SER N 1 1
5 1001 1 1 12 SER O O 2.503 2.555 -10.790 1.00 . A A . 11 SER O 1 1
5 1002 1 1 12 SER OG O 0.115 -0.259 -8.496 1.00 . A A . 11 SER OG 1 1
5 1003 1 1 13 NH2 HN1 H 2.878 3.038 -7.769 1.00 . A A . 12 NH2 HN1 1 1
5 1004 1 1 13 NH2 HN2 H 3.255 4.115 -9.040 1.00 . A A . 12 NH2 HN2 1 1
5 1005 1 1 13 NH2 N N 2.949 3.251 -8.709 1.00 . A A . 12 NH2 N 1 1
6 1006 1 1 1 ACE C C -2.885 -2.441 7.465 1.00 . A A . 0 ACE C 1 1
6 1007 1 1 1 ACE CH3 C -2.584 -2.924 8.868 1.00 . A A . 0 ACE CH3 1 1
6 1008 1 1 1 ACE H1 H -1.516 -3.032 8.990 1.00 . A A . 0 ACE H1 1 1
6 1009 1 1 1 ACE H2 H -3.060 -3.880 9.033 1.00 . A A . 0 ACE H2 1 1
6 1010 1 1 1 ACE H3 H -2.958 -2.206 9.580 1.00 . A A . 0 ACE H3 1 1
6 1011 1 1 1 ACE O O -3.086 -3.276 6.556 1.00 . A A . 0 ACE O 1 1
6 1012 1 1 2 HIS C C -1.882 -0.236 5.193 1.00 . A A . 1 HIS C 1 1
6 1013 1 1 2 HIS CA C -3.161 -0.387 6.023 1.00 . A A . 1 HIS CA 1 1
6 1014 1 1 2 HIS CB C -3.867 0.973 6.236 1.00 . A A . 1 HIS CB 1 1
6 1015 1 1 2 HIS CD2 C -2.573 3.133 6.784 1.00 . A A . 1 HIS CD2 1 1
6 1016 1 1 2 HIS CE1 C -2.341 2.866 8.942 1.00 . A A . 1 HIS CE1 1 1
6 1017 1 1 2 HIS CG C -3.163 1.967 7.113 1.00 . A A . 1 HIS CG 1 1
6 1018 1 1 2 HIS H H -2.706 -0.521 8.088 1.00 . A A . 1 HIS H 1 1
6 1019 1 1 2 HIS HA H -3.828 -1.022 5.467 1.00 . A A . 1 HIS HA 1 1
6 1020 1 1 2 HIS HB2 H -3.994 1.449 5.276 1.00 . A A . 1 HIS HB2 1 1
6 1021 1 1 2 HIS HB3 H -4.839 0.785 6.667 1.00 . A A . 1 HIS HB3 1 1
6 1022 1 1 2 HIS HD1 H -3.323 1.070 9.017 1.00 . A A . 1 HIS HD1 1 1
6 1023 1 1 2 HIS HD2 H -2.504 3.552 5.794 1.00 . A A . 1 HIS HD2 1 1
6 1024 1 1 2 HIS HE1 H -2.064 3.020 9.974 1.00 . A A . 1 HIS HE1 1 1
6 1025 1 1 2 HIS HE2 H -1.596 4.534 8.006 1.00 . A A . 1 HIS HE2 1 1
6 1026 1 1 2 HIS N N -2.897 -1.072 7.305 1.00 . A A . 1 HIS N 1 1
6 1027 1 1 2 HIS ND1 N -3.001 1.822 8.472 1.00 . A A . 1 HIS ND1 1 1
6 1028 1 1 2 HIS NE2 N -2.070 3.678 7.936 1.00 . A A . 1 HIS NE2 1 1
6 1029 1 1 2 HIS O O -1.930 0.281 4.069 1.00 . A A . 1 HIS O 1 1
6 1030 1 1 3 . C C 0.538 -1.334 3.714 1.00 . A A . 2 MK8 C 1 1
6 1031 1 1 3 . CA C 0.635 -0.676 5.164 1.00 . A A . 2 MK8 CA 1 1
6 1032 1 1 3 . CB C 1.573 -1.487 6.146 1.00 . A A . 2 MK8 CB 1 1
6 1033 1 1 3 . CB1 C 1.154 0.787 5.160 1.00 . A A . 2 MK8 CB1 1 1
6 1034 1 1 3 . CD C 2.800 -3.289 4.889 1.00 . A A . 2 MK8 CD 1 1
6 1035 1 1 3 . CE C 4.012 -3.994 4.241 1.00 . A A . 2 MK8 CE 1 1
6 1036 1 1 3 . CG C 2.959 -1.991 5.661 1.00 . A A . 2 MK8 CG 1 1
6 1037 1 1 3 . HB H 1.017 -2.347 6.476 1.00 . A A . 2 MK8 HB 1 1
6 1038 1 1 3 . HB1 H 0.463 1.417 4.624 1.00 . A A . 2 MK8 HB1 1 1
6 1039 1 1 3 . HB1A H 2.120 0.826 4.683 1.00 . A A . 2 MK8 HB1A 1 1
6 1040 1 1 3 . HB1B H 1.243 1.129 6.180 1.00 . A A . 2 MK8 HB1B 1 1
6 1041 1 1 3 . HBA H 1.755 -0.868 7.004 1.00 . A A . 2 MK8 HBA 1 1
6 1042 1 1 3 . HD H 2.073 -3.102 4.113 1.00 . A A . 2 MK8 HD 1 1
6 1043 1 1 3 . HDA H 2.370 -4.001 5.570 1.00 . A A . 2 MK8 HDA 1 1
6 1044 1 1 3 . HE H 4.390 -4.844 4.784 1.00 . A A . 2 MK8 HE 1 1
6 1045 1 1 3 . HG H 3.578 -2.170 6.512 1.00 . A A . 2 MK8 HG 1 1
6 1046 1 1 3 . HGA H 3.404 -1.247 5.027 1.00 . A A . 2 MK8 HGA 1 1
6 1047 1 1 3 . HN H -0.798 -1.091 6.691 1.00 . A A . 2 MK8 HN 1 1
6 1048 1 1 3 . N N -0.725 -0.704 5.787 1.00 . A A . 2 MK8 N 1 1
6 1049 1 1 3 . O O 0.851 -0.722 2.667 1.00 . A A . 2 MK8 O 1 1
6 1050 1 1 4 ILE C C -0.821 -2.811 1.423 1.00 . A A . 3 ILE C 1 1
6 1051 1 1 4 ILE CA C -0.015 -3.528 2.530 1.00 . A A . 3 ILE CA 1 1
6 1052 1 1 4 ILE CB C -0.645 -4.960 2.818 1.00 . A A . 3 ILE CB 1 1
6 1053 1 1 4 ILE CD1 C -0.857 -5.077 5.393 1.00 . A A . 3 ILE CD1 1 1
6 1054 1 1 4 ILE CG1 C -0.170 -5.606 4.151 1.00 . A A . 3 ILE CG1 1 1
6 1055 1 1 4 ILE CG2 C -0.269 -5.941 1.699 1.00 . A A . 3 ILE CG2 1 1
6 1056 1 1 4 ILE H H -0.070 -3.049 4.601 1.00 . A A . 3 ILE H 1 1
6 1057 1 1 4 ILE HA H 0.999 -3.681 2.163 1.00 . A A . 3 ILE HA 1 1
6 1058 1 1 4 ILE HB H -1.725 -4.854 2.832 1.00 . A A . 3 ILE HB 1 1
6 1059 1 1 4 ILE HD11 H -1.773 -5.630 5.564 1.00 . A A . 3 ILE HD11 1 1
6 1060 1 1 4 ILE HD12 H -1.079 -4.031 5.261 1.00 . A A . 3 ILE HD12 1 1
6 1061 1 1 4 ILE HD13 H -0.203 -5.197 6.242 1.00 . A A . 3 ILE HD13 1 1
6 1062 1 1 4 ILE HG12 H -0.340 -6.674 4.115 1.00 . A A . 3 ILE HG12 1 1
6 1063 1 1 4 ILE HG13 H 0.887 -5.429 4.261 1.00 . A A . 3 ILE HG13 1 1
6 1064 1 1 4 ILE HG21 H 0.581 -6.535 2.010 1.00 . A A . 3 ILE HG21 1 1
6 1065 1 1 4 ILE HG22 H -0.005 -5.383 0.810 1.00 . A A . 3 ILE HG22 1 1
6 1066 1 1 4 ILE HG23 H -1.106 -6.583 1.483 1.00 . A A . 3 ILE HG23 1 1
6 1067 1 1 4 ILE N N 0.116 -2.653 3.733 1.00 . A A . 3 ILE N 1 1
6 1068 1 1 4 ILE O O -0.496 -2.954 0.237 1.00 . A A . 3 ILE O 1 1
6 1069 1 1 5 LEU C C -1.908 -0.206 0.203 1.00 . A A . 4 LEU C 1 1
6 1070 1 1 5 LEU CA C -2.741 -1.225 1.009 1.00 . A A . 4 LEU CA 1 1
6 1071 1 1 5 LEU CB C -3.805 -0.530 1.916 1.00 . A A . 4 LEU CB 1 1
6 1072 1 1 5 LEU CD1 C -6.097 0.419 2.151 1.00 . A A . 4 LEU CD1 1 1
6 1073 1 1 5 LEU CD2 C -4.385 1.713 0.904 1.00 . A A . 4 LEU CD2 1 1
6 1074 1 1 5 LEU CG C -4.894 0.313 1.236 1.00 . A A . 4 LEU CG 1 1
6 1075 1 1 5 LEU H H -1.993 -1.972 2.843 1.00 . A A . 4 LEU H 1 1
6 1076 1 1 5 LEU HA H -3.236 -1.897 0.325 1.00 . A A . 4 LEU HA 1 1
6 1077 1 1 5 LEU HB2 H -4.311 -1.300 2.488 1.00 . A A . 4 LEU HB2 1 1
6 1078 1 1 5 LEU HB3 H -3.282 0.107 2.615 1.00 . A A . 4 LEU HB3 1 1
6 1079 1 1 5 LEU HD11 H -6.926 -0.107 1.710 1.00 . A A . 4 LEU HD11 1 1
6 1080 1 1 5 LEU HD12 H -6.352 1.459 2.285 1.00 . A A . 4 LEU HD12 1 1
6 1081 1 1 5 LEU HD13 H -5.865 -0.022 3.112 1.00 . A A . 4 LEU HD13 1 1
6 1082 1 1 5 LEU HD21 H -5.222 2.362 0.725 1.00 . A A . 4 LEU HD21 1 1
6 1083 1 1 5 LEU HD22 H -3.763 1.664 0.027 1.00 . A A . 4 LEU HD22 1 1
6 1084 1 1 5 LEU HD23 H -3.802 2.096 1.733 1.00 . A A . 4 LEU HD23 1 1
6 1085 1 1 5 LEU HG H -5.204 -0.165 0.316 1.00 . A A . 4 LEU HG 1 1
6 1086 1 1 5 LEU N N -1.851 -2.023 1.874 1.00 . A A . 4 LEU N 1 1
6 1087 1 1 5 LEU O O -2.091 -0.087 -1.026 1.00 . A A . 4 LEU O 1 1
6 1088 1 1 6 HIS C C 0.986 0.966 -0.484 1.00 . A A . 5 HIS C 1 1
6 1089 1 1 6 HIS CA C -0.110 1.548 0.404 1.00 . A A . 5 HIS CA 1 1
6 1090 1 1 6 HIS CB C 0.500 2.329 1.565 1.00 . A A . 5 HIS CB 1 1
6 1091 1 1 6 HIS CD2 C -0.968 4.195 2.614 1.00 . A A . 5 HIS CD2 1 1
6 1092 1 1 6 HIS CE1 C -0.417 5.822 1.248 1.00 . A A . 5 HIS CE1 1 1
6 1093 1 1 6 HIS CG C -0.074 3.700 1.724 1.00 . A A . 5 HIS CG 1 1
6 1094 1 1 6 HIS H H -0.964 0.336 1.906 1.00 . A A . 5 HIS H 1 1
6 1095 1 1 6 HIS HA H -0.704 2.221 -0.190 1.00 . A A . 5 HIS HA 1 1
6 1096 1 1 6 HIS HB2 H 0.316 1.787 2.473 1.00 . A A . 5 HIS HB2 1 1
6 1097 1 1 6 HIS HB3 H 1.564 2.423 1.418 1.00 . A A . 5 HIS HB3 1 1
6 1098 1 1 6 HIS HD1 H 0.865 4.696 0.109 1.00 . A A . 5 HIS HD1 1 1
6 1099 1 1 6 HIS HD2 H -1.454 3.644 3.413 1.00 . A A . 5 HIS HD2 1 1
6 1100 1 1 6 HIS HE1 H -0.330 6.798 0.800 1.00 . A A . 5 HIS HE1 1 1
6 1101 1 1 6 HIS HE2 H -1.759 6.124 2.768 1.00 . A A . 5 HIS HE2 1 1
6 1102 1 1 6 HIS N N -1.009 0.514 0.942 1.00 . A A . 5 HIS N 1 1
6 1103 1 1 6 HIS ND1 N 0.248 4.743 0.880 1.00 . A A . 5 HIS ND1 1 1
6 1104 1 1 6 HIS NE2 N -1.163 5.513 2.295 1.00 . A A . 5 HIS NE2 1 1
6 1105 1 1 6 HIS O O 1.288 1.537 -1.539 1.00 . A A . 5 HIS O 1 1
6 1106 1 1 7 . C C 2.263 -1.194 -2.216 1.00 . A A . 6 MK8 C 1 1
6 1107 1 1 7 . CA C 2.716 -0.910 -0.743 1.00 . A A . 6 MK8 CA 1 1
6 1108 1 1 7 . CB C 3.007 -2.303 -0.092 1.00 . A A . 6 MK8 CB 1 1
6 1109 1 1 7 . CB1 C 4.011 -0.063 -0.701 1.00 . A A . 6 MK8 CB1 1 1
6 1110 1 1 7 . CD C 4.357 -2.521 2.059 1.00 . A A . 6 MK8 CD 1 1
6 1111 1 1 7 . CE C 4.662 -3.681 3.062 1.00 . A A . 6 MK8 CE 1 1
6 1112 1 1 7 . CG C 2.967 -2.412 1.451 1.00 . A A . 6 MK8 CG 1 1
6 1113 1 1 7 . HB H 3.983 -2.629 -0.418 1.00 . A A . 6 MK8 HB 1 1
6 1114 1 1 7 . HB1 H 4.264 0.245 -1.704 1.00 . A A . 6 MK8 HB1 1 1
6 1115 1 1 7 . HB1A H 4.811 -0.654 -0.293 1.00 . A A . 6 MK8 HB1A 1 1
6 1116 1 1 7 . HB1B H 3.857 0.817 -0.081 1.00 . A A . 6 MK8 HB1B 1 1
6 1117 1 1 7 . HBA H 2.283 -2.995 -0.480 1.00 . A A . 6 MK8 HBA 1 1
6 1118 1 1 7 . HD H 4.564 -1.587 2.565 1.00 . A A . 6 MK8 HD 1 1
6 1119 1 1 7 . HDA H 5.054 -2.619 1.242 1.00 . A A . 6 MK8 HDA 1 1
6 1120 1 1 7 . HE H 5.485 -4.325 2.803 1.00 . A A . 6 MK8 HE 1 1
6 1121 1 1 7 . HG H 2.396 -3.293 1.722 1.00 . A A . 6 MK8 HG 1 1
6 1122 1 1 7 . HGA H 2.477 -1.531 1.846 1.00 . A A . 6 MK8 HGA 1 1
6 1123 1 1 7 . HN H 1.301 -0.546 0.822 1.00 . A A . 6 MK8 HN 1 1
6 1124 1 1 7 . N N 1.602 -0.187 -0.027 1.00 . A A . 6 MK8 N 1 1
6 1125 1 1 7 . O O 3.096 -1.460 -3.116 1.00 . A A . 6 MK8 O 1 1
6 1126 1 1 8 LEU C C 0.154 -0.175 -4.589 1.00 . A A . 7 LEU C 1 1
6 1127 1 1 8 LEU CA C 0.219 -1.431 -3.711 1.00 . A A . 7 LEU CA 1 1
6 1128 1 1 8 LEU CB C -1.223 -1.957 -3.487 1.00 . A A . 7 LEU CB 1 1
