NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
|
|
586116 |
2mjc   |
19716 | cing | 4-filtered-FRED | STAR | entry | full | 372 |
data_FRED_restraints_with_modified_coordinates_PDB_code_2mjc
# This FRED archive file contains, for PDB entry <2mjc>:
#
# - 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_2mjc
_Assembly.Sf_category assembly
_Assembly.Entry_ID 1
_Assembly.ID 1
_Assembly.Name 2mjc
_Assembly.Number_of_components 2
_Assembly.Organic_ligands .
_Assembly.Metal_ions .
_Assembly.Paramagnetic .
_Assembly.Thiol_state "all other bound"
_Assembly.Molecular_mass 2845.64
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 $Eukaryotic_translation_initiation_factor_3_subunit_G A . 1 1
2 . 2 $ZINC_ION B . 1 1
stop_
loop_
_PDBX_nonpoly_scheme.Entity_assembly_ID
_PDBX_nonpoly_scheme.Entity_ID
_PDBX_nonpoly_scheme.Mon_ID
_PDBX_nonpoly_scheme.Comp_index_ID
_PDBX_nonpoly_scheme.Comp_ID
_PDBX_nonpoly_scheme.Entry_ID
_PDBX_nonpoly_scheme.Assembly_ID
2 2 ZN 1 ZN 1 1
stop_
save_
save_Eukaryotic_translation_initiation_factor_3_subunit_G
_Entity.Sf_category entity
_Entity.Entry_ID 1
_Entity.ID 1
_Entity.Name "Eukaryotic translation initiation factor 3 subunit G"
_Entity.Type polymer
_Entity.Polymer_type polypeptide(L)
_Entity.Polymer_seq_one_letter_code KIVSCRICKGDHWTTRCPYKDTLG
_Entity.Number_of_monomers 24
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 LYS . 1 1
2 ILE . 1 1
3 VAL . 1 1
4 SER . 1 1
5 CYS . 1 1
6 ARG . 1 1
7 ILE . 1 1
8 CYS . 1 1
9 LYS . 1 1
10 GLY . 1 1
11 ASP . 1 1
12 HIS . 1 1
13 TRP . 1 1
14 THR . 1 1
15 THR . 1 1
16 ARG . 1 1
17 CYS . 1 1
18 PRO . 1 1
19 TYR . 1 1
20 LYS . 1 1
21 ASP . 1 1
22 THR . 1 1
23 LEU . 1 1
24 GLY . 1 1
stop_
loop_
_Entity_poly_seq.Mon_ID
_Entity_poly_seq.Num
_Entity_poly_seq.Comp_index_ID
_Entity_poly_seq.Entry_ID
_Entity_poly_seq.Entity_ID
LYS 1 1 1 1
ILE 2 2 1 1
VAL 3 3 1 1
SER 4 4 1 1
CYS 5 5 1 1
ARG 6 6 1 1
ILE 7 7 1 1
CYS 8 8 1 1
LYS 9 9 1 1
GLY 10 10 1 1
ASP 11 11 1 1
HIS 12 12 1 1
TRP 13 13 1 1
THR 14 14 1 1
THR 15 15 1 1
ARG 16 16 1 1
CYS 17 17 1 1
PRO 18 18 1 1
TYR 19 19 1 1
LYS 20 20 1 1
ASP 21 21 1 1
THR 22 22 1 1
LEU 23 23 1 1
GLY 24 24 1 1
stop_
save_
save_ZINC_ION
_Entity.Sf_category entity
_Entity.Entry_ID 1
_Entity.ID 2
_Entity.Name "ZINC ION"
_Entity.Type non-polymer
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 ZN $ZN 1 2
stop_
save_
save_ZN
_Chem_comp.Sf_category chem_comp
_Chem_comp.Entry_ID 1
_Chem_comp.ID ZN
_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
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34 1 . . . 1 1
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40 1 . . . 1 1
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42 1 . . . 1 1
43 1 . . . 1 1
44 1 . . . 1 1
45 1 . . . 1 1
46 1 . . . 1 1
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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
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70 1 . . . 1 1
71 1 . . . 1 1
72 1 . . . 1 1
73 1 . . . 1 1
74 1 . . . 1 1
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76 1 . . . 1 1
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78 1 . . . 1 1
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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
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100 1 . . . 1 1
101 1 . . . 1 1
102 1 . . . 1 1
103 1 . . . 1 1
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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
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122 1 . . . 1 1
123 1 . . . 1 1
124 1 . . . 1 1
125 1 . . . 1 1
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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
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142 1 . . . 1 1
143 1 . . . 1 1
144 1 . . . 1 1
145 1 . . . 1 1
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148 1 . . . 1 1
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159 1 . . . 1 1
160 1 . . . 1 1
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162 1 . . . 1 1
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165 1 . . . 1 1
166 1 . . . 1 1
167 1 . . . 1 1
168 1 . . . 1 1
169 1 . . . 1 1
170 1 . . . 1 1
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172 1 . . . 1 1
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174 1 . . . 1 1
175 1 . . . 1 1
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180 1 . . . 1 1
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187 1 . . . 1 1
188 1 . . . 1 1
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198 1 . . . 1 1
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202 1 . . . 1 1
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215 1 . . . 1 1
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224 1 . . . 1 1
225 1 . . . 1 1
226 1 . . . 1 1
227 1 . . . 1 1
228 1 . . . 1 1
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230 1 . . . 1 1
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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
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248 1 . . . 1 1
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250 1 . . . 1 1
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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
268 1 . . . 1 1
269 1 . . . 1 1
270 1 . . . 1 1
271 1 . . . 1 1
272 1 . . . 1 1
273 1 . . . 1 1
274 1 . . . 1 1
275 1 . . . 1 1
276 1 . . . 1 1
277 1 . . . 1 1
278 1 . . . 1 1
279 1 . . . 1 1
280 1 . . . 1 1
281 1 . . . 1 1
282 1 . . . 1 1
283 1 . . . 1 1
284 1 . . . 1 1
285 1 . . . 1 1
286 1 . . . 1 1
287 1 . . . 1 1
288 1 . . . 1 1
289 1 . . . 1 1
290 1 . . . 1 1
291 1 . . . 1 1
292 1 . . . 1 1
293 1 . . . 1 1
294 1 . . . 1 1
295 1 . . . 1 1
296 1 . . . 1 1
297 1 . . . 1 1
298 1 . . . 1 1
299 1 . . . 1 1
300 1 . . . 1 1
301 1 . . . 1 1
302 1 . . . 1 1
303 1 . . . 1 1
304 1 . . . 1 1
305 1 . . . 1 1
306 1 . . . 1 1
307 1 . . . 1 1
308 1 . . . 1 1
309 1 . . . 1 1
310 1 . . . 1 1
311 1 . . . 1 1
312 1 . . . 1 1
313 1 . . . 1 1
314 1 . . . 1 1
315 1 . . . 1 1
316 1 . . . 1 1
317 1 . . . 1 1
318 1 . . . 1 1
319 1 . . . 1 1
320 1 . . . 1 1
321 1 . . . 1 1
322 1 . . . 1 1
323 1 . . . 1 1
324 1 . . . 1 1
325 1 . . . 1 1
326 1 . . . 1 1
327 1 . . . 1 1
328 1 . . . 1 1
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330 1 . . . 1 1
331 1 . . . 1 1
332 1 . . . 1 1
333 1 . . . 1 1
334 1 . . . 1 1
335 1 . . . 1 1
336 1 . . . 1 1
337 1 . . . 1 1
338 1 . . . 1 1
339 1 . . . 1 1
340 1 . . . 1 1
341 1 . . . 1 1
342 1 . . . 1 1
343 1 . . . 1 1
344 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 ILE HA . 10 . HA 1 1
1 1 2 1 1 2 ILE MD . 10 . HD1# 1 1
1 1 2 1 1 2 ILE MG . 10 . HG2# 1 1
2 1 1 1 1 2 ILE HA . 10 . HA 1 1
2 1 2 1 1 2 ILE HB . 10 . HB 1 1
3 1 1 1 1 2 ILE HA . 10 . HA 1 1
3 1 2 1 1 2 ILE MD . 10 . HD1# 1 1
4 1 1 1 1 2 ILE HA . 10 . HA 1 1
4 1 2 1 1 2 ILE QG . 10 . HG1# 1 1
5 1 1 1 1 2 ILE HA . 10 . HA 1 1
5 1 2 1 1 2 ILE MG . 10 . HG2# 1 1
6 1 1 1 1 3 VAL HA . 11 . HA 1 1
6 1 2 1 1 3 VAL HB . 11 . HB 1 1
7 1 1 1 1 4 SER HA . 12 . HA 1 1
7 1 2 1 1 4 SER QB . 12 . HB# 1 1
8 1 1 1 1 5 CYS HA . 13 . HA 1 1
8 1 2 1 1 5 CYS HB3 . 13 . HB1 1 1
9 1 1 1 1 5 CYS HA . 13 . HA 1 1
9 1 2 1 1 5 CYS HB2 . 13 . HB2 1 1
10 1 1 1 1 6 ARG HA . 14 . HA 1 1
10 1 2 1 1 6 ARG QB . 14 . HB# 1 1
11 1 1 1 1 6 ARG HA . 14 . HA 1 1
11 1 2 1 1 6 ARG QD . 14 . HD# 1 1
12 1 1 1 1 6 ARG QB . 14 . HB# 1 1
12 1 2 1 1 6 ARG QD . 14 . HD# 1 1
13 1 1 1 1 6 ARG HA . 14 . HA 1 1
13 1 2 1 1 6 ARG QG . 14 . HG# 1 1
14 1 1 1 1 7 ILE QG . 15 . HG1# 1 1
14 1 2 1 1 7 ILE MG . 15 . HG2# 1 1
15 1 1 1 1 7 ILE HA . 15 . HA 1 1