6 1129 1 1 8 LEU CD1 C -1.465 -4.069 -4.903 1.00 . A A . 7 LEU CD1 1 1
6 1130 1 1 8 LEU CD2 C -3.440 -2.575 -4.502 1.00 . A A . 7 LEU CD2 1 1
6 1131 1 1 8 LEU CG C -1.929 -2.622 -4.690 1.00 . A A . 7 LEU CG 1 1
6 1132 1 1 8 LEU H H 0.317 -0.988 -1.635 1.00 . A A . 7 LEU H 1 1
6 1133 1 1 8 LEU HA H 0.786 -2.191 -4.224 1.00 . A A . 7 LEU HA 1 1
6 1134 1 1 8 LEU HB2 H -1.197 -2.673 -2.682 1.00 . A A . 7 LEU HB2 1 1
6 1135 1 1 8 LEU HB3 H -1.828 -1.117 -3.176 1.00 . A A . 7 LEU HB3 1 1
6 1136 1 1 8 LEU HD11 H -2.042 -4.724 -4.269 1.00 . A A . 7 LEU HD11 1 1
6 1137 1 1 8 LEU HD12 H -0.415 -4.158 -4.652 1.00 . A A . 7 LEU HD12 1 1
6 1138 1 1 8 LEU HD13 H -1.618 -4.345 -5.934 1.00 . A A . 7 LEU HD13 1 1
6 1139 1 1 8 LEU HD21 H -3.692 -2.906 -3.506 1.00 . A A . 7 LEU HD21 1 1
6 1140 1 1 8 LEU HD22 H -3.909 -3.222 -5.226 1.00 . A A . 7 LEU HD22 1 1
6 1141 1 1 8 LEU HD23 H -3.794 -1.565 -4.645 1.00 . A A . 7 LEU HD23 1 1
6 1142 1 1 8 LEU HG H -1.692 -2.061 -5.577 1.00 . A A . 7 LEU HG 1 1
6 1143 1 1 8 LEU N N 0.887 -1.169 -2.411 1.00 . A A . 7 LEU N 1 1
6 1144 1 1 8 LEU O O 0.337 -0.278 -5.809 1.00 . A A . 7 LEU O 1 1
6 1145 1 1 9 LEU C C 1.055 2.937 -4.937 1.00 . A A . 8 LEU C 1 1
6 1146 1 1 9 LEU CA C -0.291 2.318 -4.584 1.00 . A A . 8 LEU CA 1 1
6 1147 1 1 9 LEU CB C -1.079 3.287 -3.659 1.00 . A A . 8 LEU CB 1 1
6 1148 1 1 9 LEU CD1 C -2.834 3.703 -1.916 1.00 . A A . 8 LEU CD1 1 1
6 1149 1 1 9 LEU CD2 C -3.568 2.698 -4.070 1.00 . A A . 8 LEU CD2 1 1
6 1150 1 1 9 LEU CG C -2.422 2.784 -3.050 1.00 . A A . 8 LEU CG 1 1
6 1151 1 1 9 LEU H H -0.292 0.956 -2.966 1.00 . A A . 8 LEU H 1 1
6 1152 1 1 9 LEU HA H -0.858 2.180 -5.486 1.00 . A A . 8 LEU HA 1 1
6 1153 1 1 9 LEU HB2 H -0.429 3.543 -2.834 1.00 . A A . 8 LEU HB2 1 1
6 1154 1 1 9 LEU HB3 H -1.273 4.190 -4.214 1.00 . A A . 8 LEU HB3 1 1
6 1155 1 1 9 LEU HD11 H -2.549 4.719 -2.156 1.00 . A A . 8 LEU HD11 1 1
6 1156 1 1 9 LEU HD12 H -2.344 3.397 -1.007 1.00 . A A . 8 LEU HD12 1 1
6 1157 1 1 9 LEU HD13 H -3.902 3.656 -1.783 1.00 . A A . 8 LEU HD13 1 1
6 1158 1 1 9 LEU HD21 H -4.515 2.619 -3.547 1.00 . A A . 8 LEU HD21 1 1
6 1159 1 1 9 LEU HD22 H -3.425 1.825 -4.681 1.00 . A A . 8 LEU HD22 1 1
6 1160 1 1 9 LEU HD23 H -3.571 3.579 -4.688 1.00 . A A . 8 LEU HD23 1 1
6 1161 1 1 9 LEU HG H -2.269 1.790 -2.640 1.00 . A A . 8 LEU HG 1 1
6 1162 1 1 9 LEU N N -0.144 0.999 -3.929 1.00 . A A . 8 LEU N 1 1
6 1163 1 1 9 LEU O O 1.157 3.605 -5.981 1.00 . A A . 8 LEU O 1 1
6 1164 1 1 10 GLN C C 4.207 2.478 -5.252 1.00 . A A . 9 GLN C 1 1
6 1165 1 1 10 GLN CA C 3.441 3.235 -4.169 1.00 . A A . 9 GLN CA 1 1
6 1166 1 1 10 GLN CB C 4.195 3.154 -2.828 1.00 . A A . 9 GLN CB 1 1
6 1167 1 1 10 GLN CD C 4.301 3.872 -0.399 1.00 . A A . 9 GLN CD 1 1
6 1168 1 1 10 GLN CG C 3.562 3.986 -1.722 1.00 . A A . 9 GLN CG 1 1
6 1169 1 1 10 GLN H H 1.863 2.175 -3.241 1.00 . A A . 9 GLN H 1 1
6 1170 1 1 10 GLN HA H 3.357 4.273 -4.464 1.00 . A A . 9 GLN HA 1 1
6 1171 1 1 10 GLN HB2 H 4.220 2.125 -2.498 1.00 . A A . 9 GLN HB2 1 1
6 1172 1 1 10 GLN HB3 H 5.211 3.505 -2.969 1.00 . A A . 9 GLN HB3 1 1
6 1173 1 1 10 GLN HE21 H 4.551 5.840 -0.328 1.00 . A A . 9 GLN HE21 1 1
6 1174 1 1 10 GLN HE22 H 5.227 4.967 0.991 1.00 . A A . 9 GLN HE22 1 1
6 1175 1 1 10 GLN HG2 H 3.567 5.018 -2.021 1.00 . A A . 9 GLN HG2 1 1
6 1176 1 1 10 GLN HG3 H 2.541 3.663 -1.585 1.00 . A A . 9 GLN HG3 1 1
6 1177 1 1 10 GLN N N 2.069 2.708 -4.034 1.00 . A A . 9 GLN N 1 1
6 1178 1 1 10 GLN NE2 N 4.733 5.008 0.143 1.00 . A A . 9 GLN NE2 1 1
6 1179 1 1 10 GLN O O 4.969 3.100 -6.016 1.00 . A A . 9 GLN O 1 1
6 1180 1 1 10 GLN OE1 O 4.482 2.778 0.123 1.00 . A A . 9 GLN OE1 1 1
6 1181 1 1 11 ASP C C 4.059 0.468 -7.667 1.00 . A A . 10 ASP C 1 1
6 1182 1 1 11 ASP CA C 4.592 0.201 -6.257 1.00 . A A . 10 ASP CA 1 1
6 1183 1 1 11 ASP CB C 4.353 -1.266 -5.863 1.00 . A A . 10 ASP CB 1 1
6 1184 1 1 11 ASP CG C 5.173 -2.235 -6.711 1.00 . A A . 10 ASP CG 1 1
6 1185 1 1 11 ASP H H 3.334 0.750 -4.642 1.00 . A A . 10 ASP H 1 1
6 1186 1 1 11 ASP HA H 5.657 0.393 -6.243 1.00 . A A . 10 ASP HA 1 1
6 1187 1 1 11 ASP HB2 H 4.634 -1.404 -4.835 1.00 . A A . 10 ASP HB2 1 1
6 1188 1 1 11 ASP HB3 H 3.312 -1.502 -5.983 1.00 . A A . 10 ASP HB3 1 1
6 1189 1 1 11 ASP N N 3.962 1.120 -5.290 1.00 . A A . 10 ASP N 1 1
6 1190 1 1 11 ASP O O 4.852 0.580 -8.629 1.00 . A A . 10 ASP O 1 1
6 1191 1 1 11 ASP OD1 O 4.986 -2.243 -7.947 1.00 . A A . 10 ASP OD1 1 1
6 1192 1 1 11 ASP OD2 O 6.020 -2.964 -6.144 1.00 . A A . 10 ASP OD2 1 1
6 1193 1 1 12 SER C C 2.325 2.205 -9.579 1.00 . A A . 11 SER C 1 1
6 1194 1 1 12 SER CA C 1.947 0.846 -8.995 1.00 . A A . 11 SER CA 1 1
6 1195 1 1 12 SER CB C 0.437 0.787 -8.720 1.00 . A A . 11 SER CB 1 1
6 1196 1 1 12 SER H H 2.173 0.482 -6.931 1.00 . A A . 11 SER H 1 1
6 1197 1 1 12 SER HA H 2.202 0.066 -9.708 1.00 . A A . 11 SER HA 1 1
6 1198 1 1 12 SER HB2 H 0.177 1.460 -7.920 1.00 . A A . 11 SER HB2 1 1
6 1199 1 1 12 SER HB3 H -0.098 1.068 -9.613 1.00 . A A . 11 SER HB3 1 1
6 1200 1 1 12 SER HG H -0.902 -0.621 -8.513 1.00 . A A . 11 SER HG 1 1
6 1201 1 1 12 SER N N 2.692 0.581 -7.752 1.00 . A A . 11 SER N 1 1
6 1202 1 1 12 SER O O 2.268 2.400 -10.785 1.00 . A A . 11 SER O 1 1
6 1203 1 1 12 SER OG O 0.040 -0.517 -8.354 1.00 . A A . 11 SER OG 1 1
6 1204 1 1 13 NH2 HN1 H 2.596 2.960 -7.758 1.00 . A A . 12 NH2 HN1 1 1
6 1205 1 1 13 NH2 HN2 H 2.892 4.043 -9.059 1.00 . A A . 12 NH2 HN2 1 1
6 1206 1 1 13 NH2 N N 2.632 3.169 -8.711 1.00 . A A . 12 NH2 N 1 1
7 1207 1 1 1 ACE C C -3.097 -2.892 7.467 1.00 . A A . 0 ACE C 1 1
7 1208 1 1 1 ACE CH3 C -2.611 -3.621 8.694 1.00 . A A . 0 ACE CH3 1 1
7 1209 1 1 1 ACE H1 H -1.634 -3.252 8.975 1.00 . A A . 0 ACE H1 1 1
7 1210 1 1 1 ACE H2 H -2.558 -4.676 8.481 1.00 . A A . 0 ACE H2 1 1
7 1211 1 1 1 ACE H3 H -3.304 -3.453 9.508 1.00 . A A . 0 ACE H3 1 1
7 1212 1 1 1 ACE O O -3.791 -3.502 6.630 1.00 . A A . 0 ACE O 1 1
7 1213 1 1 2 HIS C C -1.911 -0.437 5.336 1.00 . A A . 1 HIS C 1 1
7 1214 1 1 2 HIS CA C -3.089 -0.674 6.279 1.00 . A A . 1 HIS CA 1 1
7 1215 1 1 2 HIS CB C -3.573 0.674 6.834 1.00 . A A . 1 HIS CB 1 1
7 1216 1 1 2 HIS CD2 C -4.261 2.468 5.108 1.00 . A A . 1 HIS CD2 1 1
7 1217 1 1 2 HIS CE1 C -6.380 1.958 4.919 1.00 . A A . 1 HIS CE1 1 1
7 1218 1 1 2 HIS CG C -4.492 1.418 5.923 1.00 . A A . 1 HIS CG 1 1
7 1219 1 1 2 HIS H H -2.170 -1.213 8.121 1.00 . A A . 1 HIS H 1 1
7 1220 1 1 2 HIS HA H -3.890 -1.129 5.719 1.00 . A A . 1 HIS HA 1 1
7 1221 1 1 2 HIS HB2 H -4.097 0.508 7.759 1.00 . A A . 1 HIS HB2 1 1
7 1222 1 1 2 HIS HB3 H -2.715 1.307 7.023 1.00 . A A . 1 HIS HB3 1 1
7 1223 1 1 2 HIS HD1 H -6.303 0.405 6.244 1.00 . A A . 1 HIS HD1 1 1
7 1224 1 1 2 HIS HD2 H -3.311 2.954 4.953 1.00 . A A . 1 HIS HD2 1 1
7 1225 1 1 2 HIS HE1 H -7.411 1.964 4.601 1.00 . A A . 1 HIS HE1 1 1
7 1226 1 1 2 HIS HE2 H -5.583 3.525 3.885 1.00 . A A . 1 HIS HE2 1 1
7 1227 1 1 2 HIS N N -2.718 -1.577 7.387 1.00 . A A . 1 HIS N 1 1
7 1228 1 1 2 HIS ND1 N -5.830 1.119 5.780 1.00 . A A . 1 HIS ND1 1 1
7 1229 1 1 2 HIS NE2 N -5.444 2.785 4.499 1.00 . A A . 1 HIS NE2 1 1
7 1230 1 1 2 HIS O O -2.130 -0.129 4.159 1.00 . A A . 1 HIS O 1 1
7 1231 1 1 3 . C C 0.597 -1.026 3.713 1.00 . A A . 2 MK8 C 1 1
7 1232 1 1 3 . CA C 0.651 -0.302 5.128 1.00 . A A . 2 MK8 CA 1 1
7 1233 1 1 3 . CB C 1.906 -0.724 6.010 1.00 . A A . 2 MK8 CB 1 1
7 1234 1 1 3 . CB1 C 0.789 1.237 5.008 1.00 . A A . 2 MK8 CB1 1 1
7 1235 1 1 3 . CD C 3.189 -2.565 4.763 1.00 . A A . 2 MK8 CD 1 1
7 1236 1 1 3 . CE C 3.407 -4.038 4.437 1.00 . A A . 2 MK8 CE 1 1
7 1237 1 1 3 . CG C 2.418 -2.193 6.043 1.00 . A A . 2 MK8 CG 1 1
7 1238 1 1 3 . HB H 1.681 -0.446 7.032 1.00 . A A . 2 MK8 HB 1 1
7 1239 1 1 3 . HB1 H 0.486 1.695 5.940 1.00 . A A . 2 MK8 HB1 1 1
7 1240 1 1 3 . HB1A H 0.165 1.597 4.207 1.00 . A A . 2 MK8 HB1A 1 1
7 1241 1 1 3 . HB1B H 1.819 1.488 4.808 1.00 . A A . 2 MK8 HB1B 1 1
7 1242 1 1 3 . HBA H 2.738 -0.126 5.690 1.00 . A A . 2 MK8 HBA 1 1
7 1243 1 1 3 . HD H 4.155 -2.091 4.812 1.00 . A A . 2 MK8 HD 1 1
7 1244 1 1 3 . HDA H 2.657 -2.139 3.933 1.00 . A A . 2 MK8 HDA 1 1
7 1245 1 1 3 . HE H 3.539 -4.700 5.280 1.00 . A A . 2 MK8 HE 1 1
7 1246 1 1 3 . HG H 1.584 -2.854 6.164 1.00 . A A . 2 MK8 HG 1 1
7 1247 1 1 3 . HGA H 3.083 -2.298 6.891 1.00 . A A . 2 MK8 HGA 1 1
7 1248 1 1 3 . HN H -0.559 -0.775 6.833 1.00 . A A . 2 MK8 HN 1 1
7 1249 1 1 3 . N N -0.627 -0.551 5.888 1.00 . A A . 2 MK8 N 1 1
7 1250 1 1 3 . O O 1.069 -0.512 2.675 1.00 . A A . 2 MK8 O 1 1
7 1251 1 1 4 ILE C C -0.799 -2.527 1.449 1.00 . A A . 3 ILE C 1 1
7 1252 1 1 4 ILE CA C -0.062 -3.230 2.601 1.00 . A A . 3 ILE CA 1 1
7 1253 1 1 4 ILE CB C -0.796 -4.605 2.919 1.00 . A A . 3 ILE CB 1 1
7 1254 1 1 4 ILE CD1 C -1.220 -4.568 5.460 1.00 . A A . 3 ILE CD1 1 1
7 1255 1 1 4 ILE CG1 C -0.471 -5.199 4.310 1.00 . A A . 3 ILE CG1 1 1
7 1256 1 1 4 ILE CG2 C -0.416 -5.668 1.881 1.00 . A A . 3 ILE CG2 1 1
7 1257 1 1 4 ILE H H -0.223 -2.641 4.638 1.00 . A A . 3 ILE H 1 1
7 1258 1 1 4 ILE HA H 0.941 -3.457 2.270 1.00 . A A . 3 ILE HA 1 1
7 1259 1 1 4 ILE HB H -1.861 -4.434 2.850 1.00 . A A . 3 ILE HB 1 1
7 1260 1 1 4 ILE HD11 H -0.708 -4.780 6.383 1.00 . A A . 3 ILE HD11 1 1
7 1261 1 1 4 ILE HD12 H -2.223 -4.966 5.504 1.00 . A A . 3 ILE HD12 1 1
7 1262 1 1 4 ILE HD13 H -1.262 -3.499 5.313 1.00 . A A . 3 ILE HD13 1 1
7 1263 1 1 4 ILE HG12 H -0.712 -6.249 4.303 1.00 . A A . 3 ILE HG12 1 1
7 1264 1 1 4 ILE HG13 H 0.578 -5.081 4.502 1.00 . A A . 3 ILE HG13 1 1
7 1265 1 1 4 ILE HG21 H -0.097 -6.567 2.387 1.00 . A A . 3 ILE HG21 1 1
7 1266 1 1 4 ILE HG22 H 0.388 -5.295 1.268 1.00 . A A . 3 ILE HG22 1 1
7 1267 1 1 4 ILE HG23 H -1.274 -5.890 1.258 1.00 . A A . 3 ILE HG23 1 1
7 1268 1 1 4 ILE N N 0.058 -2.306 3.766 1.00 . A A . 3 ILE N 1 1
7 1269 1 1 4 ILE O O -0.326 -2.539 0.302 1.00 . A A . 3 ILE O 1 1
7 1270 1 1 5 LEU C C -2.028 -0.075 0.134 1.00 . A A . 4 LEU C 1 1
7 1271 1 1 5 LEU CA C -2.838 -1.130 0.898 1.00 . A A . 4 LEU CA 1 1
7 1272 1 1 5 LEU CB C -3.925 -0.478 1.767 1.00 . A A . 4 LEU CB 1 1
7 1273 1 1 5 LEU CD1 C -6.265 0.309 1.989 1.00 . A A . 4 LEU CD1 1 1
7 1274 1 1 5 LEU CD2 C -4.647 1.701 0.715 1.00 . A A . 4 LEU CD2 1 1
7 1275 1 1 5 LEU CG C -5.069 0.275 1.069 1.00 . A A . 4 LEU CG 1 1
7 1276 1 1 5 LEU H H -2.219 -1.939 2.761 1.00 . A A . 4 LEU H 1 1
7 1277 1 1 5 LEU HA H -3.300 -1.811 0.200 1.00 . A A . 4 LEU HA 1 1
7 1278 1 1 5 LEU HB2 H -4.366 -1.259 2.368 1.00 . A A . 4 LEU HB2 1 1
7 1279 1 1 5 LEU HB3 H -3.431 0.213 2.433 1.00 . A A . 4 LEU HB3 1 1
7 1280 1 1 5 LEU HD11 H -5.951 0.663 2.963 1.00 . A A . 4 LEU HD11 1 1
7 1281 1 1 5 LEU HD12 H -6.679 -0.686 2.082 1.00 . A A . 4 LEU HD12 1 1
7 1282 1 1 5 LEU HD13 H -7.007 0.976 1.589 1.00 . A A . 4 LEU HD13 1 1
7 1283 1 1 5 LEU HD21 H -5.453 2.194 0.196 1.00 . A A . 4 LEU HD21 1 1
7 1284 1 1 5 LEU HD22 H -3.769 1.673 0.079 1.00 . A A . 4 LEU HD22 1 1
7 1285 1 1 5 LEU HD23 H -4.413 2.239 1.624 1.00 . A A . 4 LEU HD23 1 1
7 1286 1 1 5 LEU HG H -5.352 -0.238 0.163 1.00 . A A . 4 LEU HG 1 1
7 1287 1 1 5 LEU N N -1.959 -1.894 1.812 1.00 . A A . 4 LEU N 1 1
7 1288 1 1 5 LEU O O -2.305 0.208 -1.046 1.00 . A A . 4 LEU O 1 1
7 1289 1 1 6 HIS C C 1.014 0.945 -0.448 1.00 . A A . 5 HIS C 1 1
7 1290 1 1 6 HIS CA C -0.112 1.514 0.415 1.00 . A A . 5 HIS CA 1 1
7 1291 1 1 6 HIS CB C 0.460 2.245 1.615 1.00 . A A . 5 HIS CB 1 1
7 1292 1 1 6 HIS CD2 C -1.100 4.003 2.727 1.00 . A A . 5 HIS CD2 1 1
7 1293 1 1 6 HIS CE1 C -0.539 5.739 1.509 1.00 . A A . 5 HIS CE1 1 1
7 1294 1 1 6 HIS CG C -0.155 3.591 1.841 1.00 . A A . 5 HIS CG 1 1
7 1295 1 1 6 HIS H H -0.938 0.165 1.799 1.00 . A A . 5 HIS H 1 1
7 1296 1 1 6 HIS HA H -0.674 2.222 -0.171 1.00 . A A . 5 HIS HA 1 1
7 1297 1 1 6 HIS HB2 H 0.285 1.651 2.495 1.00 . A A . 5 HIS HB2 1 1
7 1298 1 1 6 HIS HB3 H 1.521 2.372 1.473 1.00 . A A . 5 HIS HB3 1 1
7 1299 1 1 6 HIS HD1 H 0.821 4.733 0.358 1.00 . A A . 5 HIS HD1 1 1
7 1300 1 1 6 HIS HD2 H -1.616 3.380 3.456 1.00 . A A . 5 HIS HD2 1 1
7 1301 1 1 6 HIS HE1 H -0.499 6.738 1.102 1.00 . A A . 5 HIS HE1 1 1
7 1302 1 1 6 HIS HE2 H -1.866 5.930 3.060 1.00 . A A . 5 HIS HE2 1 1
7 1303 1 1 6 HIS N N -1.034 0.480 0.879 1.00 . A A . 5 HIS N 1 1
7 1304 1 1 6 HIS ND1 N 0.171 4.706 1.091 1.00 . A A . 5 HIS ND1 1 1
7 1305 1 1 6 HIS NE2 N -1.316 5.342 2.502 1.00 . A A . 5 HIS NE2 1 1
7 1306 1 1 6 HIS O O 1.367 1.563 -1.464 1.00 . A A . 5 HIS O 1 1
7 1307 1 1 7 . C C 2.240 -1.237 -2.219 1.00 . A A . 6 MK8 C 1 1
7 1308 1 1 7 . CA C 2.702 -0.965 -0.744 1.00 . A A . 6 MK8 CA 1 1
7 1309 1 1 7 . CB C 2.993 -2.361 -0.118 1.00 . A A . 6 MK8 CB 1 1
7 1310 1 1 7 . CB1 C 4.013 -0.122 -0.712 1.00 . A A . 6 MK8 CB1 1 1
7 1311 1 1 7 . CD C 3.299 -3.987 1.749 1.00 . A A . 6 MK8 CD 1 1
7 1312 1 1 7 . CE C 3.451 -4.618 3.192 1.00 . A A . 6 MK8 CE 1 1
7 1313 1 1 7 . CG C 3.033 -2.509 1.425 1.00 . A A . 6 MK8 CG 1 1
7 1314 1 1 7 . HB H 3.957 -2.683 -0.497 1.00 . A A . 6 MK8 HB 1 1
7 1315 1 1 7 . HB1 H 4.276 0.101 0.314 1.00 . A A . 6 MK8 HB1 1 1
7 1316 1 1 7 . HB1A H 3.862 0.802 -1.256 1.00 . A A . 6 MK8 HB1A 1 1
7 1317 1 1 7 . HB1B H 4.807 -0.679 -1.176 1.00 . A A . 6 MK8 HB1B 1 1
7 1318 1 1 7 . HBA H 2.245 -3.051 -0.485 1.00 . A A . 6 MK8 HBA 1 1
7 1319 1 1 7 . HD H 4.195 -4.253 1.195 1.00 . A A . 6 MK8 HD 1 1
7 1320 1 1 7 . HDA H 2.493 -4.524 1.294 1.00 . A A . 6 MK8 HDA 1 1
7 1321 1 1 7 . HE H 3.618 -5.681 3.202 1.00 . A A . 6 MK8 HE 1 1
7 1322 1 1 7 . HG H 2.086 -2.219 1.847 1.00 . A A . 6 MK8 HG 1 1
7 1323 1 1 7 . HGA H 3.824 -1.896 1.825 1.00 . A A . 6 MK8 HGA 1 1
7 1324 1 1 7 . HN H 1.240 -0.659 0.785 1.00 . A A . 6 MK8 HN 1 1
7 1325 1 1 7 . N N 1.586 -0.254 -0.023 1.00 . A A . 6 MK8 N 1 1
7 1326 1 1 7 . O O 3.071 -1.514 -3.125 1.00 . A A . 6 MK8 O 1 1
7 1327 1 1 8 LEU C C 0.133 -0.190 -4.558 1.00 . A A . 7 LEU C 1 1
7 1328 1 1 8 LEU CA C 0.191 -1.451 -3.692 1.00 . A A . 7 LEU CA 1 1
7 1329 1 1 8 LEU CB C -1.241 -1.990 -3.455 1.00 . A A . 7 LEU CB 1 1
7 1330 1 1 8 LEU CD1 C -1.521 -4.084 -4.871 1.00 . A A . 7 LEU CD1 1 1
7 1331 1 1 8 LEU CD2 C -3.452 -2.535 -4.515 1.00 . A A . 7 LEU CD2 1 1
7 1332 1 1 8 LEU CG C -1.950 -2.623 -4.671 1.00 . A A . 7 LEU CG 1 1
7 1333 1 1 8 LEU H H 0.313 -1.008 -1.615 1.00 . A A . 7 LEU H 1 1
7 1334 1 1 8 LEU HA H 0.766 -2.200 -4.217 1.00 . A A . 7 LEU HA 1 1
7 1335 1 1 8 LEU HB2 H -1.210 -2.737 -2.669 1.00 . A A . 7 LEU HB2 1 1
7 1336 1 1 8 LEU HB3 H -1.843 -1.169 -3.109 1.00 . A A . 7 LEU HB3 1 1
7 1337 1 1 8 LEU HD11 H -0.887 -4.159 -5.744 1.00 . A A . 7 LEU HD11 1 1
7 1338 1 1 8 LEU HD12 H -2.394 -4.706 -5.008 1.00 . A A . 7 LEU HD12 1 1
7 1339 1 1 8 LEU HD13 H -0.980 -4.417 -4.001 1.00 . A A . 7 LEU HD13 1 1
7 1340 1 1 8 LEU HD21 H -3.777 -3.251 -3.782 1.00 . A A . 7 LEU HD21 1 1
7 1341 1 1 8 LEU HD22 H -3.917 -2.743 -5.468 1.00 . A A . 7 LEU HD22 1 1
7 1342 1 1 8 LEU HD23 H -3.727 -1.538 -4.199 1.00 . A A . 7 LEU HD23 1 1
7 1343 1 1 8 LEU HG H -1.683 -2.070 -5.561 1.00 . A A . 7 LEU HG 1 1
7 1344 1 1 8 LEU N N 0.867 -1.195 -2.404 1.00 . A A . 7 LEU N 1 1
7 1345 1 1 8 LEU O O 0.247 -0.292 -5.796 1.00 . A A . 7 LEU O 1 1
7 1346 1 1 9 LEU C C 1.075 2.902 -4.937 1.00 . A A . 8 LEU C 1 1
7 1347 1 1 9 LEU CA C -0.250 2.297 -4.508 1.00 . A A . 8 LEU CA 1 1
7 1348 1 1 9 LEU CB C -0.972 3.274 -3.548 1.00 . A A . 8 LEU CB 1 1
7 1349 1 1 9 LEU CD1 C -2.608 3.715 -1.723 1.00 . A A . 8 LEU CD1 1 1
7 1350 1 1 9 LEU CD2 C -3.487 2.742 -3.822 1.00 . A A . 8 LEU CD2 1 1
7 1351 1 1 9 LEU CG C -2.281 2.790 -2.875 1.00 . A A . 8 LEU CG 1 1
7 1352 1 1 9 LEU H H -0.211 0.912 -2.906 1.00 . A A . 8 LEU H 1 1
7 1353 1 1 9 LEU HA H -0.863 2.169 -5.386 1.00 . A A . 8 LEU HA 1 1
7 1354 1 1 9 LEU HB2 H -0.277 3.523 -2.756 1.00 . A A . 8 LEU HB2 1 1
7 1355 1 1 9 LEU HB3 H -1.192 4.181 -4.097 1.00 . A A . 8 LEU HB3 1 1
7 1356 1 1 9 LEU HD11 H -2.357 4.733 -1.997 1.00 . A A . 8 LEU HD11 1 1
7 1357 1 1 9 LEU HD12 H -2.037 3.423 -0.852 1.00 . A A . 8 LEU HD12 1 1
7 1358 1 1 9 LEU HD13 H -3.661 3.651 -1.507 1.00 . A A . 8 LEU HD13 1 1
7 1359 1 1 9 LEU HD21 H -3.753 3.741 -4.110 1.00 . A A . 8 LEU HD21 1 1
7 1360 1 1 9 LEU HD22 H -4.321 2.278 -3.313 1.00 . A A . 8 LEU HD22 1 1
7 1361 1 1 9 LEU HD23 H -3.234 2.167 -4.701 1.00 . A A . 8 LEU HD23 1 1
7 1362 1 1 9 LEU HG H -2.127 1.799 -2.473 1.00 . A A . 8 LEU HG 1 1
7 1363 1 1 9 LEU N N -0.098 0.972 -3.874 1.00 . A A . 8 LEU N 1 1
7 1364 1 1 9 LEU O O 1.139 3.485 -6.034 1.00 . A A . 8 LEU O 1 1
7 1365 1 1 10 GLN C C 4.225 2.485 -5.313 1.00 . A A . 9 GLN C 1 1
7 1366 1 1 10 GLN CA C 3.469 3.295 -4.263 1.00 . A A . 9 GLN CA 1 1
7 1367 1 1 10 GLN CB C 4.262 3.341 -2.948 1.00 . A A . 9 GLN CB 1 1
7 1368 1 1 10 GLN CD C 4.750 4.900 -1.008 1.00 . A A . 9 GLN CD 1 1
7 1369 1 1 10 GLN CG C 3.689 4.314 -1.928 1.00 . A A . 9 GLN CG 1 1
7 1370 1 1 10 GLN H H 1.939 2.273 -3.215 1.00 . A A . 9 GLN H 1 1
7 1371 1 1 10 GLN HA H 3.347 4.304 -4.622 1.00 . A A . 9 GLN HA 1 1
7 1372 1 1 10 GLN HB2 H 4.264 2.356 -2.511 1.00 . A A . 9 GLN HB2 1 1
7 1373 1 1 10 GLN HB3 H 5.281 3.632 -3.166 1.00 . A A . 9 GLN HB3 1 1
7 1374 1 1 10 GLN HE21 H 3.664 4.451 0.598 1.00 . A A . 9 GLN HE21 1 1
7 1375 1 1 10 GLN HE22 H 5.174 5.234 0.899 1.00 . A A . 9 GLN HE22 1 1
7 1376 1 1 10 GLN HG2 H 3.202 5.117 -2.454 1.00 . A A . 9 GLN HG2 1 1
7 1377 1 1 10 GLN HG3 H 2.957 3.792 -1.317 1.00 . A A . 9 GLN HG3 1 1
7 1378 1 1 10 GLN N N 2.114 2.755 -4.046 1.00 . A A . 9 GLN N 1 1
7 1379 1 1 10 GLN NE2 N 4.504 4.854 0.295 1.00 . A A . 9 GLN NE2 1 1
7 1380 1 1 10 GLN O O 5.022 3.064 -6.082 1.00 . A A . 9 GLN O 1 1