15 1 2 1 1 7 ILE MG . 15 . HG2# 1 1
16 1 1 1 1 7 ILE HA . 15 . HA 1 1
16 1 2 1 1 7 ILE QG . 15 . HG1# 1 1
17 1 1 1 1 7 ILE HB . 15 . HB 1 1
17 1 2 1 1 7 ILE MG . 15 . HG2# 1 1
18 1 1 1 1 7 ILE HA . 15 . HA 1 1
18 1 2 1 1 7 ILE MD . 15 . HD1# 1 1
19 1 1 1 1 7 ILE HB . 15 . HB 1 1
19 1 2 1 1 7 ILE MD . 15 . HD1# 1 1
20 1 1 1 1 8 CYS HA . 16 . HA 1 1
20 1 2 1 1 8 CYS HB2 . 16 . HB2 1 1
21 1 1 1 1 8 CYS HA . 16 . HA 1 1
21 1 2 1 1 8 CYS HB3 . 16 . HB1 1 1
22 1 1 1 1 9 LYS HA . 17 . HA 1 1
22 1 2 1 1 9 LYS QD . 17 . HD# 1 1
23 1 1 1 1 9 LYS HA . 17 . HA 1 1
23 1 2 1 1 9 LYS HB3 . 17 . HB1 1 1
24 1 1 1 1 9 LYS HA . 17 . HA 1 1
24 1 2 1 1 9 LYS HB2 . 17 . HB2 1 1
25 1 1 1 1 9 LYS HA . 17 . HA 1 1
25 1 2 1 1 9 LYS QG . 17 . HG# 1 1
26 1 1 1 1 11 ASP HA . 19 . HA 1 1
26 1 2 1 1 11 ASP QB . 19 . HB# 1 1
27 1 1 1 1 12 HIS HA . 20 . HA 1 1
27 1 2 1 1 12 HIS HB3 . 20 . HB1 1 1
28 1 1 1 1 12 HIS HA . 20 . HA 1 1
28 1 2 1 1 12 HIS HB2 . 20 . HB2 1 1
29 1 1 1 1 13 TRP HA . 21 . HA 1 1
29 1 2 1 1 13 TRP HB3 . 21 . HB1 1 1
30 1 1 1 1 13 TRP HA . 21 . HA 1 1
30 1 2 1 1 13 TRP HB2 . 21 . HB2 1 1
31 1 1 1 1 14 THR HA . 22 . HA 1 1
31 1 2 1 1 14 THR MG . 22 . HG2# 1 1
32 1 1 1 1 14 THR HA . 22 . HA 1 1
32 1 2 1 1 14 THR HB . 22 . HB 1 1
33 1 1 1 1 14 THR HB . 22 . HB 1 1
33 1 2 1 1 14 THR MG . 22 . HG2# 1 1
34 1 1 1 1 5 CYS HA . 13 . HA 1 1
34 1 2 1 1 14 THR MG . 22 . HG2# 1 1
35 1 1 1 1 15 THR HA . 23 . HA 1 1
35 1 2 1 1 15 THR HB . 23 . HB 1 1
36 1 1 1 1 15 THR HB . 23 . HB 1 1
36 1 2 1 1 15 THR MG . 23 . HG2# 1 1
37 1 1 1 1 15 THR HA . 23 . HA 1 1
37 1 2 1 1 15 THR MG . 23 . HG2# 1 1
38 1 1 1 1 16 ARG HA . 24 . HA 1 1
38 1 2 1 1 16 ARG QG . 24 . HG# 1 1
39 1 1 1 1 16 ARG HA . 24 . HA 1 1
39 1 2 1 1 16 ARG HB3 . 24 . HB1 1 1
40 1 1 1 1 16 ARG HA . 24 . HA 1 1
40 1 2 1 1 16 ARG HB2 . 24 . HB2 1 1
41 1 1 1 1 16 ARG HB2 . 24 . HB2 1 1
41 1 2 1 1 16 ARG QD . 24 . HD# 1 1
42 1 1 1 1 16 ARG HA . 24 . HA 1 1
42 1 2 1 1 16 ARG QD . 24 . HD# 1 1
43 1 1 1 1 16 ARG HB3 . 24 . HB1 1 1
43 1 2 1 1 16 ARG QD . 24 . HD# 1 1
44 1 1 1 1 17 CYS HA . 25 . HA 1 1
44 1 2 1 1 17 CYS HB3 . 25 . HB1 1 1
45 1 1 1 1 17 CYS HA . 25 . HA 1 1
45 1 2 1 1 17 CYS HB2 . 25 . HB2 1 1
46 1 1 1 1 17 CYS HA . 25 . HA 1 1
46 1 2 1 1 18 PRO QD . 26 . HD# 1 1
47 1 1 1 1 18 PRO HA . 26 . HA 1 1
47 1 2 1 1 18 PRO QB . 26 . HB# 1 1
48 1 1 1 1 18 PRO HA . 26 . HA 1 1
48 1 2 1 1 18 PRO QB . 26 . HB# 1 1
48 1 2 1 1 18 PRO QG . 26 . HG# 1 1
49 1 1 1 1 18 PRO HA . 26 . HA 1 1
49 1 2 1 1 18 PRO QG . 26 . HG# 1 1
50 1 1 1 1 18 PRO HA . 26 . HA 1 1
50 1 2 1 1 18 PRO QD . 26 . HD# 1 1
51 1 1 1 1 19 TYR HA . 27 . HA 1 1
51 1 2 1 1 19 TYR HB2 . 27 . HB2 1 1
52 1 1 1 1 19 TYR HA . 27 . HA 1 1
52 1 2 1 1 19 TYR HB3 . 27 . HB1 1 1
53 1 1 1 1 20 LYS HA . 28 . HA 1 1
53 1 2 1 1 20 LYS QG . 28 . HG# 1 1
54 1 1 1 1 21 ASP HA . 29 . HA 1 1
54 1 2 1 1 21 ASP HB2 . 29 . HB2 1 1
55 1 1 1 1 21 ASP HA . 29 . HA 1 1
55 1 2 1 1 21 ASP HB3 . 29 . HB1 1 1
56 1 1 1 1 22 THR HA . 30 . HA 1 1
56 1 2 1 1 22 THR MG . 30 . HG2# 1 1
57 1 1 1 1 23 LEU HA . 31 . HA 1 1
57 1 2 1 1 23 LEU MD2 . 31 . HD2# 1 1
58 1 1 1 1 4 SER HA . 12 . HA 1 1
58 1 2 1 1 5 CYS HB3 . 13 . HB1 1 1
59 1 1 1 1 4 SER HA . 12 . HA 1 1
59 1 2 1 1 5 CYS HB2 . 13 . HB2 1 1
60 1 1 1 1 7 ILE MG . 15 . HG2# 1 1
60 1 2 1 1 19 TYR HB3 . 27 . HB1 1 1
61 1 1 1 1 7 ILE MG . 15 . HG2# 1 1
61 1 2 1 1 8 CYS HB2 . 16 . HB2 1 1
62 1 1 1 1 7 ILE MG . 15 . HG2# 1 1
62 1 2 1 1 8 CYS HB3 . 16 . HB1 1 1
63 1 1 1 1 7 ILE MG . 15 . HG2# 1 1
63 1 2 1 1 8 CYS HA . 16 . HA 1 1
64 1 1 1 1 8 CYS HA . 16 . HA 1 1
64 1 2 1 1 9 LYS QG . 17 . HG# 1 1
65 1 1 1 1 14 THR MG . 22 . HG2# 1 1
65 1 2 1 1 15 THR HA . 23 . HA 1 1
66 1 1 1 1 17 CYS HA . 25 . HA 1 1
66 1 2 1 1 18 PRO QG . 26 . HG# 1 1
67 1 1 1 1 19 TYR HB3 . 27 . HB1 1 1
67 1 2 1 1 20 LYS QD . 28 . HD# 1 1
68 1 1 1 1 2 ILE MG . 10 . HG2# 1 1
68 1 2 1 1 4 SER QB . 12 . HB# 1 1
69 1 1 1 1 12 HIS HB2 . 20 . HB2 1 1
69 1 2 1 1 16 ARG HB2 . 24 . HB2 1 1
70 1 1 1 1 12 HIS HB3 . 20 . HB1 1 1
70 1 2 1 1 16 ARG HB3 . 24 . HB1 1 1
71 1 1 1 1 12 HIS HB2 . 20 . HB2 1 1
71 1 2 1 1 16 ARG HB3 . 24 . HB1 1 1
71 1 2 1 1 16 ARG QG . 24 . HG# 1 1
72 1 1 1 1 13 TRP HB3 . 21 . HB1 1 1
72 1 2 1 1 15 THR MG . 23 . HG2# 1 1
73 1 1 1 1 13 TRP HB2 . 21 . HB2 1 1
73 1 2 1 1 16 ARG HB3 . 24 . HB1 1 1
73 1 2 1 1 16 ARG QG . 24 . HG# 1 1
74 1 1 1 1 13 TRP HB2 . 21 . HB2 1 1
74 1 2 1 1 16 ARG HB3 . 24 . HB1 1 1
75 1 1 1 1 13 TRP HB2 . 21 . HB2 1 1
75 1 2 1 1 16 ARG QG . 24 . HG# 1 1
76 1 1 1 1 13 TRP HB3 . 21 . HB1 1 1
76 1 2 1 1 16 ARG QG . 24 . HG# 1 1
77 1 1 1 1 14 THR MG . 22 . HG2# 1 1
77 1 2 1 1 17 CYS HB2 . 25 . HB2 1 1
78 1 1 1 1 14 THR HA . 22 . HA 1 1
78 1 2 1 1 17 CYS HB3 . 25 . HB1 1 1
79 1 1 1 1 14 THR HA . 22 . HA 1 1
79 1 2 1 1 17 CYS HB2 . 25 . HB2 1 1
80 1 1 1 1 14 THR MG . 22 . HG2# 1 1
80 1 2 1 1 17 CYS HB3 . 25 . HB1 1 1
81 1 1 1 1 17 CYS HB2 . 25 . HB2 1 1
81 1 2 1 1 20 LYS QB . 28 . HB# 1 1
82 1 1 1 1 17 CYS HB3 . 25 . HB1 1 1
82 1 2 1 1 20 LYS QD . 28 . HD# 1 1
83 1 1 1 1 17 CYS HB3 . 25 . HB1 1 1
83 1 2 1 1 20 LYS QB . 28 . HB# 1 1
84 1 1 1 1 17 CYS HB3 . 25 . HB1 1 1
84 1 2 1 1 20 LYS QG . 28 . HG# 1 1
85 1 1 1 1 19 TYR HA . 27 . HA 1 1
85 1 2 1 1 22 THR MG . 30 . HG2# 1 1
86 1 1 1 1 3 VAL MG2 . 11 . HG2# 1 1
86 1 2 1 1 12 HIS HA . 20 . HA 1 1
87 1 1 1 1 3 VAL MG1 . 11 . HG1# 1 1
87 1 2 1 1 12 HIS HA . 20 . HA 1 1
88 1 1 1 1 3 VAL MG2 . 11 . HG2# 1 1
88 1 2 1 1 13 TRP HA . 21 . HA 1 1
89 1 1 1 1 3 VAL MG1 . 11 . HG1# 1 1
89 1 2 1 1 13 TRP HA . 21 . HA 1 1
90 1 1 1 1 5 CYS HB2 . 13 . HB2 1 1
90 1 2 1 1 14 THR HA . 22 . HA 1 1
91 1 1 1 1 5 CYS HB3 . 13 . HB1 1 1
91 1 2 1 1 14 THR HA . 22 . HA 1 1
92 1 1 1 1 5 CYS HB3 . 13 . HB1 1 1
92 1 2 1 1 10 GLY QA . 18 . HA# 1 1
93 1 1 1 1 5 CYS HA . 13 . HA 1 1
93 1 2 1 1 14 THR HA . 22 . HA 1 1
94 1 1 1 1 5 CYS HA . 13 . HA 1 1
94 1 2 1 1 13 TRP HA . 21 . HA 1 1
95 1 1 1 1 5 CYS HB2 . 13 . HB2 1 1
95 1 2 1 1 10 GLY QA . 18 . HA# 1 1
96 1 1 1 1 6 ARG QB . 14 . HB# 1 1
96 1 2 1 1 14 THR MG . 22 . HG2# 1 1
97 1 1 1 1 6 ARG QD . 14 . HD# 1 1
97 1 2 1 1 14 THR MG . 22 . HG2# 1 1
98 1 1 1 1 7 ILE MD . 15 . HD1# 1 1
98 1 2 1 1 17 CYS HB3 . 25 . HB1 1 1
99 1 1 1 1 7 ILE MG . 15 . HG2# 1 1
99 1 2 1 1 19 TYR HB2 . 27 . HB2 1 1
100 1 1 1 1 7 ILE MD . 15 . HD1# 1 1
100 1 2 1 1 14 THR MG . 22 . HG2# 1 1
101 1 1 1 1 7 ILE MD . 15 . HD1# 1 1
101 1 2 1 1 14 THR HA . 22 . HA 1 1
102 1 1 1 1 7 ILE MD . 15 . HD1# 1 1
102 1 2 1 1 17 CYS HB2 . 25 . HB2 1 1
103 1 1 1 1 7 ILE MG . 15 . HG2# 1 1
103 1 2 1 1 20 LYS HA . 28 . HA 1 1
104 1 1 1 1 7 ILE HA . 15 . HA 1 1
104 1 2 1 1 14 THR MG . 22 . HG2# 1 1
105 1 1 1 1 7 ILE MD . 15 . HD1# 1 1
105 1 2 1 1 20 LYS HA . 28 . HA 1 1
106 1 1 1 1 7 ILE HB . 15 . HB 1 1
106 1 2 1 1 14 THR MG . 22 . HG2# 1 1
107 1 1 1 1 7 ILE MG . 15 . HG2# 1 1
107 1 2 1 1 14 THR MG . 22 . HG2# 1 1
108 1 1 1 1 8 CYS HB3 . 16 . HB1 1 1
108 1 2 1 1 19 TYR HB2 . 27 . HB2 1 1
109 1 1 1 1 7 ILE HB . 15 . HB 1 1
109 1 2 1 1 8 CYS HA . 16 . HA 1 1
110 1 1 1 1 7 ILE HB . 15 . HB 1 1
110 1 2 1 1 17 CYS HB2 . 25 . HB2 1 1
111 1 1 1 1 7 ILE HB . 15 . HB 1 1
111 1 2 1 1 17 CYS HB3 . 25 . HB1 1 1
112 1 1 1 1 7 ILE HB . 15 . HB 1 1
112 1 2 1 1 8 CYS HB2 . 16 . HB2 1 1
113 1 1 1 1 4 SER QB . 12 . HB# 1 1
113 1 2 1 1 9 LYS HA . 17 . HA 1 1
114 1 1 1 1 7 ILE MG . 15 . HG2# 1 1
114 1 2 1 1 22 THR HB . 30 . HB 1 1
115 1 1 1 1 7 ILE HA . 15 . HA 1 1
115 1 2 1 1 8 CYS HA . 16 . HA 1 1
116 1 1 1 1 6 ARG QB . 14 . HB# 1 1
116 1 2 1 1 7 ILE HA . 15 . HA 1 1
117 1 1 1 1 7 ILE QG . 15 . HG1# 1 1
117 1 2 1 1 14 THR MG . 22 . HG2# 1 1
118 1 1 1 1 3 VAL HA . 11 . HA 1 1
118 1 2 1 1 4 SER HA . 12 . HA 1 1
119 1 1 1 1 2 ILE H . 10 . HN 1 1