7 1381 1 1 10 GLN OE1 O 5.766 5.428 -1.461 1.00 . A A . 9 GLN OE1 1 1
7 1382 1 1 11 ASP C C 4.050 0.407 -7.682 1.00 . A A . 10 ASP C 1 1
7 1383 1 1 11 ASP CA C 4.559 0.170 -6.269 1.00 . A A . 10 ASP CA 1 1
7 1384 1 1 11 ASP CB C 4.248 -1.263 -5.841 1.00 . A A . 10 ASP CB 1 1
7 1385 1 1 11 ASP CG C 5.027 -2.300 -6.633 1.00 . A A . 10 ASP CG 1 1
7 1386 1 1 11 ASP H H 3.288 0.800 -4.681 1.00 . A A . 10 ASP H 1 1
7 1387 1 1 11 ASP HA H 5.625 0.324 -6.255 1.00 . A A . 10 ASP HA 1 1
7 1388 1 1 11 ASP HB2 H 4.479 -1.388 -4.793 1.00 . A A . 10 ASP HB2 1 1
7 1389 1 1 11 ASP HB3 H 3.197 -1.443 -5.991 1.00 . A A . 10 ASP HB3 1 1
7 1390 1 1 11 ASP N N 3.943 1.136 -5.330 1.00 . A A . 10 ASP N 1 1
7 1391 1 1 11 ASP O O 4.846 0.412 -8.646 1.00 . A A . 10 ASP O 1 1
7 1392 1 1 11 ASP OD1 O 4.899 -2.319 -7.874 1.00 . A A . 10 ASP OD1 1 1
7 1393 1 1 11 ASP OD2 O 5.761 -3.093 -6.007 1.00 . A A . 10 ASP OD2 1 1
7 1394 1 1 12 SER C C 2.468 2.136 -9.730 1.00 . A A . 11 SER C 1 1
7 1395 1 1 12 SER CA C 1.966 0.859 -9.034 1.00 . A A . 11 SER CA 1 1
7 1396 1 1 12 SER CB C 0.466 0.965 -8.773 1.00 . A A . 11 SER CB 1 1
7 1397 1 1 12 SER H H 2.184 0.573 -6.929 1.00 . A A . 11 SER H 1 1
7 1398 1 1 12 SER HA H 2.147 0.019 -9.690 1.00 . A A . 11 SER HA 1 1
7 1399 1 1 12 SER HB2 H 0.280 1.690 -7.994 1.00 . A A . 11 SER HB2 1 1
7 1400 1 1 12 SER HB3 H -0.021 1.281 -9.677 1.00 . A A . 11 SER HB3 1 1
7 1401 1 1 12 SER HG H -0.411 -0.738 -9.144 1.00 . A A . 11 SER HG 1 1
7 1402 1 1 12 SER N N 2.695 0.604 -7.766 1.00 . A A . 11 SER N 1 1
7 1403 1 1 12 SER O O 2.341 2.287 -10.948 1.00 . A A . 11 SER O 1 1
7 1404 1 1 12 SER OG O -0.076 -0.273 -8.370 1.00 . A A . 11 SER OG 1 1
7 1405 1 1 13 NH2 HN1 H 2.815 2.999 -7.974 1.00 . A A . 12 NH2 HN1 1 1
7 1406 1 1 13 NH2 HN2 H 3.190 3.953 -9.359 1.00 . A A . 12 NH2 HN2 1 1
7 1407 1 1 13 NH2 N N 2.862 3.130 -8.937 1.00 . A A . 12 NH2 N 1 1
8 1408 1 1 1 ACE C C -3.373 -2.603 6.700 1.00 . A A . 0 ACE C 1 1
8 1409 1 1 1 ACE CH3 C -3.241 -3.474 7.931 1.00 . A A . 0 ACE CH3 1 1
8 1410 1 1 1 ACE H1 H -2.208 -3.753 8.060 1.00 . A A . 0 ACE H1 1 1
8 1411 1 1 1 ACE H2 H -3.851 -4.364 7.821 1.00 . A A . 0 ACE H2 1 1
8 1412 1 1 1 ACE H3 H -3.577 -2.921 8.792 1.00 . A A . 0 ACE H3 1 1
8 1413 1 1 1 ACE O O -3.682 -3.129 5.615 1.00 . A A . 0 ACE O 1 1
8 1414 1 1 2 HIS C C -1.862 -0.130 5.099 1.00 . A A . 1 HIS C 1 1
8 1415 1 1 2 HIS CA C -3.199 -0.242 5.824 1.00 . A A . 1 HIS CA 1 1
8 1416 1 1 2 HIS CB C -3.572 1.121 6.408 1.00 . A A . 1 HIS CB 1 1
8 1417 1 1 2 HIS CD2 C -3.795 3.131 4.784 1.00 . A A . 1 HIS CD2 1 1
8 1418 1 1 2 HIS CE1 C -5.881 2.832 4.176 1.00 . A A . 1 HIS CE1 1 1
8 1419 1 1 2 HIS CG C -4.252 2.038 5.441 1.00 . A A . 1 HIS CG 1 1
8 1420 1 1 2 HIS H H -2.882 -0.961 7.792 1.00 . A A . 1 HIS H 1 1
8 1421 1 1 2 HIS HA H -3.961 -0.561 5.117 1.00 . A A . 1 HIS HA 1 1
8 1422 1 1 2 HIS HB2 H -4.231 0.981 7.246 1.00 . A A . 1 HIS HB2 1 1
8 1423 1 1 2 HIS HB3 H -2.669 1.611 6.745 1.00 . A A . 1 HIS HB3 1 1
8 1424 1 1 2 HIS HD1 H -6.184 1.185 5.359 1.00 . A A . 1 HIS HD1 1 1
8 1425 1 1 2 HIS HD2 H -2.797 3.548 4.859 1.00 . A A . 1 HIS HD2 1 1
8 1426 1 1 2 HIS HE1 H -6.848 2.960 3.702 1.00 . A A . 1 HIS HE1 1 1
8 1427 1 1 2 HIS HE2 H -4.780 4.390 3.424 1.00 . A A . 1 HIS HE2 1 1
8 1428 1 1 2 HIS N N -3.124 -1.259 6.893 1.00 . A A . 1 HIS N 1 1
8 1429 1 1 2 HIS ND1 N -5.565 1.878 5.040 1.00 . A A . 1 HIS ND1 1 1
8 1430 1 1 2 HIS NE2 N -4.822 3.606 4.008 1.00 . A A . 1 HIS NE2 1 1
8 1431 1 1 2 HIS O O -1.814 0.346 3.959 1.00 . A A . 1 HIS O 1 1
8 1432 1 1 3 . C C 0.676 -1.246 3.831 1.00 . A A . 2 MK8 C 1 1
8 1433 1 1 3 . CA C 0.645 -0.599 5.289 1.00 . A A . 2 MK8 CA 1 1
8 1434 1 1 3 . CB C 1.466 -1.451 6.337 1.00 . A A . 2 MK8 CB 1 1
8 1435 1 1 3 . CB1 C 1.189 0.851 5.355 1.00 . A A . 2 MK8 CB1 1 1
8 1436 1 1 3 . CD C 2.831 -3.221 5.148 1.00 . A A . 2 MK8 CD 1 1
8 1437 1 1 3 . CE C 4.137 -3.823 4.576 1.00 . A A . 2 MK8 CE 1 1
8 1438 1 1 3 . CG C 2.898 -1.961 5.992 1.00 . A A . 2 MK8 CG 1 1
8 1439 1 1 3 . HB H 0.866 -2.320 6.596 1.00 . A A . 2 MK8 HB 1 1
8 1440 1 1 3 . HB1 H 2.232 0.829 5.629 1.00 . A A . 2 MK8 HB1 1 1
8 1441 1 1 3 . HB1A H 0.635 1.413 6.097 1.00 . A A . 2 MK8 HB1A 1 1
8 1442 1 1 3 . HB1B H 1.082 1.319 4.391 1.00 . A A . 2 MK8 HB1B 1 1
8 1443 1 1 3 . HBA H 1.561 -0.847 7.221 1.00 . A A . 2 MK8 HBA 1 1
8 1444 1 1 3 . HD H 2.171 -3.012 4.318 1.00 . A A . 2 MK8 HD 1 1
8 1445 1 1 3 . HDA H 2.376 -3.990 5.751 1.00 . A A . 2 MK8 HDA 1 1
8 1446 1 1 3 . HE H 4.875 -4.098 5.301 1.00 . A A . 2 MK8 HE 1 1
8 1447 1 1 3 . HG H 3.414 -2.180 6.906 1.00 . A A . 2 MK8 HG 1 1
8 1448 1 1 3 . HGA H 3.427 -1.199 5.443 1.00 . A A . 2 MK8 HGA 1 1
8 1449 1 1 3 . HN H -0.904 -0.958 6.690 1.00 . A A . 2 MK8 HN 1 1
8 1450 1 1 3 . N N -0.760 -0.596 5.795 1.00 . A A . 2 MK8 N 1 1
8 1451 1 1 3 . O O 1.113 -0.632 2.827 1.00 . A A . 2 MK8 O 1 1
8 1452 1 1 4 ILE C C -0.583 -2.739 1.461 1.00 . A A . 3 ILE C 1 1
8 1453 1 1 4 ILE CA C 0.189 -3.409 2.591 1.00 . A A . 3 ILE CA 1 1
8 1454 1 1 4 ILE CB C -0.391 -4.878 2.794 1.00 . A A . 3 ILE CB 1 1
8 1455 1 1 4 ILE CD1 C 0.001 -5.096 5.466 1.00 . A A . 3 ILE CD1 1 1
8 1456 1 1 4 ILE CG1 C -0.926 -5.267 4.238 1.00 . A A . 3 ILE CG1 1 1
8 1457 1 1 4 ILE CG2 C 0.615 -5.918 2.276 1.00 . A A . 3 ILE CG2 1 1
8 1458 1 1 4 ILE H H -0.073 -2.932 4.645 1.00 . A A . 3 ILE H 1 1
8 1459 1 1 4 ILE HA H 1.217 -3.515 2.276 1.00 . A A . 3 ILE HA 1 1
8 1460 1 1 4 ILE HB H -1.237 -4.947 2.117 1.00 . A A . 3 ILE HB 1 1
8 1461 1 1 4 ILE HD11 H 0.944 -4.680 5.150 1.00 . A A . 3 ILE HD11 1 1
8 1462 1 1 4 ILE HD12 H 0.167 -6.054 5.933 1.00 . A A . 3 ILE HD12 1 1
8 1463 1 1 4 ILE HD13 H -0.463 -4.426 6.183 1.00 . A A . 3 ILE HD13 1 1
8 1464 1 1 4 ILE HG12 H -1.813 -4.695 4.434 1.00 . A A . 3 ILE HG12 1 1
8 1465 1 1 4 ILE HG13 H -1.202 -6.300 4.201 1.00 . A A . 3 ILE HG13 1 1
8 1466 1 1 4 ILE HG21 H 1.342 -6.125 3.040 1.00 . A A . 3 ILE HG21 1 1
8 1467 1 1 4 ILE HG22 H 1.118 -5.527 1.396 1.00 . A A . 3 ILE HG22 1 1
8 1468 1 1 4 ILE HG23 H 0.097 -6.831 2.014 1.00 . A A . 3 ILE HG23 1 1
8 1469 1 1 4 ILE N N 0.221 -2.545 3.804 1.00 . A A . 3 ILE N 1 1
8 1470 1 1 4 ILE O O -0.200 -2.877 0.289 1.00 . A A . 3 ILE O 1 1
8 1471 1 1 5 LEU C C -1.707 -0.178 0.219 1.00 . A A . 4 LEU C 1 1
8 1472 1 1 5 LEU CA C -2.535 -1.224 0.961 1.00 . A A . 4 LEU CA 1 1
8 1473 1 1 5 LEU CB C -3.652 -0.571 1.790 1.00 . A A . 4 LEU CB 1 1
8 1474 1 1 5 LEU CD1 C -6.030 0.158 1.912 1.00 . A A . 4 LEU CD1 1 1
8 1475 1 1 5 LEU CD2 C -4.420 1.523 0.599 1.00 . A A . 4 LEU CD2 1 1
8 1476 1 1 5 LEU CG C -4.798 0.110 1.030 1.00 . A A . 4 LEU CG 1 1
8 1477 1 1 5 LEU H H -1.837 -1.931 2.829 1.00 . A A . 4 LEU H 1 1
8 1478 1 1 5 LEU HA H -2.972 -1.916 0.249 1.00 . A A . 4 LEU HA 1 1
8 1479 1 1 5 LEU HB2 H -4.088 -1.341 2.405 1.00 . A A . 4 LEU HB2 1 1
8 1480 1 1 5 LEU HB3 H -3.196 0.160 2.439 1.00 . A A . 4 LEU HB3 1 1
8 1481 1 1 5 LEU HD11 H -6.564 -0.774 1.829 1.00 . A A . 4 LEU HD11 1 1
8 1482 1 1 5 LEU HD12 H -6.664 0.971 1.593 1.00 . A A . 4 LEU HD12 1 1
8 1483 1 1 5 LEU HD13 H -5.734 0.315 2.945 1.00 . A A . 4 LEU HD13 1 1
8 1484 1 1 5 LEU HD21 H -5.063 2.234 1.098 1.00 . A A . 4 LEU HD21 1 1
8 1485 1 1 5 LEU HD22 H -4.539 1.617 -0.469 1.00 . A A . 4 LEU HD22 1 1
8 1486 1 1 5 LEU HD23 H -3.387 1.718 0.866 1.00 . A A . 4 LEU HD23 1 1
8 1487 1 1 5 LEU HG H -5.035 -0.468 0.147 1.00 . A A . 4 LEU HG 1 1
8 1488 1 1 5 LEU N N -1.658 -1.984 1.867 1.00 . A A . 4 LEU N 1 1
8 1489 1 1 5 LEU O O -1.840 -0.035 -1.006 1.00 . A A . 4 LEU O 1 1
8 1490 1 1 6 HIS C C 1.142 1.004 -0.364 1.00 . A A . 5 HIS C 1 1
8 1491 1 1 6 HIS CA C 0.067 1.573 0.553 1.00 . A A . 5 HIS CA 1 1
8 1492 1 1 6 HIS CB C 0.689 2.236 1.762 1.00 . A A . 5 HIS CB 1 1
8 1493 1 1 6 HIS CD2 C -0.695 4.036 3.013 1.00 . A A . 5 HIS CD2 1 1
8 1494 1 1 6 HIS CE1 C -0.213 5.747 1.716 1.00 . A A . 5 HIS CE1 1 1
8 1495 1 1 6 HIS CG C 0.134 3.592 2.036 1.00 . A A . 5 HIS CG 1 1
8 1496 1 1 6 HIS H H -0.834 0.310 1.979 1.00 . A A . 5 HIS H 1 1
8 1497 1 1 6 HIS HA H -0.513 2.305 0.007 1.00 . A A . 5 HIS HA 1 1
8 1498 1 1 6 HIS HB2 H 0.490 1.620 2.618 1.00 . A A . 5 HIS HB2 1 1
8 1499 1 1 6 HIS HB3 H 1.758 2.328 1.620 1.00 . A A . 5 HIS HB3 1 1
8 1500 1 1 6 HIS HD1 H 0.997 4.682 0.449 1.00 . A A . 5 HIS HD1 1 1
8 1501 1 1 6 HIS HD2 H -1.125 3.436 3.807 1.00 . A A . 5 HIS HD2 1 1
8 1502 1 1 6 HIS HE1 H -0.154 6.743 1.303 1.00 . A A . 5 HIS HE1 1 1
8 1503 1 1 6 HIS HE2 H -1.501 5.973 3.305 1.00 . A A . 5 HIS HE2 1 1
8 1504 1 1 6 HIS N N -0.847 0.523 1.023 1.00 . A A . 5 HIS N 1 1
8 1505 1 1 6 HIS ND1 N 0.415 4.685 1.240 1.00 . A A . 5 HIS ND1 1 1
8 1506 1 1 6 HIS NE2 N -0.899 5.385 2.792 1.00 . A A . 5 HIS NE2 1 1
8 1507 1 1 6 HIS O O 1.356 1.544 -1.457 1.00 . A A . 5 HIS O 1 1
8 1508 1 1 7 . C C 2.362 -1.174 -2.107 1.00 . A A . 6 MK8 C 1 1
8 1509 1 1 7 . CA C 2.897 -0.836 -0.669 1.00 . A A . 6 MK8 CA 1 1
8 1510 1 1 7 . CB C 3.245 -2.212 -0.012 1.00 . A A . 6 MK8 CB 1 1
8 1511 1 1 7 . CB1 C 4.173 0.038 -0.730 1.00 . A A . 6 MK8 CB1 1 1
8 1512 1 1 7 . CD C 3.604 -3.752 1.970 1.00 . A A . 6 MK8 CD 1 1
8 1513 1 1 7 . CE C 4.460 -4.045 3.240 1.00 . A A . 6 MK8 CE 1 1
8 1514 1 1 7 . CG C 3.368 -2.298 1.529 1.00 . A A . 6 MK8 CG 1 1
8 1515 1 1 7 . HB H 4.179 -2.556 -0.439 1.00 . A A . 6 MK8 HB 1 1
8 1516 1 1 7 . HB1 H 4.173 0.744 0.088 1.00 . A A . 6 MK8 HB1 1 1
8 1517 1 1 7 . HB1A H 4.189 0.584 -1.667 1.00 . A A . 6 MK8 HB1A 1 1
8 1518 1 1 7 . HB1B H 5.044 -0.596 -0.663 1.00 . A A . 6 MK8 HB1B 1 1
8 1519 1 1 7 . HBA H 2.474 -2.906 -0.298 1.00 . A A . 6 MK8 HBA 1 1
8 1520 1 1 7 . HD H 4.071 -4.268 1.141 1.00 . A A . 6 MK8 HD 1 1
8 1521 1 1 7 . HDA H 2.645 -4.202 2.133 1.00 . A A . 6 MK8 HDA 1 1
8 1522 1 1 7 . HE H 5.422 -4.480 3.054 1.00 . A A . 6 MK8 HE 1 1
8 1523 1 1 7 . HG H 2.453 -1.940 1.974 1.00 . A A . 6 MK8 HG 1 1
8 1524 1 1 7 . HGA H 4.194 -1.695 1.856 1.00 . A A . 6 MK8 HGA 1 1
8 1525 1 1 7 . HN H 1.565 -0.473 0.971 1.00 . A A . 6 MK8 HN 1 1
8 1526 1 1 7 . N N 1.815 -0.123 0.095 1.00 . A A . 6 MK8 N 1 1
8 1527 1 1 7 . O O 3.154 -1.457 -3.047 1.00 . A A . 6 MK8 O 1 1
8 1528 1 1 8 LEU C C 0.117 -0.274 -4.374 1.00 . A A . 7 LEU C 1 1
8 1529 1 1 8 LEU CA C 0.247 -1.496 -3.464 1.00 . A A . 7 LEU CA 1 1
8 1530 1 1 8 LEU CB C -1.184 -2.030 -3.115 1.00 . A A . 7 LEU CB 1 1
8 1531 1 1 8 LEU CD1 C -1.991 -2.976 -5.441 1.00 . A A . 7 LEU CD1 1 1
8 1532 1 1 8 LEU CD2 C -1.131 -4.545 -3.657 1.00 . A A . 7 LEU CD2 1 1
8 1533 1 1 8 LEU CG C -1.835 -3.216 -3.925 1.00 . A A . 7 LEU CG 1 1
8 1534 1 1 8 LEU H H 0.462 -0.966 -1.412 1.00 . A A . 7 LEU H 1 1
8 1535 1 1 8 LEU HA H 0.793 -2.263 -3.993 1.00 . A A . 7 LEU HA 1 1
8 1536 1 1 8 LEU HB2 H -1.165 -2.340 -2.085 1.00 . A A . 7 LEU HB2 1 1
8 1537 1 1 8 LEU HB3 H -1.854 -1.185 -3.183 1.00 . A A . 7 LEU HB3 1 1
8 1538 1 1 8 LEU HD11 H -2.109 -1.918 -5.625 1.00 . A A . 7 LEU HD11 1 1
8 1539 1 1 8 LEU HD12 H -2.859 -3.503 -5.801 1.00 . A A . 7 LEU HD12 1 1
8 1540 1 1 8 LEU HD13 H -1.110 -3.335 -5.959 1.00 . A A . 7 LEU HD13 1 1
8 1541 1 1 8 LEU HD21 H -1.682 -5.348 -4.129 1.00 . A A . 7 LEU HD21 1 1
8 1542 1 1 8 LEU HD22 H -1.096 -4.713 -2.592 1.00 . A A . 7 LEU HD22 1 1
8 1543 1 1 8 LEU HD23 H -0.126 -4.512 -4.046 1.00 . A A . 7 LEU HD23 1 1
8 1544 1 1 8 LEU HG H -2.836 -3.327 -3.545 1.00 . A A . 7 LEU HG 1 1
8 1545 1 1 8 LEU N N 0.985 -1.174 -2.221 1.00 . A A . 7 LEU N 1 1
8 1546 1 1 8 LEU O O 0.252 -0.410 -5.599 1.00 . A A . 7 LEU O 1 1
8 1547 1 1 9 LEU C C 0.958 2.842 -4.884 1.00 . A A . 8 LEU C 1 1
8 1548 1 1 9 LEU CA C -0.365 2.216 -4.439 1.00 . A A . 8 LEU CA 1 1
8 1549 1 1 9 LEU CB C -1.121 3.219 -3.527 1.00 . A A . 8 LEU CB 1 1
8 1550 1 1 9 LEU CD1 C -2.736 3.609 -1.663 1.00 . A A . 8 LEU CD1 1 1
8 1551 1 1 9 LEU CD2 C -3.610 2.651 -3.758 1.00 . A A . 8 LEU CD2 1 1
8 1552 1 1 9 LEU CG C -2.405 2.708 -2.825 1.00 . A A . 8 LEU CG 1 1
8 1553 1 1 9 LEU H H -0.272 0.894 -2.769 1.00 . A A . 8 LEU H 1 1
8 1554 1 1 9 LEU HA H -0.970 2.033 -5.314 1.00 . A A . 8 LEU HA 1 1
8 1555 1 1 9 LEU HB2 H -0.438 3.554 -2.762 1.00 . A A . 8 LEU HB2 1 1
8 1556 1 1 9 LEU HB3 H -1.393 4.080 -4.123 1.00 . A A . 8 LEU HB3 1 1
8 1557 1 1 9 LEU HD11 H -3.780 3.505 -1.417 1.00 . A A . 8 LEU HD11 1 1
8 1558 1 1 9 LEU HD12 H -2.529 4.633 -1.942 1.00 . A A . 8 LEU HD12 1 1
8 1559 1 1 9 LEU HD13 H -2.132 3.335 -0.809 1.00 . A A . 8 LEU HD13 1 1
8 1560 1 1 9 LEU HD21 H -3.761 1.636 -4.079 1.00 . A A . 8 LEU HD21 1 1
8 1561 1 1 9 LEU HD22 H -3.415 3.275 -4.614 1.00 . A A . 8 LEU HD22 1 1
8 1562 1 1 9 LEU HD23 H -4.492 3.007 -3.240 1.00 . A A . 8 LEU HD23 1 1
8 1563 1 1 9 LEU HG H -2.230 1.712 -2.439 1.00 . A A . 8 LEU HG 1 1
8 1564 1 1 9 LEU N N -0.169 0.912 -3.740 1.00 . A A . 8 LEU N 1 1
8 1565 1 1 9 LEU O O 1.008 3.464 -5.963 1.00 . A A . 8 LEU O 1 1
8 1566 1 1 10 GLN C C 4.101 2.402 -5.302 1.00 . A A . 9 GLN C 1 1
8 1567 1 1 10 GLN CA C 3.369 3.205 -4.230 1.00 . A A . 9 GLN CA 1 1
8 1568 1 1 10 GLN CB C 4.163 3.161 -2.913 1.00 . A A . 9 GLN CB 1 1
8 1569 1 1 10 GLN CD C 3.659 5.470 -1.964 1.00 . A A . 9 GLN CD 1 1
8 1570 1 1 10 GLN CG C 3.543 3.968 -1.774 1.00 . A A . 9 GLN CG 1 1
8 1571 1 1 10 GLN H H 1.839 2.176 -3.195 1.00 . A A . 9 GLN H 1 1
8 1572 1 1 10 GLN HA H 3.276 4.230 -4.558 1.00 . A A . 9 GLN HA 1 1
8 1573 1 1 10 GLN HB2 H 4.237 2.134 -2.599 1.00 . A A . 9 GLN HB2 1 1
8 1574 1 1 10 GLN HB3 H 5.159 3.544 -3.097 1.00 . A A . 9 GLN HB3 1 1
8 1575 1 1 10 GLN HE21 H 4.685 5.622 -0.271 1.00 . A A . 9 GLN HE21 1 1
8 1576 1 1 10 GLN HE22 H 4.418 7.101 -1.124 1.00 . A A . 9 GLN HE22 1 1
8 1577 1 1 10 GLN HG2 H 2.492 3.713 -1.710 1.00 . A A . 9 GLN HG2 1 1
8 1578 1 1 10 GLN HG3 H 4.031 3.699 -0.843 1.00 . A A . 9 GLN HG3 1 1
8 1579 1 1 10 GLN N N 2.007 2.670 -4.015 1.00 . A A . 9 GLN N 1 1
8 1580 1 1 10 GLN NE2 N 4.317 6.132 -1.026 1.00 . A A . 9 GLN NE2 1 1
8 1581 1 1 10 GLN O O 4.903 2.979 -6.060 1.00 . A A . 9 GLN O 1 1
8 1582 1 1 10 GLN OE1 O 3.157 6.023 -2.941 1.00 . A A . 9 GLN OE1 1 1
8 1583 1 1 11 ASP C C 3.855 0.391 -7.711 1.00 . A A . 10 ASP C 1 1
8 1584 1 1 11 ASP CA C 4.378 0.099 -6.308 1.00 . A A . 10 ASP CA 1 1
8 1585 1 1 11 ASP CB C 4.039 -1.345 -5.922 1.00 . A A . 10 ASP CB 1 1
8 1586 1 1 11 ASP CG C 4.857 -2.361 -6.692 1.00 . A A . 10 ASP CG 1 1
8 1587 1 1 11 ASP H H 3.146 0.718 -4.686 1.00 . A A . 10 ASP H 1 1
8 1588 1 1 11 ASP HA H 5.452 0.230 -6.296 1.00 . A A . 10 ASP HA 1 1
8 1589 1 1 11 ASP HB2 H 4.232 -1.475 -4.877 1.00 . A A . 10 ASP HB2 1 1
8 1590 1 1 11 ASP HB3 H 2.991 -1.532 -6.118 1.00 . A A . 10 ASP HB3 1 1
8 1591 1 1 11 ASP N N 3.790 1.056 -5.337 1.00 . A A . 10 ASP N 1 1
8 1592 1 1 11 ASP O O 4.632 0.390 -8.691 1.00 . A A . 10 ASP O 1 1
8 1593 1 1 11 ASP OD1 O 4.732 -2.408 -7.929 1.00 . A A . 10 ASP OD1 1 1
8 1594 1 1 11 ASP OD2 O 5.630 -3.104 -6.051 1.00 . A A . 10 ASP OD2 1 1
8 1595 1 1 12 SER C C 2.253 2.248 -9.634 1.00 . A A . 11 SER C 1 1
8 1596 1 1 12 SER CA C 1.766 0.936 -9.002 1.00 . A A . 11 SER CA 1 1
8 1597 1 1 12 SER CB C 0.266 1.019 -8.729 1.00 . A A . 11 SER CB 1 1
8 1598 1 1 12 SER H H 1.992 0.602 -6.926 1.00 . A A . 11 SER H 1 1
8 1599 1 1 12 SER HA H 1.951 0.125 -9.688 1.00 . A A . 11 SER HA 1 1
8 1600 1 1 12 SER HB2 H 0.090 1.774 -7.977 1.00 . A A . 11 SER HB2 1 1
8 1601 1 1 12 SER HB3 H -0.240 1.303 -9.633 1.00 . A A . 11 SER HB3 1 1
8 1602 1 1 12 SER HG H -0.082 -0.903 -8.929 1.00 . A A . 11 SER HG 1 1
8 1603 1 1 12 SER N N 2.500 0.635 -7.763 1.00 . A A . 11 SER N 1 1
8 1604 1 1 12 SER O O 2.044 2.496 -10.823 1.00 . A A . 11 SER O 1 1
8 1605 1 1 12 SER OG O -0.264 -0.223 -8.276 1.00 . A A . 11 SER OG 1 1
8 1606 1 1 13 NH2 HN1 H 2.774 2.944 -7.836 1.00 . A A . 12 NH2 HN1 1 1
8 1607 1 1 13 NH2 HN2 H 3.081 4.002 -9.190 1.00 . A A . 12 NH2 HN2 1 1
8 1608 1 1 13 NH2 N N 2.749 3.155 -8.805 1.00 . A A . 12 NH2 N 1 1
9 1609 1 1 1 ACE C C -3.230 -2.552 6.751 1.00 . A A . 0 ACE C 1 1
9 1610 1 1 1 ACE CH3 C -3.103 -3.422 7.986 1.00 . A A . 0 ACE CH3 1 1
9 1611 1 1 1 ACE H1 H -3.205 -2.814 8.874 1.00 . A A . 0 ACE H1 1 1
9 1612 1 1 1 ACE H2 H -2.138 -3.900 7.986 1.00 . A A . 0 ACE H2 1 1
9 1613 1 1 1 ACE H3 H -3.880 -4.174 7.972 1.00 . A A . 0 ACE H3 1 1
9 1614 1 1 1 ACE O O -3.455 -3.101 5.649 1.00 . A A . 0 ACE O 1 1
9 1615 1 1 2 HIS C C -1.833 -0.115 5.104 1.00 . A A . 1 HIS C 1 1
9 1616 1 1 2 HIS CA C -3.158 -0.186 5.870 1.00 . A A . 1 HIS CA 1 1
9 1617 1 1 2 HIS CB C -3.505 1.189 6.438 1.00 . A A . 1 HIS CB 1 1
9 1618 1 1 2 HIS CD2 C -3.677 3.167 4.798 1.00 . A A . 1 HIS CD2 1 1
9 1619 1 1 2 HIS CE1 C -5.755 2.884 4.161 1.00 . A A . 1 HIS CE1 1 1
9 1620 1 1 2 HIS CG C -4.163 2.095 5.452 1.00 . A A . 1 HIS CG 1 1
9 1621 1 1 2 HIS H H -2.890 -0.879 7.856 1.00 . A A . 1 HIS H 1 1
9 1622 1 1 2 HIS HA H -3.940 -0.503 5.196 1.00 . A A . 1 HIS HA 1 1
9 1623 1 1 2 HIS HB2 H -4.173 1.070 7.277 1.00 . A A . 1 HIS HB2 1 1
9 1624 1 1 2 HIS HB3 H -2.593 1.665 6.768 1.00 . A A . 1 HIS HB3 1 1
9 1625 1 1 2 HIS HD1 H -6.081 1.232 5.311 1.00 . A A . 1 HIS HD1 1 1
9 1626 1 1 2 HIS HD2 H -2.671 3.551 4.871 1.00 . A A . 1 HIS HD2 1 1
9 1627 1 1 2 HIS HE1 H -6.703 3.017 3.663 1.00 . A A . 1 HIS HE1 1 1
9 1628 1 1 2 HIS HE2 H -4.674 4.509 3.535 1.00 . A A . 1 HIS HE2 1 1
9 1629 1 1 2 HIS N N -3.073 -1.193 6.948 1.00 . A A . 1 HIS N 1 1
9 1630 1 1 2 HIS ND1 N -5.467 1.941 5.032 1.00 . A A . 1 HIS ND1 1 1
9 1631 1 1 2 HIS NE2 N -4.685 3.648 4.001 1.00 . A A . 1 HIS NE2 1 1
9 1632 1 1 2 HIS O O -1.786 0.342 3.960 1.00 . A A . 1 HIS O 1 1
9 1633 1 1 3 . C C 0.658 -1.305 3.815 1.00 . A A . 2 MK8 C 1 1
9 1634 1 1 3 . CA C 0.663 -0.647 5.265 1.00 . A A . 2 MK8 CA 1 1