119 1 2 1 1 2 ILE HA . 10 . HA 1 1
120 1 1 1 1 2 ILE H . 10 . HN 1 1
120 1 2 1 1 2 ILE HB . 10 . HB 1 1
121 1 1 1 1 3 VAL H . 11 . HN 1 1
121 1 2 1 1 3 VAL HA . 11 . HA 1 1
122 1 1 1 1 3 VAL H . 11 . HN 1 1
122 1 2 1 1 3 VAL MG2 . 11 . HG2# 1 1
123 1 1 1 1 3 VAL H . 11 . HN 1 1
123 1 2 1 1 3 VAL HB . 11 . HB 1 1
124 1 1 1 1 3 VAL H . 11 . HN 1 1
124 1 2 1 1 3 VAL MG1 . 11 . HG1# 1 1
125 1 1 1 1 4 SER H . 12 . HN 1 1
125 1 2 1 1 4 SER HA . 12 . HA 1 1
126 1 1 1 1 5 CYS H . 13 . HN 1 1
126 1 2 1 1 5 CYS HB2 . 13 . HB2 1 1
127 1 1 1 1 5 CYS H . 13 . HN 1 1
127 1 2 1 1 5 CYS HB3 . 13 . HB1 1 1
128 1 1 1 1 5 CYS H . 13 . HN 1 1
128 1 2 1 1 5 CYS HA . 13 . HA 1 1
129 1 1 1 1 6 ARG H . 14 . HN 1 1
129 1 2 1 1 6 ARG QB . 14 . HB# 1 1
130 1 1 1 1 6 ARG H . 14 . HN 1 1
130 1 2 1 1 6 ARG HA . 14 . HA 1 1
131 1 1 1 1 6 ARG H . 14 . HN 1 1
131 1 2 1 1 6 ARG QD . 14 . HD# 1 1
132 1 1 1 1 7 ILE H . 15 . HN 1 1
132 1 2 1 1 7 ILE QG . 15 . HG1# 1 1
133 1 1 1 1 7 ILE H . 15 . HN 1 1
133 1 2 1 1 7 ILE HA . 15 . HA 1 1
134 1 1 1 1 7 ILE H . 15 . HN 1 1
134 1 2 1 1 7 ILE MG . 15 . HG2# 1 1
135 1 1 1 1 8 CYS H . 16 . HN 1 1
135 1 2 1 1 8 CYS HA . 16 . HA 1 1
136 1 1 1 1 8 CYS H . 16 . HN 1 1
136 1 2 1 1 8 CYS HB2 . 16 . HB2 1 1
137 1 1 1 1 8 CYS H . 16 . HN 1 1
137 1 2 1 1 8 CYS HB3 . 16 . HB1 1 1
138 1 1 1 1 9 LYS H . 17 . HN 1 1
138 1 2 1 1 9 LYS HB2 . 17 . HB2 1 1
139 1 1 1 1 9 LYS H . 17 . HN 1 1
139 1 2 1 1 9 LYS QD . 17 . HD# 1 1
140 1 1 1 1 9 LYS H . 17 . HN 1 1
140 1 2 1 1 9 LYS QG . 17 . HG# 1 1
141 1 1 1 1 9 LYS H . 17 . HN 1 1
141 1 2 1 1 9 LYS HB3 . 17 . HB1 1 1
142 1 1 1 1 9 LYS H . 17 . HN 1 1
142 1 2 1 1 9 LYS HA . 17 . HA 1 1
143 1 1 1 1 10 GLY H . 18 . HN 1 1
143 1 2 1 1 10 GLY QA . 18 . HA# 1 1
144 1 1 1 1 11 ASP H . 19 . HN 1 1
144 1 2 1 1 11 ASP HB3 . 19 . HB1 1 1
145 1 1 1 1 11 ASP H . 19 . HN 1 1
145 1 2 1 1 11 ASP HA . 19 . HA 1 1
146 1 1 1 1 12 HIS H . 20 . HN 1 1
146 1 2 1 1 12 HIS HA . 20 . HA 1 1
147 1 1 1 1 12 HIS H . 20 . HN 1 1
147 1 2 1 1 12 HIS HB2 . 20 . HB2 1 1
148 1 1 1 1 12 HIS H . 20 . HN 1 1
148 1 2 1 1 12 HIS HB3 . 20 . HB1 1 1
149 1 1 1 1 12 HIS H . 20 . HN 1 1
149 1 2 1 1 12 HIS HD2 . 20 . HD2 1 1
150 1 1 1 1 13 TRP H . 21 . HN 1 1
150 1 2 1 1 13 TRP HA . 21 . HA 1 1
151 1 1 1 1 13 TRP H . 21 . HN 1 1
151 1 2 1 1 13 TRP HB3 . 21 . HB1 1 1
152 1 1 1 1 15 THR H . 23 . HN 1 1
152 1 2 1 1 15 THR HA . 23 . HA 1 1
153 1 1 1 1 15 THR H . 23 . HN 1 1
153 1 2 1 1 15 THR MG . 23 . HG2# 1 1
154 1 1 1 1 16 ARG H . 24 . HN 1 1
154 1 2 1 1 16 ARG HA . 24 . HA 1 1
155 1 1 1 1 16 ARG H . 24 . HN 1 1
155 1 2 1 1 16 ARG QD . 24 . HD# 1 1
156 1 1 1 1 16 ARG H . 24 . HN 1 1
156 1 2 1 1 16 ARG HB2 . 24 . HB2 1 1
157 1 1 1 1 17 CYS H . 25 . HN 1 1
157 1 2 1 1 17 CYS HB2 . 25 . HB2 1 1
158 1 1 1 1 17 CYS H . 25 . HN 1 1
158 1 2 1 1 17 CYS HB3 . 25 . HB1 1 1
159 1 1 1 1 19 TYR H . 27 . HN 1 1
159 1 2 1 1 19 TYR HB3 . 27 . HB1 1 1
160 1 1 1 1 19 TYR H . 27 . HN 1 1
160 1 2 1 1 19 TYR HB2 . 27 . HB2 1 1
161 1 1 1 1 19 TYR H . 27 . HN 1 1
161 1 2 1 1 19 TYR QD . 27 . HD1 1 1
162 1 1 1 1 20 LYS H . 28 . HN 1 1
162 1 2 1 1 20 LYS QG . 28 . HG# 1 1
163 1 1 1 1 20 LYS H . 28 . HN 1 1
163 1 2 1 1 20 LYS QB . 28 . HB# 1 1
164 1 1 1 1 20 LYS H . 28 . HN 1 1
164 1 2 1 1 20 LYS HA . 28 . HA 1 1
165 1 1 1 1 21 ASP H . 29 . HN 1 1
165 1 2 1 1 21 ASP HA . 29 . HA 1 1
166 1 1 1 1 21 ASP H . 29 . HN 1 1
166 1 2 1 1 21 ASP HB2 . 29 . HB2 1 1
167 1 1 1 1 21 ASP H . 29 . HN 1 1
167 1 2 1 1 21 ASP HB3 . 29 . HB1 1 1
168 1 1 1 1 22 THR H . 30 . HN 1 1
168 1 2 1 1 22 THR HA . 30 . HA 1 1
169 1 1 1 1 22 THR H . 30 . HN 1 1
169 1 2 1 1 22 THR MG . 30 . HG2# 1 1
170 1 1 1 1 2 ILE HA . 10 . HA 1 1
170 1 2 1 1 3 VAL H . 11 . HN 1 1
171 1 1 1 1 2 ILE MD . 10 . HD1# 1 1
171 1 1 1 1 2 ILE MG . 10 . HG2# 1 1
171 1 2 1 1 3 VAL H . 11 . HN 1 1
172 1 1 1 1 2 ILE QG . 10 . HG1# 1 1
172 1 2 1 1 3 VAL H . 11 . HN 1 1
173 1 1 1 1 2 ILE H . 10 . HN 1 1
173 1 2 1 1 3 VAL HA . 11 . HA 1 1
174 1 1 1 1 2 ILE H . 10 . HN 1 1
174 1 2 1 1 3 VAL MG1 . 11 . HG1# 1 1
175 1 1 1 1 2 ILE H . 10 . HN 1 1
175 1 2 1 1 3 VAL H . 11 . HN 1 1
176 1 1 1 1 3 VAL HB . 11 . HB 1 1
176 1 2 1 1 4 SER H . 12 . HN 1 1
177 1 1 1 1 3 VAL MG2 . 11 . HG2# 1 1
177 1 2 1 1 4 SER H . 12 . HN 1 1
178 1 1 1 1 3 VAL MG1 . 11 . HG1# 1 1
178 1 2 1 1 4 SER H . 12 . HN 1 1
179 1 1 1 1 3 VAL H . 11 . HN 1 1
179 1 2 1 1 4 SER H . 12 . HN 1 1
180 1 1 1 1 3 VAL HA . 11 . HA 1 1
180 1 2 1 1 4 SER H . 12 . HN 1 1
181 1 1 1 1 4 SER H . 12 . HN 1 1
181 1 2 1 1 5 CYS H . 13 . HN 1 1
182 1 1 1 1 4 SER HA . 12 . HA 1 1
182 1 2 1 1 5 CYS H . 13 . HN 1 1
183 1 1 1 1 4 SER QB . 12 . HB# 1 1
183 1 2 1 1 5 CYS H . 13 . HN 1 1
184 1 1 1 1 5 CYS H . 13 . HN 1 1
184 1 2 1 1 9 LYS H . 17 . HN 1 1
185 1 1 1 1 5 CYS HA . 13 . HA 1 1
185 1 2 1 1 6 ARG H . 14 . HN 1 1
186 1 1 1 1 5 CYS H . 13 . HN 1 1
186 1 2 1 1 6 ARG H . 14 . HN 1 1
187 1 1 1 1 5 CYS HB3 . 13 . HB1 1 1
187 1 2 1 1 6 ARG H . 14 . HN 1 1
188 1 1 1 1 5 CYS HB2 . 13 . HB2 1 1
188 1 2 1 1 6 ARG H . 14 . HN 1 1
189 1 1 1 1 5 CYS H . 13 . HN 1 1
189 1 2 1 1 6 ARG HA . 14 . HA 1 1
190 1 1 1 1 6 ARG H . 14 . HN 1 1
190 1 2 1 1 7 ILE HA . 15 . HA 1 1
191 1 1 1 1 6 ARG H . 14 . HN 1 1
191 1 2 1 1 7 ILE H . 15 . HN 1 1
192 1 1 1 1 6 ARG HA . 14 . HA 1 1
192 1 2 1 1 7 ILE H . 15 . HN 1 1
193 1 1 1 1 6 ARG H . 14 . HN 1 1
193 1 2 1 1 7 ILE MD . 15 . HD1# 1 1
194 1 1 1 1 6 ARG H . 14 . HN 1 1
194 1 2 1 1 7 ILE MG . 15 . HG2# 1 1
195 1 1 1 1 6 ARG H . 14 . HN 1 1
195 1 2 1 1 7 ILE QG . 15 . HG1# 1 1
196 1 1 1 1 7 ILE MG . 15 . HG2# 1 1
196 1 2 1 1 8 CYS H . 16 . HN 1 1
197 1 1 1 1 7 ILE MD . 15 . HD1# 1 1
197 1 2 1 1 8 CYS H . 16 . HN 1 1
198 1 1 1 1 7 ILE H . 15 . HN 1 1
198 1 2 1 1 8 CYS HA . 16 . HA 1 1
199 1 1 1 1 7 ILE H . 15 . HN 1 1
199 1 2 1 1 8 CYS H . 16 . HN 1 1
200 1 1 1 1 7 ILE HA . 15 . HA 1 1
200 1 2 1 1 8 CYS H . 16 . HN 1 1
201 1 1 1 1 8 CYS H . 16 . HN 1 1
201 1 2 1 1 9 LYS H . 17 . HN 1 1
202 1 1 1 1 8 CYS H . 16 . HN 1 1
202 1 2 1 1 9 LYS HA . 17 . HA 1 1
203 1 1 1 1 8 CYS HA . 16 . HA 1 1
203 1 2 1 1 9 LYS H . 17 . HN 1 1
204 1 1 1 1 8 CYS HB2 . 16 . HB2 1 1
204 1 2 1 1 9 LYS H . 17 . HN 1 1
205 1 1 1 1 9 LYS H . 17 . HN 1 1
205 1 2 1 1 10 GLY H . 18 . HN 1 1
206 1 1 1 1 9 LYS HB2 . 17 . HB2 1 1
206 1 2 1 1 10 GLY H . 18 . HN 1 1
207 1 1 1 1 9 LYS HA . 17 . HA 1 1
207 1 2 1 1 10 GLY H . 18 . HN 1 1
208 1 1 1 1 9 LYS HB3 . 17 . HB1 1 1
208 1 2 1 1 10 GLY H . 18 . HN 1 1
209 1 1 1 1 10 GLY H . 18 . HN 1 1
209 1 2 1 1 11 ASP H . 19 . HN 1 1
210 1 1 1 1 10 GLY QA . 18 . HA# 1 1
210 1 2 1 1 11 ASP H . 19 . HN 1 1
211 1 1 1 1 11 ASP H . 19 . HN 1 1
211 1 2 1 1 12 HIS HE1 . 20 . HE1 1 1
212 1 1 1 1 11 ASP H . 19 . HN 1 1
212 1 2 1 1 12 HIS H . 20 . HN 1 1
213 1 1 1 1 12 HIS H . 20 . HN 1 1
213 1 2 1 1 13 TRP H . 21 . HN 1 1
214 1 1 1 1 11 ASP HA . 19 . HA 1 1
214 1 2 1 1 12 HIS H . 20 . HN 1 1
215 1 1 1 1 12 HIS HA . 20 . HA 1 1
215 1 2 1 1 13 TRP H . 21 . HN 1 1
216 1 1 1 1 12 HIS HB3 . 20 . HB1 1 1
216 1 2 1 1 13 TRP H . 21 . HN 1 1
217 1 1 1 1 12 HIS HB2 . 20 . HB2 1 1
217 1 2 1 1 13 TRP H . 21 . HN 1 1
218 1 1 1 1 13 TRP HA . 21 . HA 1 1
218 1 2 1 1 14 THR H . 22 . HN 1 1
219 1 1 1 1 13 TRP H . 21 . HN 1 1
219 1 2 1 1 14 THR H . 22 . HN 1 1
220 1 1 1 1 14 THR H . 22 . HN 1 1
220 1 2 1 1 15 THR H . 23 . HN 1 1
221 1 1 1 1 14 THR MG . 22 . HG2# 1 1
221 1 2 1 1 15 THR H . 23 . HN 1 1
222 1 1 1 1 14 THR HA . 22 . HA 1 1
222 1 2 1 1 15 THR H . 23 . HN 1 1
223 1 1 1 1 15 THR HA . 23 . HA 1 1
223 1 2 1 1 16 ARG H . 24 . HN 1 1
224 1 1 1 1 15 THR H . 23 . HN 1 1
224 1 2 1 1 16 ARG H . 24 . HN 1 1
225 1 1 1 1 15 THR MG . 23 . HG2# 1 1
225 1 2 1 1 16 ARG H . 24 . HN 1 1
226 1 1 1 1 16 ARG HA . 24 . HA 1 1