9 1635 1 1 3 . CB C 1.472 -1.508 6.315 1.00 . A A . 2 MK8 CB 1 1
9 1636 1 1 3 . CB1 C 1.250 0.786 5.306 1.00 . A A . 2 MK8 CB1 1 1
9 1637 1 1 3 . CD C 2.776 -3.336 5.104 1.00 . A A . 2 MK8 CD 1 1
9 1638 1 1 3 . CE C 4.040 -3.960 4.476 1.00 . A A . 2 MK8 CE 1 1
9 1639 1 1 3 . CG C 2.882 -2.071 5.961 1.00 . A A . 2 MK8 CG 1 1
9 1640 1 1 3 . HB H 0.853 -2.357 6.585 1.00 . A A . 2 MK8 HB 1 1
9 1641 1 1 3 . HB1 H 2.204 0.768 5.821 1.00 . A A . 2 MK8 HB1 1 1
9 1642 1 1 3 . HB1A H 0.569 1.440 5.829 1.00 . A A . 2 MK8 HB1A 1 1
9 1643 1 1 3 . HB1B H 1.392 1.150 4.301 1.00 . A A . 2 MK8 HB1B 1 1
9 1644 1 1 3 . HBA H 1.602 -0.904 7.196 1.00 . A A . 2 MK8 HBA 1 1
9 1645 1 1 3 . HD H 2.080 -3.122 4.295 1.00 . A A . 2 MK8 HD 1 1
9 1646 1 1 3 . HDA H 2.334 -4.096 5.716 1.00 . A A . 2 MK8 HDA 1 1
9 1647 1 1 3 . HE H 4.794 -4.278 5.171 1.00 . A A . 2 MK8 HE 1 1
9 1648 1 1 3 . HG H 3.386 -2.317 6.879 1.00 . A A . 2 MK8 HG 1 1
9 1649 1 1 3 . HGA H 3.445 -1.320 5.431 1.00 . A A . 2 MK8 HGA 1 1
9 1650 1 1 3 . HN H -0.886 -0.926 6.701 1.00 . A A . 2 MK8 HN 1 1
9 1651 1 1 3 . N N -0.737 -0.594 5.790 1.00 . A A . 2 MK8 N 1 1
9 1652 1 1 3 . O O 1.101 -0.720 2.797 1.00 . A A . 2 MK8 O 1 1
9 1653 1 1 4 ILE C C -0.673 -2.753 1.480 1.00 . A A . 3 ILE C 1 1
9 1654 1 1 4 ILE CA C 0.098 -3.478 2.602 1.00 . A A . 3 ILE CA 1 1
9 1655 1 1 4 ILE CB C -0.567 -4.893 2.891 1.00 . A A . 3 ILE CB 1 1
9 1656 1 1 4 ILE CD1 C -0.832 -5.001 5.471 1.00 . A A . 3 ILE CD1 1 1
9 1657 1 1 4 ILE CG1 C -0.134 -5.540 4.239 1.00 . A A . 3 ILE CG1 1 1
9 1658 1 1 4 ILE CG2 C -0.229 -5.900 1.782 1.00 . A A . 3 ILE CG2 1 1
9 1659 1 1 4 ILE H H -0.102 -2.972 4.664 1.00 . A A . 3 ILE H 1 1
9 1660 1 1 4 ILE HA H 1.119 -3.648 2.263 1.00 . A A . 3 ILE HA 1 1
9 1661 1 1 4 ILE HB H -1.638 -4.760 2.890 1.00 . A A . 3 ILE HB 1 1
9 1662 1 1 4 ILE HD11 H -0.876 -5.779 6.226 1.00 . A A . 3 ILE HD11 1 1
9 1663 1 1 4 ILE HD12 H -1.832 -4.696 5.211 1.00 . A A . 3 ILE HD12 1 1
9 1664 1 1 4 ILE HD13 H -0.281 -4.153 5.857 1.00 . A A . 3 ILE HD13 1 1
9 1665 1 1 4 ILE HG12 H -0.346 -6.594 4.196 1.00 . A A . 3 ILE HG12 1 1
9 1666 1 1 4 ILE HG13 H 0.927 -5.399 4.368 1.00 . A A . 3 ILE HG13 1 1
9 1667 1 1 4 ILE HG21 H 0.669 -5.579 1.274 1.00 . A A . 3 ILE HG21 1 1
9 1668 1 1 4 ILE HG22 H -1.043 -5.945 1.075 1.00 . A A . 3 ILE HG22 1 1
9 1669 1 1 4 ILE HG23 H -0.070 -6.876 2.217 1.00 . A A . 3 ILE HG23 1 1
9 1670 1 1 4 ILE N N 0.174 -2.596 3.807 1.00 . A A . 3 ILE N 1 1
9 1671 1 1 4 ILE O O -0.301 -2.876 0.293 1.00 . A A . 3 ILE O 1 1
9 1672 1 1 5 LEU C C -1.783 -0.176 0.262 1.00 . A A . 4 LEU C 1 1
9 1673 1 1 5 LEU CA C -2.609 -1.205 1.025 1.00 . A A . 4 LEU CA 1 1
9 1674 1 1 5 LEU CB C -3.706 -0.539 1.877 1.00 . A A . 4 LEU CB 1 1
9 1675 1 1 5 LEU CD1 C -6.056 0.264 2.040 1.00 . A A . 4 LEU CD1 1 1
9 1676 1 1 5 LEU CD2 C -4.428 1.598 0.719 1.00 . A A . 4 LEU CD2 1 1
9 1677 1 1 5 LEU CG C -4.847 0.187 1.138 1.00 . A A . 4 LEU CG 1 1
9 1678 1 1 5 LEU H H -1.919 -1.967 2.871 1.00 . A A . 4 LEU H 1 1
9 1679 1 1 5 LEU HA H -3.069 -1.875 0.319 1.00 . A A . 4 LEU HA 1 1
9 1680 1 1 5 LEU HB2 H -4.145 -1.304 2.500 1.00 . A A . 4 LEU HB2 1 1
9 1681 1 1 5 LEU HB3 H -3.220 0.177 2.519 1.00 . A A . 4 LEU HB3 1 1
9 1682 1 1 5 LEU HD11 H -6.842 0.810 1.538 1.00 . A A . 4 LEU HD11 1 1
9 1683 1 1 5 LEU HD12 H -5.790 0.765 2.955 1.00 . A A . 4 LEU HD12 1 1
9 1684 1 1 5 LEU HD13 H -6.398 -0.736 2.268 1.00 . A A . 4 LEU HD13 1 1
9 1685 1 1 5 LEU HD21 H -4.891 2.325 1.374 1.00 . A A . 4 LEU HD21 1 1
9 1686 1 1 5 LEU HD22 H -4.744 1.780 -0.295 1.00 . A A . 4 LEU HD22 1 1
9 1687 1 1 5 LEU HD23 H -3.354 1.691 0.781 1.00 . A A . 4 LEU HD23 1 1
9 1688 1 1 5 LEU HG H -5.119 -0.373 0.253 1.00 . A A . 4 LEU HG 1 1
9 1689 1 1 5 LEU N N -1.735 -1.991 1.910 1.00 . A A . 4 LEU N 1 1
9 1690 1 1 5 LEU O O -1.956 -0.017 -0.956 1.00 . A A . 4 LEU O 1 1
9 1691 1 1 6 HIS C C 1.110 0.967 -0.388 1.00 . A A . 5 HIS C 1 1
9 1692 1 1 6 HIS CA C 0.047 1.535 0.542 1.00 . A A . 5 HIS CA 1 1
9 1693 1 1 6 HIS CB C 0.701 2.227 1.733 1.00 . A A . 5 HIS CB 1 1
9 1694 1 1 6 HIS CD2 C -0.686 4.033 2.974 1.00 . A A . 5 HIS CD2 1 1
9 1695 1 1 6 HIS CE1 C -0.137 5.754 1.724 1.00 . A A . 5 HIS CE1 1 1
9 1696 1 1 6 HIS CG C 0.157 3.591 2.009 1.00 . A A . 5 HIS CG 1 1
9 1697 1 1 6 HIS H H -0.829 0.265 1.987 1.00 . A A . 5 HIS H 1 1
9 1698 1 1 6 HIS HA H -0.540 2.261 0.001 1.00 . A A . 5 HIS HA 1 1
9 1699 1 1 6 HIS HB2 H 0.536 1.632 2.612 1.00 . A A . 5 HIS HB2 1 1
9 1700 1 1 6 HIS HB3 H 1.762 2.319 1.560 1.00 . A A . 5 HIS HB3 1 1
9 1701 1 1 6 HIS HD1 H 1.072 4.692 0.460 1.00 . A A . 5 HIS HD1 1 1
9 1702 1 1 6 HIS HD2 H -1.149 3.433 3.751 1.00 . A A . 5 HIS HD2 1 1
9 1703 1 1 6 HIS HE1 H -0.070 6.748 1.325 1.00 . A A . 5 HIS HE1 1 1
9 1704 1 1 6 HIS HE2 H -1.302 5.996 3.403 1.00 . A A . 5 HIS HE2 1 1
9 1705 1 1 6 HIS N N -0.875 0.495 1.035 1.00 . A A . 5 HIS N 1 1
9 1706 1 1 6 HIS ND1 N 0.477 4.693 1.246 1.00 . A A . 5 HIS ND1 1 1
9 1707 1 1 6 HIS NE2 N -0.855 5.382 2.780 1.00 . A A . 5 HIS NE2 1 1
9 1708 1 1 6 HIS O O 1.352 1.539 -1.462 1.00 . A A . 5 HIS O 1 1
9 1709 1 1 7 . C C 2.342 -1.200 -2.171 1.00 . A A . 6 MK8 C 1 1
9 1710 1 1 7 . CA C 2.853 -0.883 -0.727 1.00 . A A . 6 MK8 CA 1 1
9 1711 1 1 7 . CB C 3.196 -2.266 -0.088 1.00 . A A . 6 MK8 CB 1 1
9 1712 1 1 7 . CB1 C 4.139 -0.011 -0.756 1.00 . A A . 6 MK8 CB1 1 1
9 1713 1 1 7 . CD C 3.425 -3.814 1.890 1.00 . A A . 6 MK8 CD 1 1
9 1714 1 1 7 . CE C 4.314 -4.163 3.125 1.00 . A A . 6 MK8 CE 1 1
9 1715 1 1 7 . CG C 3.268 -2.361 1.458 1.00 . A A . 6 MK8 CG 1 1
9 1716 1 1 7 . HB H 4.150 -2.593 -0.480 1.00 . A A . 6 MK8 HB 1 1
9 1717 1 1 7 . HB1 H 3.878 1.014 -0.999 1.00 . A A . 6 MK8 HB1 1 1
9 1718 1 1 7 . HB1A H 4.820 -0.394 -1.506 1.00 . A A . 6 MK8 HB1A 1 1
9 1719 1 1 7 . HB1B H 4.614 -0.041 0.211 1.00 . A A . 6 MK8 HB1B 1 1
9 1720 1 1 7 . HBA H 2.450 -2.975 -0.419 1.00 . A A . 6 MK8 HBA 1 1
9 1721 1 1 7 . HD H 3.815 -4.360 1.039 1.00 . A A . 6 MK8 HD 1 1
9 1722 1 1 7 . HDA H 2.444 -4.200 2.096 1.00 . A A . 6 MK8 HDA 1 1
9 1723 1 1 7 . HE H 5.251 -4.618 2.903 1.00 . A A . 6 MK8 HE 1 1
9 1724 1 1 7 . HG H 2.358 -1.955 1.885 1.00 . A A . 6 MK8 HG 1 1
9 1725 1 1 7 . HGA H 4.119 -1.790 1.810 1.00 . A A . 6 MK8 HGA 1 1
9 1726 1 1 7 . HN H 1.501 -0.552 0.910 1.00 . A A . 6 MK8 HN 1 1
9 1727 1 1 7 . N N 1.761 -0.177 0.046 1.00 . A A . 6 MK8 N 1 1
9 1728 1 1 7 . O O 3.146 -1.485 -3.098 1.00 . A A . 6 MK8 O 1 1
9 1729 1 1 8 LEU C C 0.119 -0.225 -4.444 1.00 . A A . 7 LEU C 1 1
9 1730 1 1 8 LEU CA C 0.246 -1.474 -3.561 1.00 . A A . 7 LEU CA 1 1
9 1731 1 1 8 LEU CB C -1.151 -2.050 -3.246 1.00 . A A . 7 LEU CB 1 1
9 1732 1 1 8 LEU CD1 C -1.462 -4.156 -4.656 1.00 . A A . 7 LEU CD1 1 1
9 1733 1 1 8 LEU CD2 C -3.406 -2.649 -4.189 1.00 . A A . 7 LEU CD2 1 1
9 1734 1 1 8 LEU CG C -1.907 -2.710 -4.431 1.00 . A A . 7 LEU CG 1 1
9 1735 1 1 8 LEU H H 0.437 -0.985 -1.505 1.00 . A A . 7 LEU H 1 1
9 1736 1 1 8 LEU HA H 0.811 -2.222 -4.095 1.00 . A A . 7 LEU HA 1 1
9 1737 1 1 8 LEU HB2 H -1.030 -2.792 -2.471 1.00 . A A . 7 LEU HB2 1 1
9 1738 1 1 8 LEU HB3 H -1.770 -1.251 -2.858 1.00 . A A . 7 LEU HB3 1 1
9 1739 1 1 8 LEU HD11 H -0.468 -4.295 -4.269 1.00 . A A . 7 LEU HD11 1 1
9 1740 1 1 8 LEU HD12 H -1.470 -4.374 -5.716 1.00 . A A . 7 LEU HD12 1 1
9 1741 1 1 8 LEU HD13 H -2.143 -4.824 -4.150 1.00 . A A . 7 LEU HD13 1 1
9 1742 1 1 8 LEU HD21 H -3.751 -3.598 -3.809 1.00 . A A . 7 LEU HD21 1 1
9 1743 1 1 8 LEU HD22 H -3.909 -2.434 -5.118 1.00 . A A . 7 LEU HD22 1 1
9 1744 1 1 8 LEU HD23 H -3.621 -1.871 -3.471 1.00 . A A . 7 LEU HD23 1 1
9 1745 1 1 8 LEU HG H -1.696 -2.159 -5.336 1.00 . A A . 7 LEU HG 1 1
9 1746 1 1 8 LEU N N 0.968 -1.181 -2.304 1.00 . A A . 7 LEU N 1 1
9 1747 1 1 8 LEU O O 0.278 -0.337 -5.671 1.00 . A A . 7 LEU O 1 1
9 1748 1 1 9 LEU C C 0.943 2.905 -4.874 1.00 . A A . 8 LEU C 1 1
9 1749 1 1 9 LEU CA C -0.388 2.259 -4.463 1.00 . A A . 8 LEU CA 1 1
9 1750 1 1 9 LEU CB C -1.156 3.238 -3.541 1.00 . A A . 8 LEU CB 1 1
9 1751 1 1 9 LEU CD1 C -2.754 3.635 -1.646 1.00 . A A . 8 LEU CD1 1 1
9 1752 1 1 9 LEU CD2 C -3.641 2.619 -3.735 1.00 . A A . 8 LEU CD2 1 1
9 1753 1 1 9 LEU CG C -2.427 2.714 -2.810 1.00 . A A . 8 LEU CG 1 1
9 1754 1 1 9 LEU H H -0.296 0.913 -2.814 1.00 . A A . 8 LEU H 1 1
9 1755 1 1 9 LEU HA H -0.978 2.079 -5.349 1.00 . A A . 8 LEU HA 1 1
9 1756 1 1 9 LEU HB2 H -0.464 3.589 -2.785 1.00 . A A . 8 LEU HB2 1 1
9 1757 1 1 9 LEU HB3 H -1.447 4.092 -4.139 1.00 . A A . 8 LEU HB3 1 1
9 1758 1 1 9 LEU HD11 H -3.811 3.585 -1.422 1.00 . A A . 8 LEU HD11 1 1
9 1759 1 1 9 LEU HD12 H -2.496 4.650 -1.912 1.00 . A A . 8 LEU HD12 1 1
9 1760 1 1 9 LEU HD13 H -2.186 3.332 -0.782 1.00 . A A . 8 LEU HD13 1 1
9 1761 1 1 9 LEU HD21 H -3.411 1.967 -4.559 1.00 . A A . 8 LEU HD21 1 1
9 1762 1 1 9 LEU HD22 H -3.876 3.601 -4.105 1.00 . A A . 8 LEU HD22 1 1
9 1763 1 1 9 LEU HD23 H -4.491 2.225 -3.184 1.00 . A A . 8 LEU HD23 1 1
9 1764 1 1 9 LEU HG H -2.239 1.730 -2.411 1.00 . A A . 8 LEU HG 1 1
9 1765 1 1 9 LEU N N -0.187 0.951 -3.785 1.00 . A A . 8 LEU N 1 1
9 1766 1 1 9 LEU O O 1.001 3.580 -5.922 1.00 . A A . 8 LEU O 1 1
9 1767 1 1 10 GLN C C 4.117 2.478 -5.293 1.00 . A A . 9 GLN C 1 1
9 1768 1 1 10 GLN CA C 3.360 3.242 -4.202 1.00 . A A . 9 GLN CA 1 1
9 1769 1 1 10 GLN CB C 4.145 3.218 -2.884 1.00 . A A . 9 GLN CB 1 1
9 1770 1 1 10 GLN CD C 4.296 3.930 -0.467 1.00 . A A . 9 GLN CD 1 1
9 1771 1 1 10 GLN CG C 3.495 4.014 -1.757 1.00 . A A . 9 GLN CG 1 1
9 1772 1 1 10 GLN H H 1.831 2.157 -3.209 1.00 . A A . 9 GLN H 1 1
9 1773 1 1 10 GLN HA H 3.252 4.266 -4.520 1.00 . A A . 9 GLN HA 1 1
9 1774 1 1 10 GLN HB2 H 4.233 2.193 -2.555 1.00 . A A . 9 GLN HB2 1 1
9 1775 1 1 10 GLN HB3 H 5.138 3.616 -3.048 1.00 . A A . 9 GLN HB3 1 1
9 1776 1 1 10 GLN HE21 H 4.342 5.917 -0.318 1.00 . A A . 9 GLN HE21 1 1
9 1777 1 1 10 GLN HE22 H 5.154 5.047 0.934 1.00 . A A . 9 GLN HE22 1 1
9 1778 1 1 10 GLN HG2 H 3.417 5.048 -2.051 1.00 . A A . 9 GLN HG2 1 1
9 1779 1 1 10 GLN HG3 H 2.505 3.619 -1.575 1.00 . A A . 9 GLN HG3 1 1
9 1780 1 1 10 GLN N N 1.996 2.696 -4.012 1.00 . A A . 9 GLN N 1 1
9 1781 1 1 10 GLN NE2 N 4.629 5.080 0.107 1.00 . A A . 9 GLN NE2 1 1
9 1782 1 1 10 GLN O O 4.861 3.104 -6.071 1.00 . A A . 9 GLN O 1 1
9 1783 1 1 10 GLN OE1 O 4.593 2.839 0.026 1.00 . A A . 9 GLN OE1 1 1
9 1784 1 1 11 ASP C C 3.937 0.432 -7.685 1.00 . A A . 10 ASP C 1 1
9 1785 1 1 11 ASP CA C 4.504 0.194 -6.302 1.00 . A A . 10 ASP CA 1 1
9 1786 1 1 11 ASP CB C 4.261 -1.253 -5.874 1.00 . A A . 10 ASP CB 1 1
9 1787 1 1 11 ASP CG C 5.088 -2.235 -6.685 1.00 . A A . 10 ASP CG 1 1
9 1788 1 1 11 ASP H H 3.279 0.732 -4.664 1.00 . A A . 10 ASP H 1 1
9 1789 1 1 11 ASP HA H 5.560 0.376 -6.333 1.00 . A A . 10 ASP HA 1 1
9 1790 1 1 11 ASP HB2 H 4.516 -1.356 -4.837 1.00 . A A . 10 ASP HB2 1 1
9 1791 1 1 11 ASP HB3 H 3.218 -1.503 -6.006 1.00 . A A . 10 ASP HB3 1 1
9 1792 1 1 11 ASP N N 3.890 1.116 -5.325 1.00 . A A . 10 ASP N 1 1
9 1793 1 1 11 ASP O O 4.711 0.480 -8.663 1.00 . A A . 10 ASP O 1 1
9 1794 1 1 11 ASP OD1 O 4.926 -2.259 -7.922 1.00 . A A . 10 ASP OD1 1 1
9 1795 1 1 11 ASP OD2 O 5.886 -2.982 -6.088 1.00 . A A . 10 ASP OD2 1 1
9 1796 1 1 12 SER C C 2.221 2.162 -9.601 1.00 . A A . 11 SER C 1 1
9 1797 1 1 12 SER CA C 1.812 0.835 -8.976 1.00 . A A . 11 SER CA 1 1
9 1798 1 1 12 SER CB C 0.300 0.808 -8.681 1.00 . A A . 11 SER CB 1 1
9 1799 1 1 12 SER H H 2.078 0.529 -6.884 1.00 . A A . 11 SER H 1 1
9 1800 1 1 12 SER HA H 2.049 0.048 -9.674 1.00 . A A . 11 SER HA 1 1
9 1801 1 1 12 SER HB2 H 0.086 1.508 -7.897 1.00 . A A . 11 SER HB2 1 1
9 1802 1 1 12 SER HB3 H -0.254 1.086 -9.568 1.00 . A A . 11 SER HB3 1 1
9 1803 1 1 12 SER HG H -0.614 -0.916 -8.977 1.00 . A A . 11 SER HG 1 1
9 1804 1 1 12 SER N N 2.573 0.584 -7.732 1.00 . A A . 11 SER N 1 1
9 1805 1 1 12 SER O O 2.085 2.364 -10.804 1.00 . A A . 11 SER O 1 1
9 1806 1 1 12 SER OG O -0.117 -0.490 -8.268 1.00 . A A . 11 SER OG 1 1
9 1807 1 1 13 NH2 HN1 H 2.733 2.857 -7.804 1.00 . A A . 12 NH2 HN1 1 1
9 1808 1 1 13 NH2 HN2 H 2.979 3.951 -9.165 1.00 . A A . 12 NH2 HN2 1 1
9 1809 1 1 13 NH2 N N 2.686 3.084 -8.776 1.00 . A A . 12 NH2 N 1 1
10 1810 1 1 1 ACE C C -3.371 -3.096 6.994 1.00 . A A . 0 ACE C 1 1
10 1811 1 1 1 ACE CH3 C -3.108 -4.003 8.175 1.00 . A A . 0 ACE CH3 1 1
10 1812 1 1 1 ACE H1 H -2.652 -3.437 8.972 1.00 . A A . 0 ACE H1 1 1
10 1813 1 1 1 ACE H2 H -2.449 -4.801 7.872 1.00 . A A . 0 ACE H2 1 1
10 1814 1 1 1 ACE H3 H -4.044 -4.420 8.522 1.00 . A A . 0 ACE H3 1 1
10 1815 1 1 1 ACE O O -3.924 -3.569 5.981 1.00 . A A . 0 ACE O 1 1
10 1816 1 1 2 HIS C C -1.904 -0.506 5.285 1.00 . A A . 1 HIS C 1 1
10 1817 1 1 2 HIS CA C -3.160 -0.737 6.115 1.00 . A A . 1 HIS CA 1 1
10 1818 1 1 2 HIS CB C -3.577 0.592 6.766 1.00 . A A . 1 HIS CB 1 1
10 1819 1 1 2 HIS CD2 C -4.123 2.620 5.246 1.00 . A A . 1 HIS CD2 1 1
10 1820 1 1 2 HIS CE1 C -6.231 2.163 4.861 1.00 . A A . 1 HIS CE1 1 1
10 1821 1 1 2 HIS CG C -4.418 1.471 5.898 1.00 . A A . 1 HIS CG 1 1
10 1822 1 1 2 HIS H H -2.563 -1.512 7.992 1.00 . A A . 1 HIS H 1 1
10 1823 1 1 2 HIS HA H -3.947 -1.061 5.460 1.00 . A A . 1 HIS HA 1 1
10 1824 1 1 2 HIS HB2 H -4.148 0.389 7.653 1.00 . A A . 1 HIS HB2 1 1
10 1825 1 1 2 HIS HB3 H -2.691 1.146 7.033 1.00 . A A . 1 HIS HB3 1 1
10 1826 1 1 2 HIS HD1 H -6.256 0.441 5.969 1.00 . A A . 1 HIS HD1 1 1
10 1827 1 1 2 HIS HD2 H -3.164 3.115 5.218 1.00 . A A . 1 HIS HD2 1 1
10 1828 1 1 2 HIS HE1 H -7.246 2.232 4.501 1.00 . A A . 1 HIS HE1 1 1
10 1829 1 1 2 HIS HE2 H -5.351 3.826 4.052 1.00 . A A . 1 HIS HE2 1 1
10 1830 1 1 2 HIS N N -2.977 -1.776 7.148 1.00 . A A . 1 HIS N 1 1
10 1831 1 1 2 HIS ND1 N -5.746 1.212 5.637 1.00 . A A . 1 HIS ND1 1 1
10 1832 1 1 2 HIS NE2 N -5.264 3.028 4.611 1.00 . A A . 1 HIS NE2 1 1
10 1833 1 1 2 HIS O O -2.030 -0.090 4.121 1.00 . A A . 1 HIS O 1 1
10 1834 1 1 3 . C C 0.671 -1.166 3.793 1.00 . A A . 2 MK8 C 1 1
10 1835 1 1 3 . CA C 0.653 -0.519 5.243 1.00 . A A . 2 MK8 CA 1 1
10 1836 1 1 3 . CB C 1.811 -1.096 6.101 1.00 . A A . 2 MK8 CB 1 1
10 1837 1 1 3 . CB1 C 0.911 1.009 5.226 1.00 . A A . 2 MK8 CB1 1 1
10 1838 1 1 3 . CD C 2.217 -3.526 5.334 1.00 . A A . 2 MK8 CD 1 1
10 1839 1 1 3 . CE C 3.701 -3.619 4.927 1.00 . A A . 2 MK8 CE 1 1
10 1840 1 1 3 . CG C 1.769 -2.589 6.462 1.00 . A A . 2 MK8 CG 1 1
10 1841 1 1 3 . HB H 1.836 -0.539 7.026 1.00 . A A . 2 MK8 HB 1 1
10 1842 1 1 3 . HB1 H 1.497 1.277 6.091 1.00 . A A . 2 MK8 HB1 1 1
10 1843 1 1 3 . HB1A H -0.034 1.537 5.256 1.00 . A A . 2 MK8 HB1A 1 1
10 1844 1 1 3 . HB1B H 1.448 1.280 4.332 1.00 . A A . 2 MK8 HB1B 1 1
10 1845 1 1 3 . HBA H 2.738 -0.920 5.579 1.00 . A A . 2 MK8 HBA 1 1
10 1846 1 1 3 . HD H 1.652 -3.252 4.460 1.00 . A A . 2 MK8 HD 1 1
10 1847 1 1 3 . HDA H 1.923 -4.515 5.615 1.00 . A A . 2 MK8 HDA 1 1
10 1848 1 1 3 . HE H 4.387 -3.792 5.727 1.00 . A A . 2 MK8 HE 1 1
10 1849 1 1 3 . HG H 0.767 -2.843 6.749 1.00 . A A . 2 MK8 HG 1 1
10 1850 1 1 3 . HGA H 2.424 -2.749 7.297 1.00 . A A . 2 MK8 HGA 1 1
10 1851 1 1 3 . HN H -0.680 -1.039 6.840 1.00 . A A . 2 MK8 HN 1 1
10 1852 1 1 3 . N N -0.675 -0.740 5.908 1.00 . A A . 2 MK8 N 1 1
10 1853 1 1 3 . O O 1.288 -0.634 2.829 1.00 . A A . 2 MK8 O 1 1
10 1854 1 1 4 ILE C C -0.763 -2.414 1.363 1.00 . A A . 3 ILE C 1 1
10 1855 1 1 4 ILE CA C -0.078 -3.208 2.470 1.00 . A A . 3 ILE CA 1 1
10 1856 1 1 4 ILE CB C -0.812 -4.607 2.658 1.00 . A A . 3 ILE CB 1 1
10 1857 1 1 4 ILE CD1 C -1.267 -4.776 5.195 1.00 . A A . 3 ILE CD1 1 1
10 1858 1 1 4 ILE CG1 C -0.501 -5.310 4.004 1.00 . A A . 3 ILE CG1 1 1
10 1859 1 1 4 ILE CG2 C -0.400 -5.584 1.548 1.00 . A A . 3 ILE CG2 1 1
10 1860 1 1 4 ILE H H -0.421 -2.725 4.519 1.00 . A A . 3 ILE H 1 1
10 1861 1 1 4 ILE HA H 0.944 -3.408 2.177 1.00 . A A . 3 ILE HA 1 1
10 1862 1 1 4 ILE HB H -1.879 -4.442 2.575 1.00 . A A . 3 ILE HB 1 1
10 1863 1 1 4 ILE HD11 H -1.278 -5.518 5.972 1.00 . A A . 3 ILE HD11 1 1
10 1864 1 1 4 ILE HD12 H -2.281 -4.546 4.898 1.00 . A A . 3 ILE HD12 1 1
10 1865 1 1 4 ILE HD13 H -0.787 -3.878 5.558 1.00 . A A . 3 ILE HD13 1 1
10 1866 1 1 4 ILE HG12 H -0.725 -6.360 3.915 1.00 . A A . 3 ILE HG12 1 1
10 1867 1 1 4 ILE HG13 H 0.545 -5.194 4.214 1.00 . A A . 3 ILE HG13 1 1
10 1868 1 1 4 ILE HG21 H -0.610 -5.142 0.586 1.00 . A A . 3 ILE HG21 1 1
10 1869 1 1 4 ILE HG22 H -0.963 -6.497 1.652 1.00 . A A . 3 ILE HG22 1 1
10 1870 1 1 4 ILE HG23 H 0.661 -5.802 1.623 1.00 . A A . 3 ILE HG23 1 1
10 1871 1 1 4 ILE N N -0.005 -2.377 3.706 1.00 . A A . 3 ILE N 1 1
10 1872 1 1 4 ILE O O -0.309 -2.435 0.206 1.00 . A A . 3 ILE O 1 1
10 1873 1 1 5 LEU C C -1.845 0.194 0.181 1.00 . A A . 4 LEU C 1 1
10 1874 1 1 5 LEU CA C -2.706 -0.868 0.886 1.00 . A A . 4 LEU CA 1 1
10 1875 1 1 5 LEU CB C -3.804 -0.205 1.739 1.00 . A A . 4 LEU CB 1 1
10 1876 1 1 5 LEU CD1 C -6.173 0.562 1.864 1.00 . A A . 4 LEU CD1 1 1
10 1877 1 1 5 LEU CD2 C -4.502 1.963 0.681 1.00 . A A . 4 LEU CD2 1 1
10 1878 1 1 5 LEU CG C -4.927 0.538 1.004 1.00 . A A . 4 LEU CG 1 1
10 1879 1 1 5 LEU H H -2.130 -1.782 2.709 1.00 . A A . 4 LEU H 1 1
10 1880 1 1 5 LEU HA H -3.169 -1.503 0.142 1.00 . A A . 4 LEU HA 1 1
10 1881 1 1 5 LEU HB2 H -4.269 -0.974 2.340 1.00 . A A . 4 LEU HB2 1 1
10 1882 1 1 5 LEU HB3 H -3.322 0.501 2.414 1.00 . A A . 4 LEU HB3 1 1
10 1883 1 1 5 LEU HD11 H -6.439 -0.442 2.157 1.00 . A A . 4 LEU HD11 1 1
10 1884 1 1 5 LEU HD12 H -6.984 1.005 1.300 1.00 . A A . 4 LEU HD12 1 1
10 1885 1 1 5 LEU HD13 H -5.978 1.158 2.745 1.00 . A A . 4 LEU HD13 1 1
10 1886 1 1 5 LEU HD21 H -3.535 1.950 0.199 1.00 . A A . 4 LEU HD21 1 1