226 1 2 1 1 17 CYS H . 25 . HN 1 1
227 1 1 1 1 16 ARG H . 24 . HN 1 1
227 1 2 1 1 17 CYS HB2 . 25 . HB2 1 1
228 1 1 1 1 16 ARG H . 24 . HN 1 1
228 1 2 1 1 17 CYS H . 25 . HN 1 1
229 1 1 1 1 16 ARG HB3 . 24 . HB1 1 1
229 1 1 1 1 16 ARG QG . 24 . HG# 1 1
229 1 2 1 1 17 CYS H . 25 . HN 1 1
230 1 1 1 1 18 PRO QD . 26 . HD# 1 1
230 1 2 1 1 19 TYR H . 27 . HN 1 1
231 1 1 1 1 18 PRO HA . 26 . HA 1 1
231 1 2 1 1 19 TYR H . 27 . HN 1 1
232 1 1 1 1 18 PRO QB . 26 . HB# 1 1
232 1 1 1 1 18 PRO QG . 26 . HG# 1 1
232 1 2 1 1 19 TYR H . 27 . HN 1 1
233 1 1 1 1 19 TYR H . 27 . HN 1 1
233 1 2 1 1 20 LYS H . 28 . HN 1 1
234 1 1 1 1 19 TYR HB3 . 27 . HB1 1 1
234 1 2 1 1 20 LYS H . 28 . HN 1 1
235 1 1 1 1 19 TYR HA . 27 . HA 1 1
235 1 2 1 1 20 LYS H . 28 . HN 1 1
236 1 1 1 1 19 TYR H . 27 . HN 1 1
236 1 2 1 1 20 LYS HA . 28 . HA 1 1
237 1 1 1 1 19 TYR QD . 27 . HD1 1 1
237 1 2 1 1 20 LYS H . 28 . HN 1 1
238 1 1 1 1 20 LYS H . 28 . HN 1 1
238 1 2 1 1 21 ASP H . 29 . HN 1 1
239 1 1 1 1 20 LYS HA . 28 . HA 1 1
239 1 2 1 1 21 ASP H . 29 . HN 1 1
240 1 1 1 1 20 LYS QG . 28 . HG# 1 1
240 1 2 1 1 21 ASP H . 29 . HN 1 1
241 1 1 1 1 20 LYS QD . 28 . HD# 1 1
241 1 2 1 1 21 ASP H . 29 . HN 1 1
242 1 1 1 1 20 LYS QB . 28 . HB# 1 1
242 1 2 1 1 21 ASP H . 29 . HN 1 1
243 1 1 1 1 21 ASP HA . 29 . HA 1 1
243 1 2 1 1 22 THR H . 30 . HN 1 1
244 1 1 1 1 21 ASP HB2 . 29 . HB2 1 1
244 1 2 1 1 22 THR H . 30 . HN 1 1
245 1 1 1 1 21 ASP HB3 . 29 . HB1 1 1
245 1 2 1 1 22 THR H . 30 . HN 1 1
246 1 1 1 1 21 ASP H . 29 . HN 1 1
246 1 2 1 1 22 THR H . 30 . HN 1 1
247 1 1 1 1 21 ASP H . 29 . HN 1 1
247 1 2 1 1 22 THR HA . 30 . HA 1 1
248 1 1 1 1 22 THR H . 30 . HN 1 1
248 1 2 1 1 23 LEU H . 31 . HN 1 1
249 1 1 1 1 2 ILE MD . 10 . HD1# 1 1
249 1 1 1 1 2 ILE MG . 10 . HG2# 1 1
249 1 2 1 1 4 SER H . 12 . HN 1 1
250 1 1 1 1 3 VAL HA . 11 . HA 1 1
250 1 2 1 1 5 CYS H . 13 . HN 1 1
251 1 1 1 1 3 VAL MG2 . 11 . HG2# 1 1
251 1 2 1 1 5 CYS H . 13 . HN 1 1
252 1 1 1 1 3 VAL MG1 . 11 . HG1# 1 1
252 1 2 1 1 5 CYS H . 13 . HN 1 1
253 1 1 1 1 5 CYS H . 13 . HN 1 1
253 1 2 1 1 8 CYS H . 16 . HN 1 1
254 1 1 1 1 5 CYS HA . 13 . HA 1 1
254 1 2 1 1 7 ILE H . 15 . HN 1 1
255 1 1 1 1 5 CYS HB3 . 13 . HB1 1 1
255 1 2 1 1 9 LYS H . 17 . HN 1 1
256 1 1 1 1 6 ARG HA . 14 . HA 1 1
256 1 2 1 1 8 CYS H . 16 . HN 1 1
257 1 1 1 1 6 ARG H . 14 . HN 1 1
257 1 2 1 1 9 LYS QG . 17 . HG# 1 1
258 1 1 1 1 6 ARG H . 14 . HN 1 1
258 1 2 1 1 8 CYS H . 16 . HN 1 1
259 1 1 1 1 6 ARG H . 14 . HN 1 1
259 1 2 1 1 9 LYS H . 17 . HN 1 1
260 1 1 1 1 7 ILE MG . 15 . HG2# 1 1
260 1 2 1 1 9 LYS H . 17 . HN 1 1
261 1 1 1 1 7 ILE MD . 15 . HD1# 1 1
261 1 2 1 1 9 LYS H . 17 . HN 1 1
262 1 1 1 1 7 ILE HA . 15 . HA 1 1
262 1 2 1 1 9 LYS H . 17 . HN 1 1
263 1 1 1 1 7 ILE H . 15 . HN 1 1
263 1 2 1 1 9 LYS QG . 17 . HG# 1 1
264 1 1 1 1 7 ILE H . 15 . HN 1 1
264 1 2 1 1 9 LYS H . 17 . HN 1 1
265 1 1 1 1 8 CYS HB2 . 16 . HB2 1 1
265 1 2 1 1 10 GLY H . 18 . HN 1 1
266 1 1 1 1 8 CYS H . 16 . HN 1 1
266 1 2 1 1 10 GLY QA . 18 . HA# 1 1
267 1 1 1 1 8 CYS H . 16 . HN 1 1
267 1 2 1 1 10 GLY H . 18 . HN 1 1
268 1 1 1 1 9 LYS HA . 17 . HA 1 1
268 1 2 1 1 12 HIS H . 20 . HN 1 1
269 1 1 1 1 10 GLY QA . 18 . HA# 1 1
269 1 2 1 1 12 HIS H . 20 . HN 1 1
270 1 1 1 1 13 TRP HB3 . 21 . HB1 1 1
270 1 2 1 1 16 ARG H . 24 . HN 1 1
271 1 1 1 1 13 TRP HB3 . 21 . HB1 1 1
271 1 2 1 1 15 THR H . 23 . HN 1 1
272 1 1 1 1 13 TRP H . 21 . HN 1 1
272 1 2 1 1 16 ARG H . 24 . HN 1 1
273 1 1 1 1 13 TRP HA . 21 . HA 1 1
273 1 2 1 1 16 ARG H . 24 . HN 1 1
274 1 1 1 1 13 TRP HB2 . 21 . HB2 1 1
274 1 2 1 1 16 ARG H . 24 . HN 1 1
275 1 1 1 1 13 TRP H . 21 . HN 1 1
275 1 2 1 1 16 ARG HB2 . 24 . HB2 1 1
276 1 1 1 1 13 TRP HB2 . 21 . HB2 1 1
276 1 2 1 1 15 THR H . 23 . HN 1 1
277 1 1 1 1 14 THR H . 22 . HN 1 1
277 1 2 1 1 16 ARG H . 24 . HN 1 1
278 1 1 1 1 14 THR HA . 22 . HA 1 1
278 1 2 1 1 16 ARG H . 24 . HN 1 1
279 1 1 1 1 14 THR HA . 22 . HA 1 1
279 1 2 1 1 17 CYS H . 25 . HN 1 1
280 1 1 1 1 17 CYS HB3 . 25 . HB1 1 1
280 1 2 1 1 20 LYS H . 28 . HN 1 1
281 1 1 1 1 20 LYS QG . 28 . HG# 1 1
281 1 2 1 1 22 THR H . 30 . HN 1 1
282 1 1 1 1 20 LYS QD . 28 . HD# 1 1
282 1 2 1 1 22 THR H . 30 . HN 1 1
283 1 1 1 1 20 LYS HA . 28 . HA 1 1
283 1 2 1 1 22 THR H . 30 . HN 1 1
284 1 1 1 1 3 VAL MG2 . 11 . HG2# 1 1
284 1 2 1 1 12 HIS H . 20 . HN 1 1
285 1 1 1 1 3 VAL MG1 . 11 . HG1# 1 1
285 1 2 1 1 12 HIS H . 20 . HN 1 1
286 1 1 1 1 3 VAL MG1 . 11 . HG1# 1 1
286 1 2 1 1 13 TRP H . 21 . HN 1 1
287 1 1 1 1 3 VAL MG2 . 11 . HG2# 1 1
287 1 2 1 1 13 TRP H . 21 . HN 1 1
288 1 1 1 1 5 CYS HB3 . 13 . HB1 1 1
288 1 2 1 1 10 GLY H . 18 . HN 1 1
289 1 1 1 1 5 CYS H . 13 . HN 1 1
289 1 2 1 1 11 ASP H . 19 . HN 1 1
290 1 1 1 1 5 CYS H . 13 . HN 1 1
290 1 2 1 1 12 HIS H . 20 . HN 1 1
291 1 1 1 1 5 CYS H . 13 . HN 1 1
291 1 2 1 1 10 GLY H . 18 . HN 1 1
292 1 1 1 1 5 CYS H . 13 . HN 1 1
292 1 2 1 1 12 HIS HD2 . 20 . HD2 1 1
293 1 1 1 1 6 ARG H . 14 . HN 1 1
293 1 2 1 1 17 CYS HB3 . 25 . HB1 1 1
294 1 1 1 1 6 ARG H . 14 . HN 1 1
294 1 2 1 1 14 THR MG . 22 . HG2# 1 1
295 1 1 1 1 6 ARG H . 14 . HN 1 1
295 1 2 1 1 14 THR HA . 22 . HA 1 1
296 1 1 1 1 7 ILE H . 15 . HN 1 1
296 1 2 1 1 14 THR HA . 22 . HA 1 1
297 1 1 1 1 7 ILE H . 15 . HN 1 1
297 1 2 1 1 14 THR MG . 22 . HG2# 1 1
298 1 1 1 1 7 ILE MD . 15 . HD1# 1 1
298 1 2 1 1 20 LYS H . 28 . HN 1 1
299 1 1 1 1 12 HIS HD2 . 20 . HD2 1 1
299 1 2 1 1 17 CYS H . 25 . HN 1 1
300 1 1 1 1 7 ILE MD . 15 . HD1# 1 1
300 1 2 1 1 17 CYS H . 25 . HN 1 1
301 1 1 1 1 15 THR H . 23 . HN 1 1
301 1 2 1 1 17 CYS H . 25 . HN 1 1
302 1 1 1 1 7 ILE MG . 15 . HG2# 1 1
302 1 2 1 1 19 TYR H . 27 . HN 1 1
303 1 1 1 1 8 CYS H . 16 . HN 1 1
303 1 2 1 1 9 LYS QG . 17 . HG# 1 1
304 1 1 1 1 8 CYS H . 16 . HN 1 1
304 1 2 1 1 9 LYS QD . 17 . HD# 1 1
305 1 1 1 1 8 CYS H . 16 . HN 1 1
305 1 2 1 1 9 LYS HB3 . 17 . HB1 1 1
306 1 1 1 1 8 CYS H . 16 . HN 1 1
306 1 2 1 1 9 LYS HB2 . 17 . HB2 1 1
307 1 1 1 1 13 TRP H . 21 . HN 1 1
307 1 2 1 1 16 ARG QG . 24 . HG# 1 1
308 1 1 1 1 9 LYS H . 17 . HN 1 1
308 1 2 1 1 10 GLY QA . 18 . HA# 1 1
309 1 1 1 1 5 CYS HB3 . 13 . HB1 1 1
309 1 2 1 1 12 HIS H . 20 . HN 1 1
310 1 1 1 1 5 CYS HB2 . 13 . HB2 1 1
310 1 2 1 1 12 HIS H . 20 . HN 1 1
311 1 1 1 1 12 HIS HB3 . 20 . HB1 1 1
311 1 2 1 1 12 HIS HD2 . 20 . HD2 1 1
312 1 1 1 1 12 HIS HB2 . 20 . HB2 1 1
312 1 2 1 1 12 HIS HD2 . 20 . HD2 1 1
313 1 1 1 1 13 TRP HB3 . 21 . HB1 1 1
313 1 2 1 1 13 TRP HE3 . 21 . HE3 1 1
314 1 1 1 1 13 TRP HB2 . 21 . HB2 1 1
314 1 2 1 1 13 TRP HE3 . 21 . HE3 1 1
315 1 1 1 1 13 TRP HB2 . 21 . HB2 1 1
315 1 2 1 1 13 TRP HD1 . 21 . HD1 1 1
316 1 1 1 1 13 TRP HB3 . 21 . HB1 1 1
316 1 2 1 1 13 TRP HD1 . 21 . HD1 1 1
317 1 1 1 1 13 TRP HA . 21 . HA 1 1
317 1 2 1 1 13 TRP HD1 . 21 . HD1 1 1
318 1 1 1 1 13 TRP HA . 21 . HA 1 1
318 1 2 1 1 13 TRP HE3 . 21 . HE3 1 1
319 1 1 1 1 19 TYR HA . 27 . HA 1 1
319 1 2 1 1 19 TYR QD . 27 . HD1 1 1
320 1 1 1 1 19 TYR HA . 27 . HA 1 1
320 1 2 1 1 19 TYR QE . 27 . HE1 1 1
321 1 1 1 1 19 TYR HB3 . 27 . HB1 1 1
321 1 2 1 1 19 TYR QD . 27 . HD1 1 1
322 1 1 1 1 19 TYR HB2 . 27 . HB2 1 1
322 1 2 1 1 19 TYR QD . 27 . HD1 1 1
323 1 1 1 1 18 PRO QG . 26 . HG# 1 1
323 1 2 1 1 19 TYR QE . 27 . HE1 1 1
324 1 1 1 1 18 PRO QD . 26 . HD# 1 1
324 1 2 1 1 19 TYR QD . 27 . HD1 1 1
325 1 1 1 1 18 PRO QB . 26 . HB# 1 1
325 1 2 1 1 19 TYR QD . 27 . HD1 1 1
326 1 1 1 1 18 PRO QB . 26 . HB# 1 1
326 1 2 1 1 19 TYR QE . 27 . HE1 1 1
327 1 1 1 1 10 GLY QA . 18 . HA# 1 1
327 1 2 1 1 12 HIS HE1 . 20 . HE1 1 1
328 1 1 1 1 5 CYS HB2 . 13 . HB2 1 1
328 1 2 1 1 12 HIS HD2 . 20 . HD2 1 1
329 1 1 1 1 5 CYS HB3 . 13 . HB1 1 1
329 1 2 1 1 12 HIS HD2 . 20 . HD2 1 1
330 1 1 1 1 7 ILE MG . 15 . HG2# 1 1
330 1 2 1 1 19 TYR QD . 27 . HD1 1 1
331 1 1 1 1 8 CYS HB2 . 16 . HB2 1 1
331 1 2 1 1 19 TYR HE2 . 27 . HE1 1 1
332 1 1 1 1 8 CYS HB2 . 16 . HB2 1 1
332 1 2 1 1 19 TYR QD . 27 . HD1 1 1
333 1 1 1 1 8 CYS HB3 . 16 . HB1 1 1
333 1 2 1 1 19 TYR QD . 27 . HD1 1 1
334 1 1 1 1 8 CYS HB3 . 16 . HB1 1 1
334 1 2 1 1 19 TYR QE . 27 . HE1 1 1
335 1 1 1 1 12 HIS HD2 . 20 . HD2 1 1
335 1 2 1 1 17 CYS HA . 25 . HA 1 1
336 1 1 1 1 12 HIS HD2 . 20 . HD2 1 1
336 1 2 1 1 18 PRO QD . 26 . HD# 1 1
337 1 1 1 1 12 HIS HE1 . 20 . HE1 1 1
337 1 2 1 1 18 PRO QD . 26 . HD# 1 1
338 1 1 1 1 12 HIS HD2 . 20 . HD2 1 1
338 1 2 1 1 17 CYS HB3 . 25 . HB1 1 1
339 1 1 1 1 12 HIS HD2 . 20 . HD2 1 1
339 1 2 1 1 17 CYS HB2 . 25 . HB2 1 1
340 1 1 1 1 12 HIS HA . 20 . HA 1 1
340 1 2 1 1 13 TRP HD1 . 21 . HD1 1 1
341 1 1 1 1 5 CYS HB2 . 13 . HB2 1 1
341 1 2 1 1 12 HIS HE1 . 20 . HE1 1 1
342 1 1 1 1 18 PRO QG . 26 . HG# 1 1
342 1 2 1 1 19 TYR QD . 27 . HD1 1 1
343 1 1 1 1 12 HIS HE1 . 20 . HE1 1 1
343 1 2 1 1 17 CYS HA . 25 . HA 1 1
344 1 1 1 1 12 HIS HA . 20 . HA 1 1
344 1 2 1 1 12 HIS HD2 . 20 . HD2 1 1
stop_
loop_
_Dist_constraint_value.Constraint_ID
_Dist_constraint_value.Tree_node_ID
_Dist_constraint_value.Source_experiment_ID
_Dist_constraint_value.Spectral_peak_ID
_Dist_constraint_value.Intensity_val
_Dist_constraint_value.Intensity_lower_val_err
_Dist_constraint_value.Intensity_upper_val_err
_Dist_constraint_value.Distance_val
_Dist_constraint_value.Distance_lower_bound_val
_Dist_constraint_value.Distance_upper_bound_val
_Dist_constraint_value.Entry_ID
_Dist_constraint_value.Distance_constraint_list_ID
1 1 . . . . . 2.9 1.8 4.0 1 1
2 1 . . . . . 2.9 1.8 4.0 1 1
3 1 . . . . . 3.65 1.8 5.5 1 1
4 1 . . . . . 3.65 1.8 5.5 1 1
5 1 . . . . . 2.9 1.8 4.0 1 1
6 1 . . . . . 2.9 1.8 4.0 1 1
7 1 . . . . . 2.4 1.8 3.0 1 1
8 1 . . . . . 2.4 1.8 3.0 1 1
9 1 . . . . . 2.4 1.8 3.0 1 1
10 1 . . . . . 2.4 1.8 3.0 1 1
11 1 . . . . . 3.65 1.8 5.5 1 1
12 1 . . . . . 2.9 1.8 4.0 1 1
13 1 . . . . . 3.65 1.8 5.5 1 1
14 1 . . . . . 2.9 1.8 4.0 1 1
15 1 . . . . . 2.9 1.8 4.0 1 1
16 1 . . . . . 2.9 1.8 4.0 1 1
17 1 . . . . . 2.4 1.8 3.0 1 1
18 1 . . . . . 3.65 1.8 5.5 1 1
19 1 . . . . . 2.9 1.8 4.0 1 1
20 1 . . . . . 2.4 1.8 3.0 1 1
21 1 . . . . . 2.4 1.8 3.0 1 1
22 1 . . . . . 3.65 1.8 5.5 1 1
23 1 . . . . . 2.4 1.8 3.0 1 1
24 1 . . . . . 2.4 1.8 3.0 1 1
25 1 . . . . . 2.9 1.8 4.0 1 1
26 1 . . . . . 2.4 1.8 3.0 1 1
27 1 . . . . . 2.4 1.8 3.0 1 1
28 1 . . . . . 2.4 1.8 3.0 1 1
29 1 . . . . . 2.4 1.8 3.0 1 1
30 1 . . . . . 2.9 1.8 4.0 1 1
31 1 . . . . . 2.9 1.8 4.0 1 1
32 1 . . . . . 2.9 1.8 4.0 1 1
33 1 . . . . . 2.4 1.8 3.0 1 1
34 1 . . . . . 3.65 1.8 5.5 1 1
35 1 . . . . . 2.4 1.8 3.0 1 1
36 1 . . . . . 2.4 1.8 3.0 1 1
37 1 . . . . . 2.4 1.8 3.0 1 1
38 1 . . . . . 3.65 1.8 4.0 1 1
39 1 . . . . . 2.9 1.8 3.0 1 1
40 1 . . . . . 2.9 1.8 3.0 1 1
41 1 . . . . . 3.65 1.8 5.5 1 1
42 1 . . . . . 3.65 1.8 5.5 1 1
43 1 . . . . . 3.65 1.8 5.5 1 1
44 1 . . . . . 2.9 1.8 3.0 1 1
45 1 . . . . . 2.9 1.8 3.0 1 1
46 1 . . . . . 2.9 1.8 3.0 1 1
47 1 . . . . . 2.4 1.8 3.0 1 1
48 1 . . . . . 2.4 1.8 3.0 1 1
49 1 . . . . . 3.65 1.8 5.5 1 1
50 1 . . . . . 3.65 1.8 5.5 1 1
51 1 . . . . . 2.9 1.8 4.0 1 1
52 1 . . . . . 2.9 1.8 3.0 1 1
53 1 . . . . . 3.65 1.8 5.5 1 1
54 1 . . . . . 2.9 1.8 3.0 1 1
55 1 . . . . . 2.9 1.8 4.0 1 1
56 1 . . . . . 2.9 1.8 4.0 1 1
57 1 . . . . . 3.65 1.8 4.0 1 1
58 1 . . . . . 3.65 1.8 5.5 1 1
59 1 . . . . . 3.65 1.8 5.5 1 1
60 1 . . . . . 3.65 1.8 5.5 1 1
61 1 . . . . . 3.65 1.8 5.5 1 1
62 1 . . . . . 3.65 1.8 5.5 1 1
63 1 . . . . . 3.65 1.8 5.5 1 1
64 1 . . . . . 3.65 1.8 5.5 1 1
65 1 . . . . . 3.65 1.8 5.5 1 1
66 1 . . . . . 3.65 1.8 5.5 1 1
67 1 . . . . . 3.65 1.8 5.5 1 1
68 1 . . . . . 3.65 1.8 5.5 1 1
69 1 . . . . . 3.65 1.8 5.5 1 1
70 1 . . . . . 3.65 1.8 5.5 1 1
71 1 . . . . . 3.65 1.8 5.5 1 1
72 1 . . . . . 3.65 1.8 5.5 1 1
73 1 . . . . . 3.65 1.8 5.5 1 1
74 1 . . . . . 3.65 1.8 5.5 1 1
75 1 . . . . . 3.65 1.8 5.5 1 1
76 1 . . . . . 3.65 1.8 5.5 1 1
77 1 . . . . . 3.65 1.8 5.5 1 1
78 1 . . . . . 3.65 1.8 5.5 1 1
79 1 . . . . . 3.65 1.8 5.5 1 1
80 1 . . . . . 3.65 1.8 5.5 1 1
81 1 . . . . . 3.65 1.8 5.5 1 1
82 1 . . . . . 3.65 1.8 5.5 1 1
83 1 . . . . . 3.65 1.8 5.5 1 1
84 1 . . . . . 3.65 1.8 5.5 1 1
85 1 . . . . . 3.65 1.8 5.5 1 1
86 1 . . . . . 3.65 1.8 5.5 1 1
87 1 . . . . . 3.65 1.8 5.5 1 1
88 1 . . . . . 3.65 1.8 5.5 1 1
89 1 . . . . . 3.65 1.8 5.5 1 1
90 1 . . . . . 3.65 1.8 5.5 1 1
91 1 . . . . . 3.65 1.8 5.5 1 1
92 1 . . . . . 3.65 1.8 5.5 1 1
93 1 . . . . . 3.65 1.8 5.5 1 1
94 1 . . . . . 3.65 1.8 5.5 1 1
95 1 . . . . . 3.65 1.8 5.5 1 1
96 1 . . . . . 3.65 1.8 4.0 1 1
97 1 . . . . . 3.65 1.8 5.5 1 1
98 1 . . . . . 3.65 1.8 5.5 1 1
99 1 . . . . . 3.65 1.8 5.5 1 1
100 1 . . . . . 2.9 1.8 4.0 1 1
101 1 . . . . . 3.65 1.8 5.5 1 1
102 1 . . . . . 3.65 1.8 5.5 1 1
103 1 . . . . . 3.65 1.8 5.5 1 1
104 1 . . . . . 3.65 1.8 5.5 1 1
105 1 . . . . . 2.9 1.8 4.0 1 1
106 1 . . . . . 3.65 1.8 5.5 1 1
107 1 . . . . . 3.65 1.8 5.5 1 1
108 1 . . . . . 3.65 1.8 5.5 1 1
109 1 . . . . . 3.65 1.8 5.5 1 1
110 1 . . . . . 3.65 1.8 5.5 1 1
111 1 . . . . . 3.65 1.8 5.5 1 1
112 1 . . . . . 3.65 1.8 5.5 1 1
113 1 . . . . . 3.65 1.8 5.5 1 1
114 1 . . . . . 3.65 1.8 5.5 1 1
115 1 . . . . . 3.65 1.8 5.5 1 1
116 1 . . . . . 3.65 1.8 5.5 1 1
117 1 . . . . . 3.65 1.8 5.5 1 1
118 1 . . . . . 3.65 1.8 5.5 1 1
119 1 . . . . . 2.9 1.8 4.0 1 1
120 1 . . . . . 2.4 1.8 3.0 1 1
121 1 . . . . . 2.4 1.8 3.0 1 1
122 1 . . . . . 3.65 1.8 5.5 1 1
123 1 . . . . . 2.4 1.8 3.0 1 1
124 1 . . . . . 2.4 1.8 3.0 1 1
125 1 . . . . . 2.9 1.8 4.0 1 1
126 1 . . . . . 2.4 1.8 3.0 1 1
127 1 . . . . . 2.4 1.8 3.0 1 1
128 1 . . . . . 2.4 1.8 3.0 1 1
129 1 . . . . . 2.4 1.8 3.0 1 1
130 1 . . . . . 2.4 1.8 3.0 1 1
131 1 . . . . . 3.65 1.8 5.5 1 1
132 1 . . . . . 2.9 1.8 4.0 1 1
133 1 . . . . . 2.4 1.8 3.0 1 1
134 1 . . . . . 3.65 1.8 5.5 1 1
135 1 . . . . . 2.9 1.8 4.0 1 1
136 1 . . . . . 2.9 1.8 4.0 1 1
137 1 . . . . . 2.4 1.8 3.0 1 1
138 1 . . . . . 2.9 1.8 4.0 1 1
139 1 . . . . . 3.65 1.8 5.5 1 1
140 1 . . . . . 2.4 1.8 3.0 1 1
141 1 . . . . . 2.9 1.8 4.0 1 1
142 1 . . . . . 2.4 1.8 3.0 1 1
143 1 . . . . . 2.4 1.8 3.0 1 1
144 1 . . . . . 2.4 1.8 3.0 1 1
145 1 . . . . . 2.4 1.8 3.0 1 1
146 1 . . . . . 2.9 1.8 4.0 1 1
147 1 . . . . . 3.65 1.8 5.5 1 1
148 1 . . . . . 3.65 1.8 5.5 1 1
149 1 . . . . . 3.65 1.8 5.5 1 1
150 1 . . . . . 2.9 1.8 4.0 1 1
151 1 . . . . . 2.9 1.8 4.0 1 1
152 1 . . . . . 2.9 1.8 4.0 1 1
153 1 . . . . . 2.9 1.8 4.0 1 1
154 1 . . . . . 2.4 1.8 3.0 1 1
155 1 . . . . . 3.65 1.8 5.5 1 1
156 1 . . . . . 2.9 1.8 4.0 1 1
157 1 . . . . . 2.9 1.8 4.0 1 1
158 1 . . . . . 2.9 1.8 4.0 1 1
159 1 . . . . . 3.65 1.8 5.5 1 1
160 1 . . . . . 2.9 1.8 4.0 1 1
161 1 . . . . . 3.65 1.8 5.5 1 1
162 1 . . . . . 2.4 1.8 3.0 1 1
163 1 . . . . . 2.4 1.8 3.0 1 1
164 1 . . . . . 2.4 1.8 3.0 1 1
165 1 . . . . . 2.4 1.8 3.0 1 1
166 1 . . . . . 2.4 1.8 3.0 1 1
167 1 . . . . . 2.4 1.8 3.0 1 1
168 1 . . . . . 2.9 1.8 4.0 1 1
169 1 . . . . . 2.9 1.8 4.0 1 1
170 1 . . . . . 2.4 1.8 3.0 1 1
171 1 . . . . . 2.9 1.8 4.0 1 1
172 1 . . . . . 3.65 1.8 5.5 1 1
173 1 . . . . . 3.65 1.8 5.5 1 1
174 1 . . . . . 3.65 1.8 5.5 1 1
175 1 . . . . . 2.9 1.8 4.0 1 1
176 1 . . . . . 2.9 1.8 4.0 1 1
177 1 . . . . . 3.65 1.8 5.5 1 1
178 1 . . . . . 3.65 1.8 5.5 1 1
179 1 . . . . . 3.65 1.8 5.5 1 1
180 1 . . . . . 2.4 1.8 3.0 1 1
181 1 . . . . . 3.65 1.8 5.5 1 1
182 1 . . . . . 2.4 1.8 3.0 1 1
183 1 . . . . . 2.4 1.8 3.0 1 1
184 1 . . . . . 3.65 1.8 4.0 1 1
185 1 . . . . . 2.4 1.8 3.0 1 1
186 1 . . . . . 3.65 1.8 5.5 1 1
187 1 . . . . . 3.65 1.8 5.5 1 1