10 1887 1 1 5 LEU HD22 H -4.436 2.527 1.601 1.00 . A A . 4 LEU HD22 1 1
10 1888 1 1 5 LEU HD23 H -5.230 2.423 0.023 1.00 . A A . 4 LEU HD23 1 1
10 1889 1 1 5 LEU HG H -5.154 0.033 0.077 1.00 . A A . 4 LEU HG 1 1
10 1890 1 1 5 LEU N N -1.872 -1.712 1.767 1.00 . A A . 4 LEU N 1 1
10 1891 1 1 5 LEU O O -2.091 0.515 -0.992 1.00 . A A . 4 LEU O 1 1
10 1892 1 1 6 HIS C C 1.218 1.147 -0.392 1.00 . A A . 5 HIS C 1 1
10 1893 1 1 6 HIS CA C 0.126 1.730 0.508 1.00 . A A . 5 HIS CA 1 1
10 1894 1 1 6 HIS CB C 0.721 2.424 1.727 1.00 . A A . 5 HIS CB 1 1
10 1895 1 1 6 HIS CD2 C -0.816 4.166 2.865 1.00 . A A . 5 HIS CD2 1 1
10 1896 1 1 6 HIS CE1 C -0.280 5.907 1.644 1.00 . A A . 5 HIS CE1 1 1
10 1897 1 1 6 HIS CG C 0.118 3.764 1.972 1.00 . A A . 5 HIS CG 1 1
10 1898 1 1 6 HIS H H -0.748 0.362 1.861 1.00 . A A . 5 HIS H 1 1
10 1899 1 1 6 HIS HA H -0.428 2.458 -0.065 1.00 . A A . 5 HIS HA 1 1
10 1900 1 1 6 HIS HB2 H 0.539 1.812 2.598 1.00 . A A . 5 HIS HB2 1 1
10 1901 1 1 6 HIS HB3 H 1.785 2.555 1.599 1.00 . A A . 5 HIS HB3 1 1
10 1902 1 1 6 HIS HD1 H 1.089 4.896 0.481 1.00 . A A . 5 HIS HD1 1 1
10 1903 1 1 6 HIS HD2 H -1.309 3.540 3.606 1.00 . A A . 5 HIS HD2 1 1
10 1904 1 1 6 HIS HE1 H -0.228 6.917 1.253 1.00 . A A . 5 HIS HE1 1 1
10 1905 1 1 6 HIS HE2 H -1.516 6.100 3.264 1.00 . A A . 5 HIS HE2 1 1
10 1906 1 1 6 HIS N N -0.835 0.704 0.949 1.00 . A A . 5 HIS N 1 1
10 1907 1 1 6 HIS ND1 N 0.435 4.873 1.218 1.00 . A A . 5 HIS ND1 1 1
10 1908 1 1 6 HIS NE2 N -1.049 5.505 2.644 1.00 . A A . 5 HIS NE2 1 1
10 1909 1 1 6 HIS O O 1.426 1.668 -1.493 1.00 . A A . 5 HIS O 1 1
10 1910 1 1 7 . C C 2.435 -1.116 -2.076 1.00 . A A . 6 MK8 C 1 1
10 1911 1 1 7 . CA C 2.998 -0.682 -0.674 1.00 . A A . 6 MK8 CA 1 1
10 1912 1 1 7 . CB C 3.415 -1.991 0.084 1.00 . A A . 6 MK8 CB 1 1
10 1913 1 1 7 . CB1 C 4.246 0.242 -0.869 1.00 . A A . 6 MK8 CB1 1 1
10 1914 1 1 7 . CD C 3.512 -3.268 2.291 1.00 . A A . 6 MK8 CD 1 1
10 1915 1 1 7 . CE C 4.243 -3.513 3.651 1.00 . A A . 6 MK8 CE 1 1
10 1916 1 1 7 . CG C 3.660 -1.904 1.609 1.00 . A A . 6 MK8 CG 1 1
10 1917 1 1 7 . HB H 4.322 -2.362 -0.376 1.00 . A A . 6 MK8 HB 1 1
10 1918 1 1 7 . HB1 H 4.536 0.225 -1.909 1.00 . A A . 6 MK8 HB1 1 1
10 1919 1 1 7 . HB1A H 5.059 -0.118 -0.261 1.00 . A A . 6 MK8 HB1A 1 1
10 1920 1 1 7 . HB1B H 3.998 1.253 -0.578 1.00 . A A . 6 MK8 HB1B 1 1
10 1921 1 1 7 . HBA H 2.636 -2.722 -0.059 1.00 . A A . 6 MK8 HBA 1 1
10 1922 1 1 7 . HD H 3.858 -4.018 1.588 1.00 . A A . 6 MK8 HD 1 1
10 1923 1 1 7 . HDA H 2.464 -3.439 2.464 1.00 . A A . 6 MK8 HDA 1 1
10 1924 1 1 7 . HE H 5.305 -3.611 3.595 1.00 . A A . 6 MK8 HE 1 1
10 1925 1 1 7 . HG H 2.948 -1.215 2.034 1.00 . A A . 6 MK8 HG 1 1
10 1926 1 1 7 . HGA H 4.660 -1.533 1.783 1.00 . A A . 6 MK8 HGA 1 1
10 1927 1 1 7 . HN H 1.655 -0.306 0.963 1.00 . A A . 6 MK8 HN 1 1
10 1928 1 1 7 . N N 1.906 0.039 0.086 1.00 . A A . 6 MK8 N 1 1
10 1929 1 1 7 . O O 3.215 -1.531 -2.974 1.00 . A A . 6 MK8 O 1 1
10 1930 1 1 8 LEU C C 0.167 -0.229 -4.415 1.00 . A A . 7 LEU C 1 1
10 1931 1 1 8 LEU CA C 0.322 -1.421 -3.462 1.00 . A A . 7 LEU CA 1 1
10 1932 1 1 8 LEU CB C -1.068 -2.008 -3.113 1.00 . A A . 7 LEU CB 1 1
10 1933 1 1 8 LEU CD1 C -1.255 -4.216 -4.412 1.00 . A A . 7 LEU CD1 1 1
10 1934 1 1 8 LEU CD2 C -3.286 -2.805 -3.998 1.00 . A A . 7 LEU CD2 1 1
10 1935 1 1 8 LEU CG C -1.787 -2.786 -4.247 1.00 . A A . 7 LEU CG 1 1
10 1936 1 1 8 LEU H H 0.522 -0.741 -1.456 1.00 . A A . 7 LEU H 1 1
10 1937 1 1 8 LEU HA H 0.901 -2.193 -3.958 1.00 . A A . 7 LEU HA 1 1
10 1938 1 1 8 LEU HB2 H -0.949 -2.671 -2.272 1.00 . A A . 7 LEU HB2 1 1
10 1939 1 1 8 LEU HB3 H -1.715 -1.186 -2.809 1.00 . A A . 7 LEU HB3 1 1
10 1940 1 1 8 LEU HD11 H -2.080 -4.910 -4.433 1.00 . A A . 7 LEU HD11 1 1
10 1941 1 1 8 LEU HD12 H -0.602 -4.456 -3.584 1.00 . A A . 7 LEU HD12 1 1
10 1942 1 1 8 LEU HD13 H -0.696 -4.288 -5.336 1.00 . A A . 7 LEU HD13 1 1
10 1943 1 1 8 LEU HD21 H -3.806 -2.811 -4.943 1.00 . A A . 7 LEU HD21 1 1
10 1944 1 1 8 LEU HD22 H -3.572 -1.926 -3.433 1.00 . A A . 7 LEU HD22 1 1
10 1945 1 1 8 LEU HD23 H -3.546 -3.692 -3.441 1.00 . A A . 7 LEU HD23 1 1
10 1946 1 1 8 LEU HG H -1.615 -2.280 -5.179 1.00 . A A . 7 LEU HG 1 1
10 1947 1 1 8 LEU N N 1.052 -1.043 -2.226 1.00 . A A . 7 LEU N 1 1
10 1948 1 1 8 LEU O O 0.299 -0.404 -5.644 1.00 . A A . 7 LEU O 1 1
10 1949 1 1 9 LEU C C 0.971 2.866 -4.998 1.00 . A A . 8 LEU C 1 1
10 1950 1 1 9 LEU CA C -0.345 2.245 -4.547 1.00 . A A . 8 LEU CA 1 1
10 1951 1 1 9 LEU CB C -1.110 3.268 -3.673 1.00 . A A . 8 LEU CB 1 1
10 1952 1 1 9 LEU CD1 C -2.722 3.717 -1.822 1.00 . A A . 8 LEU CD1 1 1
10 1953 1 1 9 LEU CD2 C -3.597 2.686 -3.900 1.00 . A A . 8 LEU CD2 1 1
10 1954 1 1 9 LEU CG C -2.393 2.779 -2.962 1.00 . A A . 8 LEU CG 1 1
10 1955 1 1 9 LEU H H -0.220 0.990 -2.847 1.00 . A A . 8 LEU H 1 1
10 1956 1 1 9 LEU HA H -0.941 2.020 -5.417 1.00 . A A . 8 LEU HA 1 1
10 1957 1 1 9 LEU HB2 H -0.435 3.628 -2.910 1.00 . A A . 8 LEU HB2 1 1
10 1958 1 1 9 LEU HB3 H -1.380 4.106 -4.303 1.00 . A A . 8 LEU HB3 1 1
10 1959 1 1 9 LEU HD11 H -1.971 3.617 -1.052 1.00 . A A . 8 LEU HD11 1 1
10 1960 1 1 9 LEU HD12 H -3.692 3.471 -1.420 1.00 . A A . 8 LEU HD12 1 1
10 1961 1 1 9 LEU HD13 H -2.731 4.726 -2.187 1.00 . A A . 8 LEU HD13 1 1
10 1962 1 1 9 LEU HD21 H -4.491 2.540 -3.314 1.00 . A A . 8 LEU HD21 1 1
10 1963 1 1 9 LEU HD22 H -3.465 1.849 -4.573 1.00 . A A . 8 LEU HD22 1 1
10 1964 1 1 9 LEU HD23 H -3.681 3.597 -4.468 1.00 . A A . 8 LEU HD23 1 1
10 1965 1 1 9 LEU HG H -2.216 1.802 -2.542 1.00 . A A . 8 LEU HG 1 1
10 1966 1 1 9 LEU N N -0.132 0.975 -3.815 1.00 . A A . 8 LEU N 1 1
10 1967 1 1 9 LEU O O 1.029 3.440 -6.097 1.00 . A A . 8 LEU O 1 1
10 1968 1 1 10 GLN C C 4.134 2.450 -5.360 1.00 . A A . 9 GLN C 1 1
10 1969 1 1 10 GLN CA C 3.368 3.271 -4.324 1.00 . A A . 9 GLN CA 1 1
10 1970 1 1 10 GLN CB C 4.140 3.308 -2.994 1.00 . A A . 9 GLN CB 1 1
10 1971 1 1 10 GLN CD C 4.258 4.144 -0.598 1.00 . A A . 9 GLN CD 1 1
10 1972 1 1 10 GLN CG C 3.498 4.192 -1.913 1.00 . A A . 9 GLN CG 1 1
10 1973 1 1 10 GLN H H 1.835 2.256 -3.266 1.00 . A A . 9 GLN H 1 1
10 1974 1 1 10 GLN HA H 3.269 4.282 -4.690 1.00 . A A . 9 GLN HA 1 1
10 1975 1 1 10 GLN HB2 H 4.213 2.303 -2.608 1.00 . A A . 9 GLN HB2 1 1
10 1976 1 1 10 GLN HB3 H 5.134 3.680 -3.181 1.00 . A A . 9 GLN HB3 1 1
10 1977 1 1 10 GLN HE21 H 4.466 6.118 -0.613 1.00 . A A . 9 GLN HE21 1 1
10 1978 1 1 10 GLN HE22 H 5.177 5.303 0.727 1.00 . A A . 9 GLN HE22 1 1
10 1979 1 1 10 GLN HG2 H 3.477 5.212 -2.262 1.00 . A A . 9 GLN HG2 1 1
10 1980 1 1 10 GLN HG3 H 2.483 3.861 -1.736 1.00 . A A . 9 GLN HG3 1 1
10 1981 1 1 10 GLN N N 2.013 2.733 -4.106 1.00 . A A . 9 GLN N 1 1
10 1982 1 1 10 GLN NE2 N 4.674 5.306 -0.112 1.00 . A A . 9 GLN NE2 1 1
10 1983 1 1 10 GLN O O 4.889 3.030 -6.167 1.00 . A A . 9 GLN O 1 1
10 1984 1 1 10 GLN OE1 O 4.453 3.077 -0.013 1.00 . A A . 9 GLN OE1 1 1
10 1985 1 1 11 ASP C C 3.954 0.312 -7.662 1.00 . A A . 10 ASP C 1 1
10 1986 1 1 11 ASP CA C 4.516 0.118 -6.256 1.00 . A A . 10 ASP CA 1 1
10 1987 1 1 11 ASP CB C 4.234 -1.314 -5.789 1.00 . A A . 10 ASP CB 1 1
10 1988 1 1 11 ASP CG C 5.025 -2.358 -6.565 1.00 . A A . 10 ASP CG 1 1
10 1989 1 1 11 ASP H H 3.277 0.747 -4.662 1.00 . A A . 10 ASP H 1 1
10 1990 1 1 11 ASP HA H 5.583 0.292 -6.265 1.00 . A A . 10 ASP HA 1 1
10 1991 1 1 11 ASP HB2 H 4.486 -1.403 -4.742 1.00 . A A . 10 ASP HB2 1 1
10 1992 1 1 11 ASP HB3 H 3.181 -1.530 -5.917 1.00 . A A . 10 ASP HB3 1 1
10 1993 1 1 11 ASP N N 3.897 1.089 -5.330 1.00 . A A . 10 ASP N 1 1
10 1994 1 1 11 ASP O O 4.726 0.329 -8.647 1.00 . A A . 10 ASP O 1 1
10 1995 1 1 11 ASP OD1 O 4.755 -2.544 -7.775 1.00 . A A . 10 ASP OD1 1 1
10 1996 1 1 11 ASP OD2 O 5.911 -2.993 -5.954 1.00 . A A . 10 ASP OD2 1 1
10 1997 1 1 12 SER C C 2.190 1.919 -9.658 1.00 . A A . 11 SER C 1 1
10 1998 1 1 12 SER CA C 1.815 0.628 -8.944 1.00 . A A . 11 SER CA 1 1
10 1999 1 1 12 SER CB C 0.312 0.595 -8.634 1.00 . A A . 11 SER CB 1 1
10 2000 1 1 12 SER H H 2.092 0.406 -6.873 1.00 . A A . 11 SER H 1 1
10 2001 1 1 12 SER HA H 2.044 -0.194 -9.592 1.00 . A A . 11 SER HA 1 1
10 2002 1 1 12 SER HB2 H 0.081 1.314 -7.857 1.00 . A A . 11 SER HB2 1 1
10 2003 1 1 12 SER HB3 H -0.233 0.843 -9.522 1.00 . A A . 11 SER HB3 1 1
10 2004 1 1 12 SER HG H -0.707 -0.605 -7.456 1.00 . A A . 11 SER HG 1 1
10 2005 1 1 12 SER N N 2.583 0.443 -7.709 1.00 . A A . 11 SER N 1 1
10 2006 1 1 12 SER O O 1.947 2.055 -10.854 1.00 . A A . 11 SER O 1 1
10 2007 1 1 12 SER OG O -0.093 -0.692 -8.192 1.00 . A A . 11 SER OG 1 1
10 2008 1 1 13 NH2 HN1 H 2.705 2.765 -7.940 1.00 . A A . 12 NH2 HN1 1 1
10 2009 1 1 13 NH2 HN2 H 2.870 3.746 -9.328 1.00 . A A . 12 NH2 HN2 1 1
10 2010 1 1 13 NH2 N N 2.634 2.910 -8.899 1.00 . A A . 12 NH2 N 1 1
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