188 1 . . . . . 2.9 1.8 4.0 1 1
189 1 . . . . . 3.65 1.8 5.5 1 1
190 1 . . . . . 3.65 1.8 5.5 1 1
191 1 . . . . . 2.4 1.8 3.0 1 1
192 1 . . . . . 2.9 1.8 4.0 1 1
193 1 . . . . . 3.65 1.8 5.5 1 1
194 1 . . . . . 3.65 1.8 5.5 1 1
195 1 . . . . . 3.65 1.8 5.5 1 1
196 1 . . . . . 2.9 1.8 4.0 1 1
197 1 . . . . . 3.65 1.8 5.5 1 1
198 1 . . . . . 3.65 1.8 5.5 1 1
199 1 . . . . . 2.4 1.8 3.0 1 1
200 1 . . . . . 3.65 1.8 5.5 1 1
201 1 . . . . . 2.4 1.8 3.0 1 1
202 1 . . . . . 2.9 1.8 4.0 1 1
203 1 . . . . . 2.9 1.8 4.0 1 1
204 1 . . . . . 3.65 1.8 5.5 1 1
205 1 . . . . . 2.4 1.8 3.0 1 1
206 1 . . . . . 3.65 1.8 5.5 1 1
207 1 . . . . . 2.9 1.8 4.0 1 1
208 1 . . . . . 3.65 1.8 5.5 1 1
209 1 . . . . . 3.65 1.8 5.5 1 1
210 1 . . . . . 2.4 1.8 3.0 1 1
211 1 . . . . . 3.65 1.8 5.5 1 1
212 1 . . . . . 3.65 1.8 5.5 1 1
213 1 . . . . . 3.65 1.8 4.0 1 1
214 1 . . . . . 2.4 1.8 3.0 1 1
215 1 . . . . . 2.4 1.8 3.0 1 1
216 1 . . . . . 2.9 1.8 4.0 1 1
217 1 . . . . . 2.4 1.8 3.0 1 1
218 1 . . . . . 2.9 1.8 4.0 1 1
219 1 . . . . . 3.65 1.8 5.5 1 1
220 1 . . . . . 3.65 1.8 5.5 1 1
221 1 . . . . . 3.65 1.8 5.5 1 1
222 1 . . . . . 3.65 1.8 5.5 1 1
223 1 . . . . . 2.9 1.8 4.0 1 1
224 1 . . . . . 2.9 1.8 4.0 1 1
225 1 . . . . . 3.65 1.8 5.5 1 1
226 1 . . . . . 3.65 1.8 5.5 1 1
227 1 . . . . . 3.65 1.8 5.5 1 1
228 1 . . . . . 2.4 1.8 3.0 1 1
229 1 . . . . . 3.65 1.8 5.5 1 1
230 1 . . . . . 2.9 1.8 4.0 1 1
231 1 . . . . . 3.65 1.8 5.5 1 1
232 1 . . . . . 3.65 1.8 5.5 1 1
233 1 . . . . . 2.4 1.8 3.0 1 1
234 1 . . . . . 3.65 1.8 5.5 1 1
235 1 . . . . . 2.4 1.8 3.0 1 1
236 1 . . . . . 3.65 1.8 5.5 1 1
237 1 . . . . . 3.65 1.8 5.5 1 1
238 1 . . . . . 2.4 1.8 3.0 1 1
239 1 . . . . . 2.4 1.8 3.0 1 1
240 1 . . . . . 2.9 1.8 4.0 1 1
241 1 . . . . . 3.65 1.8 5.5 1 1
242 1 . . . . . 2.9 1.8 4.0 1 1
243 1 . . . . . 2.4 1.8 3.0 1 1
244 1 . . . . . 3.65 1.8 5.5 1 1
245 1 . . . . . 2.9 1.8 4.0 1 1
246 1 . . . . . 2.4 1.8 3.0 1 1
247 1 . . . . . 3.65 1.8 5.5 1 1
248 1 . . . . . 2.4 1.8 3.0 1 1
249 1 . . . . . 3.65 1.8 5.5 1 1
250 1 . . . . . 3.65 1.8 5.5 1 1
251 1 . . . . . 3.65 1.8 5.5 1 1
252 1 . . . . . 3.65 1.8 5.5 1 1
253 1 . . . . . 3.65 1.8 5.5 1 1
254 1 . . . . . 3.65 1.8 5.5 1 1
255 1 . . . . . 2.4 1.8 3.0 1 1
256 1 . . . . . 3.65 1.8 5.5 1 1
257 1 . . . . . 3.65 1.8 5.5 1 1
258 1 . . . . . 3.65 1.8 5.5 1 1
259 1 . . . . . 3.65 1.8 5.5 1 1
260 1 . . . . . 3.65 1.8 5.5 1 1
261 1 . . . . . 3.65 1.8 5.5 1 1
262 1 . . . . . 3.65 1.8 5.5 1 1
263 1 . . . . . 3.65 1.8 5.5 1 1
264 1 . . . . . 3.65 1.8 4.0 1 1
265 1 . . . . . 3.65 1.8 5.5 1 1
266 1 . . . . . 3.65 1.8 5.5 1 1
267 1 . . . . . 3.65 1.8 5.5 1 1
268 1 . . . . . 3.65 1.8 5.5 1 1
269 1 . . . . . 3.65 1.8 5.5 1 1
270 1 . . . . . 2.9 1.8 4.0 1 1
271 1 . . . . . 2.9 1.8 4.0 1 1
272 1 . . . . . 3.65 1.8 5.5 1 1
273 1 . . . . . 3.65 1.8 5.5 1 1
274 1 . . . . . 2.9 1.8 4.0 1 1
275 1 . . . . . 3.65 1.8 5.5 1 1
276 1 . . . . . 3.65 1.8 5.5 1 1
277 1 . . . . . 3.65 1.8 5.5 1 1
278 1 . . . . . 3.65 1.8 5.5 1 1
279 1 . . . . . 3.65 1.8 5.5 1 1
280 1 . . . . . 2.9 1.8 4.0 1 1
281 1 . . . . . 3.65 1.8 5.5 1 1
282 1 . . . . . 3.65 1.8 5.5 1 1
283 1 . . . . . 3.65 1.8 5.5 1 1
284 1 . . . . . 3.65 1.8 5.5 1 1
285 1 . . . . . 3.65 1.8 5.5 1 1
286 1 . . . . . 3.65 1.8 5.5 1 1
287 1 . . . . . 3.65 1.8 5.5 1 1
288 1 . . . . . 2.4 1.8 3.0 1 1
289 1 . . . . . 3.65 1.8 5.5 1 1
290 1 . . . . . 3.65 1.8 4.0 1 1
291 1 . . . . . 2.9 1.8 4.0 1 1
292 1 . . . . . 3.65 1.8 5.5 1 1
293 1 . . . . . 3.65 1.8 5.5 1 1
294 1 . . . . . 2.9 1.8 4.0 1 1
295 1 . . . . . 3.65 1.8 5.5 1 1
296 1 . . . . . 3.65 1.8 5.5 1 1
297 1 . . . . . 2.9 1.8 4.0 1 1
298 1 . . . . . 3.65 1.8 5.5 1 1
299 1 . . . . . 3.65 1.8 5.5 1 1
300 1 . . . . . 3.65 1.8 5.5 1 1
301 1 . . . . . 3.65 1.8 5.5 1 1
302 1 . . . . . 3.65 1.8 5.5 1 1
303 1 . . . . . 3.65 1.8 5.5 1 1
304 1 . . . . . 3.65 1.8 5.5 1 1
305 1 . . . . . 3.65 1.8 5.5 1 1
306 1 . . . . . 3.65 1.8 5.5 1 1
307 1 . . . . . 3.65 1.8 5.5 1 1
308 1 . . . . . 3.65 1.8 5.5 1 1
309 1 . . . . . 3.65 1.8 5.5 1 1
310 1 . . . . . 3.65 1.8 5.5 1 1
311 1 . . . . . 3.65 1.8 5.5 1 1
312 1 . . . . . 3.65 1.8 5.5 1 1
313 1 . . . . . 3.65 1.8 5.5 1 1
314 1 . . . . . 3.65 1.8 5.5 1 1
315 1 . . . . . 3.65 1.8 5.5 1 1
316 1 . . . . . 3.65 1.8 5.5 1 1
317 1 . . . . . 2.9 1.8 4.0 1 1
318 1 . . . . . 2.9 1.8 4.0 1 1
319 1 . . . . . 2.9 1.8 4.0 1 1
320 1 . . . . . 3.65 1.8 5.5 1 1
321 1 . . . . . 2.9 1.8 4.0 1 1
322 1 . . . . . 2.9 1.8 4.0 1 1
323 1 . . . . . 3.65 1.8 5.5 1 1
324 1 . . . . . 3.65 1.8 5.5 1 1
325 1 . . . . . 3.65 1.8 5.5 1 1
326 1 . . . . . 3.65 1.8 5.5 1 1
327 1 . . . . . 3.65 1.8 4.0 1 1
328 1 . . . . . 2.9 1.8 4.0 1 1
329 1 . . . . . 2.9 1.8 4.0 1 1
330 1 . . . . . 3.65 1.8 5.5 1 1
331 1 . . . . . 3.65 1.8 5.5 1 1
332 1 . . . . . 2.9 1.8 4.0 1 1
333 1 . . . . . 2.9 1.8 4.0 1 1
334 1 . . . . . 3.65 1.8 5.5 1 1
335 1 . . . . . 2.9 1.8 4.0 1 1
336 1 . . . . . 3.65 1.8 5.5 1 1
337 1 . . . . . 3.65 1.8 4.0 1 1
338 1 . . . . . 3.65 1.8 5.5 1 1
339 1 . . . . . 3.65 1.8 5.5 1 1
340 1 . . . . . 3.65 1.8 5.5 1 1
341 1 . . . . . 3.65 1.8 5.5 1 1
342 1 . . . . . 3.65 1.8 5.5 1 1
343 1 . . . . . 3.65 1.8 5.5 1 1
344 1 . . . . . 3.65 1.8 5.5 1 1
stop_
save_
save_CNS/XPLOR_distance_constraints_3_1
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID 1
_Distance_constraint_list.ID 2
_Distance_constraint_list.Constraint_type "general distance"
_Distance_constraint_list.Constraint_file_ID .
_Distance_constraint_list.Block_ID .
loop_
_Dist_constraint_tree.Constraint_ID
_Dist_constraint_tree.Node_ID
_Dist_constraint_tree.Down_node_ID
_Dist_constraint_tree.Right_node_ID
_Dist_constraint_tree.Logic_operation
_Dist_constraint_tree.Entry_ID
_Dist_constraint_tree.Distance_constraint_list_ID
1 1 . . . 1 2
2 1 . . . 1 2
3 1 . . . 1 2
4 1 . . . 1 2
5 1 . . . 1 2
6 1 . . . 1 2
stop_
loop_
_Dist_constraint.Tree_node_member_constraint_ID
_Dist_constraint.Tree_node_member_node_ID
_Dist_constraint.Constraint_tree_node_member_ID
_Dist_constraint.Entity_assembly_ID
_Dist_constraint.Entity_ID
_Dist_constraint.Comp_index_ID
_Dist_constraint.Comp_ID
_Dist_constraint.Atom_ID
_Dist_constraint.Auth_asym_ID
_Dist_constraint.Auth_seq_ID
_Dist_constraint.Auth_comp_ID
_Dist_constraint.Auth_atom_ID
_Dist_constraint.Entry_ID
_Dist_constraint.Distance_constraint_list_ID
1 1 1 1 1 8 CYS SG . 16 . SG 1 2
1 1 2 1 1 17 CYS SG . 25 . SG 1 2
2 1 1 1 1 5 CYS SG . 13 . SG 1 2
2 1 2 1 1 8 CYS SG . 16 . SG 1 2
3 1 1 1 1 5 CYS SG . 13 . SG 1 2
3 1 2 1 1 17 CYS SG . 25 . SG 1 2
4 1 1 1 1 8 CYS SG . 16 . SG 1 2
4 1 2 1 1 12 HIS NE2 . 20 . NE2 1 2
5 1 1 1 1 5 CYS SG . 13 . SG 1 2
5 1 2 1 1 12 HIS NE2 . 20 . NE2 1 2
6 1 1 1 1 12 HIS NE2 . 20 . NE2 1 2
6 1 2 1 1 17 CYS SG . 25 . SG 1 2
stop_
loop_
_Dist_constraint_value.Constraint_ID
_Dist_constraint_value.Tree_node_ID
_Dist_constraint_value.Source_experiment_ID
_Dist_constraint_value.Spectral_peak_ID
_Dist_constraint_value.Intensity_val
_Dist_constraint_value.Intensity_lower_val_err
_Dist_constraint_value.Intensity_upper_val_err
_Dist_constraint_value.Distance_val
_Dist_constraint_value.Distance_lower_bound_val
_Dist_constraint_value.Distance_upper_bound_val
_Dist_constraint_value.Entry_ID
_Dist_constraint_value.Distance_constraint_list_ID
1 1 . . . . . 3.9 3.6 4.2 1 2
2 1 . . . . . 3.9 3.6 4.2 1 2
3 1 . . . . . 3.9 3.6 4.2 1 2
4 1 . . . . . 3.85 3.5 4.2 1 2
5 1 . . . . . 3.85 3.5 4.2 1 2
6 1 . . . . . 3.85 3.5 4.2 1 2
stop_
save_
save_CNS/XPLOR_dihedral_4
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID 1
_Torsion_angle_constraint_list.ID 1
_Torsion_angle_constraint_list.Constraint_file_ID .
_Torsion_angle_constraint_list.Block_ID .
loop_
_Torsion_angle_constraint.ID
_Torsion_angle_constraint.Torsion_angle_name
_Torsion_angle_constraint.Entity_assembly_ID_1
_Torsion_angle_constraint.Entity_ID_1
_Torsion_angle_constraint.Comp_index_ID_1
_Torsion_angle_constraint.Comp_ID_1
_Torsion_angle_constraint.Atom_ID_1
_Torsion_angle_constraint.Entity_assembly_ID_2
_Torsion_angle_constraint.Entity_ID_2
_Torsion_angle_constraint.Comp_index_ID_2
_Torsion_angle_constraint.Comp_ID_2
_Torsion_angle_constraint.Atom_ID_2
_Torsion_angle_constraint.Entity_assembly_ID_3
_Torsion_angle_constraint.Entity_ID_3
_Torsion_angle_constraint.Comp_index_ID_3
_Torsion_angle_constraint.Comp_ID_3
_Torsion_angle_constraint.Atom_ID_3
_Torsion_angle_constraint.Entity_assembly_ID_4
_Torsion_angle_constraint.Entity_ID_4
_Torsion_angle_constraint.Comp_index_ID_4
_Torsion_angle_constraint.Comp_ID_4
_Torsion_angle_constraint.Atom_ID_4
_Torsion_angle_constraint.Angle_lower_bound_val
_Torsion_angle_constraint.Angle_upper_bound_val
_Torsion_angle_constraint.Auth_asym_ID_1
_Torsion_angle_constraint.Auth_seq_ID_1
_Torsion_angle_constraint.Auth_comp_ID_1
_Torsion_angle_constraint.Auth_atom_ID_1
_Torsion_angle_constraint.Auth_asym_ID_2
_Torsion_angle_constraint.Auth_seq_ID_2
_Torsion_angle_constraint.Auth_comp_ID_2
_Torsion_angle_constraint.Auth_atom_ID_2
_Torsion_angle_constraint.Auth_asym_ID_3
_Torsion_angle_constraint.Auth_seq_ID_3
_Torsion_angle_constraint.Auth_comp_ID_3
_Torsion_angle_constraint.Auth_atom_ID_3
_Torsion_angle_constraint.Auth_asym_ID_4
_Torsion_angle_constraint.Auth_seq_ID_4
_Torsion_angle_constraint.Auth_comp_ID_4
_Torsion_angle_constraint.Auth_atom_ID_4
_Torsion_angle_constraint.Entry_ID
_Torsion_angle_constraint.Torsion_angle_constraint_list_ID
1 . 1 1 5 CYS N 1 1 5 CYS CA 1 1 5 CYS CB 1 1 5 CYS SG 130.0 230.00002 . 13 . N . 13 . CA . 13 . CB . 13 . SG 1 1
2 . 1 1 17 CYS N 1 1 17 CYS CA 1 1 17 CYS CB 1 1 17 CYS SG 130.0 230.00002 . 25 . N . 25 . CA . 25 . CB . 25 . SG 1 1
3 . 1 1 8 CYS N 1 1 8 CYS CA 1 1 8 CYS CB 1 1 8 CYS SG 10.0 110.0 . 16 . N . 16 . CA . 16 . CB . 16 . SG 1 1
4 . 1 1 12 HIS N 1 1 12 HIS CA 1 1 12 HIS CB 1 1 12 HIS CG 10.0 110.0 . 20 . N . 20 . CA . 20 . CB . 20 . CG 1 1
5 . 1 1 16 ARG N 1 1 16 ARG CA 1 1 16 ARG CB 1 1 16 ARG CG 10.0 110.0 . 24 . N . 24 . CA . 24 . CB . 24 . CG 1 1
6 . 1 1 21 ASP N 1 1 21 ASP CA 1 1 21 ASP CB 1 1 21 ASP CG 10.0 110.0 . 29 . N . 29 . CA . 29 . CB . 29 . CG 1 1
7 . 1 1 9 LYS N 1 1 9 LYS CA 1 1 9 LYS CB 1 1 9 LYS CG -110.0 -10.0 . 17 . N . 17 . CA . 17 . CB . 17 . CG 1 1
8 . 1 1 13 TRP N 1 1 13 TRP CA 1 1 13 TRP CB 1 1 13 TRP CG -110.0 -10.0 . 21 . N . 21 . CA . 21 . CB . 21 . CG 1 1
9 . 1 1 19 TYR N 1 1 19 TYR CA 1 1 19 TYR CB 1 1 19 TYR CG -110.0 -10.0 . 27 . N . 27 . CA . 27 . CB . 27 . CG 1 1
10 . 1 1 6 ARG N 1 1 6 ARG CA 1 1 6 ARG CB 1 1 6 ARG CG -150.0 150.0 . 14 . N . 14 . CA . 14 . CB . 14 . CG 1 1
11 . 1 1 11 ASP N 1 1 11 ASP CA 1 1 11 ASP CB 1 1 11 ASP CG -150.0 150.0 . 19 . N . 19 . CA . 19 . CB . 19 . CG 1 1
12 . 1 1 20 LYS N 1 1 20 LYS CA 1 1 20 LYS CB 1 1 20 LYS CG -150.0 150.0 . 28 . N . 28 . CA . 28 . CB . 28 . CG 1 1
13 . 1 1 8 CYS C 1 1 9 LYS N 1 1 9 LYS CA 1 1 9 LYS C 30.0 89.99999 . 16 . C . 17 . N . 17 . CA . 17 . C 1 1
14 . 1 1 6 ARG C 1 1 7 ILE N 1 1 7 ILE CA 1 1 7 ILE C -150.0 -89.99999 . 14 . C . 15 . N . 15 . CA . 15 . C 1 1
15 . 1 1 7 ILE C 1 1 8 CYS N 1 1 8 CYS CA 1 1 8 CYS C -150.0 -89.99999 . 15 . C . 16 . N . 16 . CA . 16 . C 1 1
16 . 1 1 15 THR C 1 1 16 ARG N 1 1 16 ARG CA 1 1 16 ARG C -150.0 -89.99999 . 23 . C . 24 . N . 24 . CA . 24 . C 1 1
17 . 1 1 18 PRO C 1 1 19 TYR N 1 1 19 TYR CA 1 1 19 TYR C -150.0 -89.99999 . 26 . C . 27 . N . 27 . CA . 27 . C 1 1
18 . 1 1 2 ILE C 1 1 3 VAL N 1 1 3 VAL CA 1 1 3 VAL C -160.0 -80.0 . 10 . C . 11 . N . 11 . CA . 11 . C 1 1
19 . 1 1 3 VAL C 1 1 4 SER N 1 1 4 SER CA 1 1 4 SER C -160.0 -80.0 . 11 . C . 12 . N . 12 . CA . 12 . C 1 1
20 . 1 1 21 ASP C 1 1 22 THR N 1 1 22 THR CA 1 1 22 THR C -160.0 -80.0 . 29 . C . 30 . N . 30 . CA . 30 . C 1 1
21 . 1 1 4 SER C 1 1 5 CYS N 1 1 5 CYS CA 1 1 5 CYS C -89.99999 -40.0 . 12 . C . 13 . N . 13 . CA . 13 . C 1 1
22 . 1 1 19 TYR C 1 1 20 LYS N 1 1 20 LYS CA 1 1 20 LYS C -85.0 -35.0 . 27 . C . 28 . N . 28 . CA . 28 . C 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 LYS C C -12.718 -4.134 2.149 1.00 . A A . 9 LYS C 1 1
1 2 1 1 1 LYS CA C -12.558 -3.946 3.654 1.00 . A A . 9 LYS CA 1 1
1 3 1 1 1 LYS CB C -13.347 -2.713 4.111 1.00 . A A . 9 LYS CB 1 1
1 4 1 1 1 LYS CD C -14.134 -3.404 6.405 1.00 . A A . 9 LYS CD 1 1
1 5 1 1 1 LYS CE C -14.054 -3.067 7.895 1.00 . A A . 9 LYS CE 1 1
1 6 1 1 1 LYS CG C -13.168 -2.502 5.625 1.00 . A A . 9 LYS CG 1 1
1 7 1 1 1 LYS H1 H -10.802 -2.828 3.639 1.00 . A A . 9 LYS H1 1 1
1 8 1 1 1 LYS H2 H -10.557 -4.504 3.514 1.00 . A A . 9 LYS H2 1 1
1 9 1 1 1 LYS H3 H -10.981 -3.814 5.007 1.00 . A A . 9 LYS H3 1 1
1 10 1 1 1 LYS HA H -12.930 -4.821 4.163 1.00 . A A . 9 LYS HA 1 1
1 11 1 1 1 LYS HB2 H -12.982 -1.843 3.584 1.00 . A A . 9 LYS HB2 1 1
1 12 1 1 1 LYS HB3 H -14.394 -2.853 3.887 1.00 . A A . 9 LYS HB3 1 1
1 13 1 1 1 LYS HD2 H -15.143 -3.243 6.054 1.00 . A A . 9 LYS HD2 1 1
1 14 1 1 1 LYS HD3 H -13.862 -4.438 6.260 1.00 . A A . 9 LYS HD3 1 1
1 15 1 1 1 LYS HE2 H -14.127 -1.996 8.026 1.00 . A A . 9 LYS HE2 1 1
1 16 1 1 1 LYS HE3 H -14.867 -3.550 8.417 1.00 . A A . 9 LYS HE3 1 1
1 17 1 1 1 LYS HG2 H -12.151 -2.737 5.905 1.00 . A A . 9 LYS HG2 1 1
1 18 1 1 1 LYS HG3 H -13.374 -1.470 5.867 1.00 . A A . 9 LYS HG3 1 1
1 19 1 1 1 LYS HZ1 H -12.028 -2.817 8.307 1.00 . A A . 9 LYS HZ1 1 1
1 20 1 1 1 LYS HZ2 H -12.472 -4.418 7.950 1.00 . A A . 9 LYS HZ2 1 1
1 21 1 1 1 LYS HZ3 H -12.859 -3.742 9.461 1.00 . A A . 9 LYS HZ3 1 1
1 22 1 1 1 LYS N N -11.116 -3.759 3.978 1.00 . A A . 9 LYS N 1 1
1 23 1 1 1 LYS NZ N -12.755 -3.548 8.444 1.00 . A A . 9 LYS NZ 1 1
1 24 1 1 1 LYS O O -12.874 -5.256 1.667 1.00 . A A . 9 LYS O 1 1
1 25 1 1 2 ILE C C -11.947 -2.007 -0.694 1.00 . A A . 10 ILE C 1 1
1 26 1 1 2 ILE CA C -12.829 -3.067 -0.040 1.00 . A A . 10 ILE CA 1 1
1 27 1 1 2 ILE CB C -14.301 -2.838 -0.410 1.00 . A A . 10 ILE CB 1 1
1 28 1 1 2 ILE CD1 C -16.019 -3.116 -2.207 1.00 . A A . 10 ILE CD1 1 1
1 29 1 1 2 ILE CG1 C -14.533 -3.256 -1.867 1.00 . A A . 10 ILE CG1 1 1
1 30 1 1 2 ILE CG2 C -14.676 -1.361 -0.231 1.00 . A A . 10 ILE CG2 1 1
1 31 1 1 2 ILE H H -12.562 -2.162 1.849 1.00 . A A . 10 ILE H 1 1
1 32 1 1 2 ILE HA H -12.526 -4.040 -0.403 1.00 . A A . 10 ILE HA 1 1
1 33 1 1 2 ILE HB H -14.919 -3.439 0.239 1.00 . A A . 10 ILE HB 1 1
1 34 1 1 2 ILE HD11 H -16.608 -3.634 -1.465 1.00 . A A . 10 ILE HD11 1 1
1 35 1 1 2 ILE HD12 H -16.206 -3.545 -3.179 1.00 . A A . 10 ILE HD12 1 1
1 36 1 1 2 ILE HD13 H -16.288 -2.071 -2.216 1.00 . A A . 10 ILE HD13 1 1
1 37 1 1 2 ILE HG12 H -13.952 -2.623 -2.520 1.00 . A A . 10 ILE HG12 1 1
1 38 1 1 2 ILE HG13 H -14.231 -4.285 -1.999 1.00 . A A . 10 ILE HG13 1 1
1 39 1 1 2 ILE HG21 H -15.748 -1.271 -0.136 1.00 . A A . 10 ILE HG21 1 1
1 40 1 1 2 ILE HG22 H -14.344 -0.793 -1.088 1.00 . A A . 10 ILE HG22 1 1
1 41 1 1 2 ILE HG23 H -14.203 -0.973 0.661 1.00 . A A . 10 ILE HG23 1 1
1 42 1 1 2 ILE N N -12.684 -3.025 1.411 1.00 . A A . 10 ILE N 1 1
1 43 1 1 2 ILE O O -12.093 -0.812 -0.434 1.00 . A A . 10 ILE O 1 1
1 44 1 1 3 VAL C C -10.801 -0.894 -3.412 1.00 . A A . 11 VAL C 1 1
1 45 1 1 3 VAL CA C -10.118 -1.543 -2.224 1.00 . A A . 11 VAL CA 1 1
1 46 1 1 3 VAL CB C -8.869 -2.289 -2.694 1.00 . A A . 11 VAL CB 1 1
1 47 1 1 3 VAL CG1 C -9.270 -3.450 -3.606 1.00 . A A . 11 VAL CG1 1 1
1 48 1 1 3 VAL CG2 C -7.960 -1.328 -3.465 1.00 . A A . 11 VAL CG2 1 1
1 49 1 1 3 VAL H H -10.954 -3.418 -1.698 1.00 . A A . 11 VAL H 1 1
1 50 1 1 3 VAL HA H -9.817 -0.762 -1.544 1.00 . A A . 11 VAL HA 1 1
1 51 1 1 3 VAL HB H -8.340 -2.672 -1.835 1.00 . A A . 11 VAL HB 1 1
1 52 1 1 3 VAL HG11 H -9.629 -3.061 -4.547 1.00 . A A . 11 VAL HG11 1 1
1 53 1 1 3 VAL HG12 H -10.051 -4.028 -3.135 1.00 . A A . 11 VAL HG12 1 1
1 54 1 1 3 VAL HG13 H -8.413 -4.082 -3.783 1.00 . A A . 11 VAL HG13 1 1
1 55 1 1 3 VAL HG21 H -6.983 -1.772 -3.580 1.00 . A A . 11 VAL HG21 1 1
1 56 1 1 3 VAL HG22 H -7.873 -0.400 -2.919 1.00 . A A . 11 VAL HG22 1 1
1 57 1 1 3 VAL HG23 H -8.385 -1.134 -4.438 1.00 . A A . 11 VAL HG23 1 1
1 58 1 1 3 VAL N N -11.026 -2.456 -1.538 1.00 . A A . 11 VAL N 1 1
1 59 1 1 3 VAL O O -11.422 -1.563 -4.236 1.00 . A A . 11 VAL O 1 1
1 60 1 1 4 SER C C -10.456 2.454 -4.816 1.00 . A A . 12 SER C 1 1
1 61 1 1 4 SER CA C -11.254 1.185 -4.574 1.00 . A A . 12 SER CA 1 1
1 62 1 1 4 SER CB C -12.698 1.552 -4.258 1.00 . A A . 12 SER CB 1 1
1 63 1 1 4 SER H H -10.148 0.886 -2.797 1.00 . A A . 12 SER H 1 1
1 64 1 1 4 SER HA H -11.238 0.590 -5.476 1.00 . A A . 12 SER HA 1 1
1 65 1 1 4 SER HB2 H -12.721 2.293 -3.476 1.00 . A A . 12 SER HB2 1 1
1 66 1 1 4 SER HB3 H -13.159 1.958 -5.149 1.00 . A A . 12 SER HB3 1 1
1 67 1 1 4 SER HG H -12.828 -0.366 -3.968 1.00 . A A . 12 SER HG 1 1
1 68 1 1 4 SER N N -10.666 0.421 -3.487 1.00 . A A . 12 SER N 1 1
1 69 1 1 4 SER O O -10.295 3.290 -3.927 1.00 . A A . 12 SER O 1 1
1 70 1 1 4 SER OG O -13.398 0.393 -3.828 1.00 . A A . 12 SER OG 1 1
1 71 1 1 5 CYS C C -10.033 4.997 -6.399 1.00 . A A . 13 CYS C 1 1
1 72 1 1 5 CYS CA C -9.173 3.736 -6.422 1.00 . A A . 13 CYS CA 1 1
1 73 1 1 5 CYS CB C -8.605 3.516 -7.825 1.00 . A A . 13 CYS CB 1 1
1 74 1 1 5 CYS H H -10.136 1.868 -6.679 1.00 . A A . 13 CYS H 1 1
1 75 1 1 5 CYS HA H -8.354 3.856 -5.729 1.00 . A A . 13 CYS HA 1 1
1 76 1 1 5 CYS HB2 H -8.204 2.516 -7.895 1.00 . A A . 13 CYS HB2 1 1
1 77 1 1 5 CYS HB3 H -9.390 3.638 -8.551 1.00 . A A . 13 CYS HB3 1 1
1 78 1 1 5 CYS N N -9.962 2.577 -6.030 1.00 . A A . 13 CYS N 1 1
1 79 1 1 5 CYS O O -11.257 4.919 -6.301 1.00 . A A . 13 CYS O 1 1
1 80 1 1 5 CYS SG S -7.291 4.715 -8.151 1.00 . A A . 13 CYS SG 1 1
1 81 1 1 6 ARG C C -9.796 8.250 -7.721 1.00 . A A . 14 ARG C 1 1
1 82 1 1 6 ARG CA C -10.098 7.444 -6.462 1.00 . A A . 14 ARG CA 1 1
1 83 1 1 6 ARG CB C -9.676 8.251 -5.232 1.00 . A A . 14 ARG CB 1 1
1 84 1 1 6 ARG CD C -9.695 8.326 -2.735 1.00 . A A . 14 ARG CD 1 1
1 85 1 1 6 ARG CG C -10.099 7.508 -3.963 1.00 . A A . 14 ARG CG 1 1
1 86 1 1 6 ARG CZ C -10.126 8.294 -0.345 1.00 . A A . 14 ARG CZ 1 1
1 87 1 1 6 ARG H H -8.406 6.159 -6.553 1.00 . A A . 14 ARG H 1 1
1 88 1 1 6 ARG HA H -11.164 7.268 -6.410 1.00 . A A . 14 ARG HA 1 1
1 89 1 1 6 ARG HB2 H -8.603 8.378 -5.236 1.00 . A A . 14 ARG HB2 1 1
1 90 1 1 6 ARG HB3 H -10.153 9.219 -5.255 1.00 . A A . 14 ARG HB3 1 1
1 91 1 1 6 ARG HD2 H -8.621 8.420 -2.704 1.00 . A A . 14 ARG HD2 1 1
1 92 1 1 6 ARG HD3 H -10.137 9.310 -2.801 1.00 . A A . 14 ARG HD3 1 1
1 93 1 1 6 ARG HE H -10.492 6.749 -1.564 1.00 . A A . 14 ARG HE 1 1
1 94 1 1 6 ARG HG2 H -11.170 7.369 -3.968 1.00 . A A . 14 ARG HG2 1 1
1 95 1 1 6 ARG HG3 H -9.609 6.547 -3.929 1.00 . A A . 14 ARG HG3 1 1
1 96 1 1 6 ARG HH11 H -9.363 9.987 -1.094 1.00 . A A . 14 ARG HH11 1 1
1 97 1 1 6 ARG HH12 H -9.660 9.989 0.612 1.00 . A A . 14 ARG HH12 1 1
1 98 1 1 6 ARG HH21 H -10.884 6.746 0.673 1.00 . A A . 14 ARG HH21 1 1
1 99 1 1 6 ARG HH22 H -10.521 8.155 1.613 1.00 . A A . 14 ARG HH22 1 1
1 100 1 1 6 ARG N N -9.384 6.161 -6.482 1.00 . A A . 14 ARG N 1 1
1 101 1 1 6 ARG NE N -10.156 7.668 -1.518 1.00 . A A . 14 ARG NE 1 1
1 102 1 1 6 ARG NH1 N -9.682 9.519 -0.269 1.00 . A A . 14 ARG NH1 1 1
1 103 1 1 6 ARG NH2 N -10.543 7.684 0.731 1.00 . A A . 14 ARG NH2 1 1
1 104 1 1 6 ARG O O -9.979 9.467 -7.750 1.00 . A A . 14 ARG O 1 1
1 105 1 1 7 ILE C C -9.646 7.466 -11.196 1.00 . A A . 15 ILE C 1 1
1 106 1 1 7 ILE CA C -9.003 8.214 -10.035 1.00 . A A . 15 ILE CA 1 1
1 107 1 1 7 ILE CB C -7.485 8.235 -10.234 1.00 . A A . 15 ILE CB 1 1
1 108 1 1 7 ILE CD1 C -5.320 8.636 -9.053 1.00 . A A . 15 ILE CD1 1 1
1 109 1 1 7 ILE CG1 C -6.818 8.944 -9.052 1.00 . A A . 15 ILE CG1 1 1
1 110 1 1 7 ILE CG2 C -7.150 8.978 -11.528 1.00 . A A . 15 ILE CG2 1 1
1 111 1 1 7 ILE H H -9.208 6.593 -8.680 1.00 . A A . 15 ILE H 1 1
1 112 1 1 7 ILE HA H -9.368 9.233 -10.030 1.00 . A A . 15 ILE HA 1 1
1 113 1 1 7 ILE HB H -7.121 7.219 -10.298 1.00 . A A . 15 ILE HB 1 1
1 114 1 1 7 ILE HD11 H -5.174 7.565 -9.036 1.00 . A A . 15 ILE HD11 1 1
1 115 1 1 7 ILE HD12 H -4.860 9.076 -8.182 1.00 . A A . 15 ILE HD12 1 1
1 116 1 1 7 ILE HD13 H -4.869 9.046 -9.945 1.00 . A A . 15 ILE HD13 1 1
1 117 1 1 7 ILE HG12 H -6.967 10.011 -9.140 1.00 . A A . 15 ILE HG12 1 1
1 118 1 1 7 ILE HG13 H -7.252 8.596 -8.128 1.00 . A A . 15 ILE HG13 1 1
1 119 1 1 7 ILE HG21 H -7.420 8.364 -12.376 1.00 . A A . 15 ILE HG21 1 1
1 120 1 1 7 ILE HG22 H -6.091 9.187 -11.559 1.00 . A A . 15 ILE HG22 1 1
1 121 1 1 7 ILE HG23 H -7.702 9.905 -11.565 1.00 . A A . 15 ILE HG23 1 1
1 122 1 1 7 ILE N N -9.333 7.562 -8.765 1.00 . A A . 15 ILE N 1 1
1 123 1 1 7 ILE O O -10.111 8.072 -12.161 1.00 . A A . 15 ILE O 1 1
1 124 1 1 8 CYS C C -11.168 4.250 -11.525 1.00 . A A . 16 CYS C 1 1
1 125 1 1 8 CYS CA C -10.232 5.288 -12.138 1.00 . A A . 16 CYS CA 1 1
1 126 1 1 8 CYS CB C -9.104 4.585 -12.890 1.00 . A A . 16 CYS CB 1 1
1 127 1 1 8 CYS H H -9.264 5.718 -10.308 1.00 . A A . 16 CYS H 1 1
1 128 1 1 8 CYS HA H -10.792 5.894 -12.837 1.00 . A A . 16 CYS HA 1 1
1 129 1 1 8 CYS HB2 H -9.514 4.006 -13.704 1.00 . A A . 16 CYS HB2 1 1
1 130 1 1 8 CYS HB3 H -8.423 5.326 -13.281 1.00 . A A . 16 CYS HB3 1 1
1 131 1 1 8 CYS N N -9.657 6.138 -11.097 1.00 . A A . 16 CYS N 1 1
1 132 1 1 8 CYS O O -11.970 3.635 -12.228 1.00 . A A . 16 CYS O 1 1
1 133 1 1 8 CYS SG S -8.214 3.493 -11.755 1.00 . A A . 16 CYS SG 1 1
1 134 1 1 9 LYS C C -11.681 1.694 -10.043 1.00 . A A . 17 LYS C 1 1
1 135 1 1 9 LYS CA C -11.912 3.106 -9.514 1.00 . A A . 17 LYS CA 1 1
1 136 1 1 9 LYS CB C -13.381 3.491 -9.684 1.00 . A A . 17 LYS CB 1 1
1 137 1 1 9 LYS CD C -15.020 5.379 -9.644 1.00 . A A . 17 LYS CD 1 1
1 138 1 1 9 LYS CE C -15.276 6.764 -9.046 1.00 . A A . 17 LYS CE 1 1
1 139 1 1 9 LYS CG C -13.555 4.992 -9.428 1.00 . A A . 17 LYS CG 1 1
1 140 1 1 9 LYS H H -10.413 4.583 -9.699 1.00 . A A . 17 LYS H 1 1
1 141 1 1 9 LYS HA H -11.669 3.127 -8.462 1.00 . A A . 17 LYS HA 1 1
1 142 1 1 9 LYS HB2 H -13.703 3.255 -10.687 1.00 . A A . 17 LYS HB2 1 1
1 143 1 1 9 LYS HB3 H -13.976 2.940 -8.977 1.00 . A A . 17 LYS HB3 1 1
1 144 1 1 9 LYS HD2 H -15.232 5.398 -10.703 1.00 . A A . 17 LYS HD2 1 1
1 145 1 1 9 LYS HD3 H -15.658 4.656 -9.161 1.00 . A A . 17 LYS HD3 1 1
1 146 1 1 9 LYS HE2 H -16.259 7.104 -9.338 1.00 . A A . 17 LYS HE2 1 1
1 147 1 1 9 LYS HE3 H -15.220 6.708 -7.969 1.00 . A A . 17 LYS HE3 1 1
1 148 1 1 9 LYS HG2 H -13.267 5.220 -8.413 1.00 . A A . 17 LYS HG2 1 1
1 149 1 1 9 LYS HG3 H -12.936 5.550 -10.114 1.00 . A A . 17 LYS HG3 1 1
1 150 1 1 9 LYS HZ1 H -13.331 7.502 -9.116 1.00 . A A . 17 LYS HZ1 1 1
1 151 1 1 9 LYS HZ2 H -14.530 8.691 -9.300 1.00 . A A . 17 LYS HZ2 1 1
1 152 1 1 9 LYS HZ3 H -14.173 7.635 -10.582 1.00 . A A . 17 LYS HZ3 1 1
1 153 1 1 9 LYS N N -11.065 4.064 -10.210 1.00 . A A . 17 LYS N 1 1
1 154 1 1 9 LYS NZ N -14.250 7.720 -9.549 1.00 . A A . 17 LYS NZ 1 1
1 155 1 1 9 LYS O O -12.628 0.988 -10.387 1.00 . A A . 17 LYS O 1 1
1 156 1 1 10 GLY C C -9.874 -1.012 -9.418 1.00 . A A . 18 GLY C 1 1
1 157 1 1 10 GLY CA C -10.056 -0.045 -10.584 1.00 . A A . 18 GLY CA 1 1
1 158 1 1 10 GLY H H -9.703 1.898 -9.808 1.00 . A A . 18 GLY H 1 1
1 159 1 1 10 GLY HA2 H -10.835 -0.415 -11.237 1.00 . A A . 18 GLY HA2 1 1
1 160 1 1 10 GLY HA3 H -9.131 0.017 -11.136 1.00 . A A . 18 GLY HA3 1 1
1 161 1 1 10 GLY N N -10.413 1.289 -10.099 1.00 . A A . 18 GLY N 1 1
1 162 1 1 10 GLY O O -10.759 -1.156 -8.575 1.00 . A A . 18 GLY O 1 1
1 163 1 1 11 ASP C C -7.097 -2.268 -7.630 1.00 . A A . 19 ASP C 1 1
1 164 1 1 11 ASP CA C -8.411 -2.634 -8.315 1.00 . A A . 19 ASP CA 1 1
1 165 1 1 11 ASP CB C -8.304 -4.039 -8.908 1.00 . A A . 19 ASP CB 1 1
1 166 1 1 11 ASP CG C -7.111 -4.118 -9.854 1.00 . A A . 19 ASP CG 1 1
1 167 1 1 11 ASP H H -8.053 -1.515 -10.081 1.00 . A A . 19 ASP H 1 1
1 168 1 1 11 ASP HA H -9.202 -2.626 -7.577 1.00 . A A . 19 ASP HA 1 1
1 169 1 1 11 ASP HB2 H -8.178 -4.756 -8.110 1.00 . A A . 19 ASP HB2 1 1
1 170 1 1 11 ASP HB3 H -9.206 -4.264 -9.453 1.00 . A A . 19 ASP HB3 1 1
1 171 1 1 11 ASP N N -8.717 -1.674 -9.379 1.00 . A A . 19 ASP N 1 1
1 172 1 1 11 ASP O O -6.124 -3.019 -7.690 1.00 . A A . 19 ASP O 1 1
1 173 1 1 11 ASP OD1 O -7.139 -3.442 -10.869 1.00 . A A . 19 ASP OD1 1 1
1 174 1 1 11 ASP OD2 O -6.185 -4.853 -9.550 1.00 . A A . 19 ASP OD2 1 1
1 175 1 1 12 HIS C C -6.137 0.722 -5.660 1.00 . A A . 20 HIS C 1 1
1 176 1 1 12 HIS CA C -5.884 -0.646 -6.285 1.00 . A A . 20 HIS CA 1 1
1 177 1 1 12 HIS CB C -4.707 -0.559 -7.263 1.00 . A A . 20 HIS CB 1 1
1 178 1 1 12 HIS CD2 C -5.601 1.294 -8.898 1.00 . A A . 20 HIS CD2 1 1
1 179 1 1 12 HIS CE1 C -5.690 0.104 -10.705 1.00 . A A . 20 HIS CE1 1 1
1 180 1 1 12 HIS CG C -5.175 0.032 -8.564 1.00 . A A . 20 HIS CG 1 1
1 181 1 1 12 HIS H H -7.883 -0.552 -6.962 1.00 . A A . 20 HIS H 1 1
1 182 1 1 12 HIS HA H -5.637 -1.350 -5.503 1.00 . A A . 20 HIS HA 1 1
1 183 1 1 12 HIS HB2 H -3.931 0.064 -6.845 1.00 . A A . 20 HIS HB2 1 1
1 184 1 1 12 HIS HB3 H -4.311 -1.548 -7.441 1.00 . A A . 20 HIS HB3 1 1
1 185 1 1 12 HIS HD2 H -5.673 2.129 -8.216 1.00 . A A . 20 HIS HD2 1 1
1 186 1 1 12 HIS HE1 H -5.842 -0.203 -11.730 1.00 . A A . 20 HIS HE1 1 1
1 187 1 1 12 HIS N N -7.078 -1.108 -6.979 1.00 . A A . 20 HIS N 1 1
1 188 1 1 12 HIS ND1 N -5.241 -0.710 -9.732 1.00 . A A . 20 HIS ND1 1 1
1 189 1 1 12 HIS NE2 N -5.925 1.337 -10.250 1.00 . A A . 20 HIS NE2 1 1
1 190 1 1 12 HIS O O -6.816 1.567 -6.242 1.00 . A A . 20 HIS O 1 1
1 191 1 1 13 TRP C C -5.412 3.366 -4.700 1.00 . A A . 21 TRP C 1 1
1 192 1 1 13 TRP CA C -5.757 2.202 -3.774 1.00 . A A . 21 TRP CA 1 1
1 193 1 1 13 TRP CB C -4.858 2.246 -2.534 1.00 . A A . 21 TRP CB 1 1
1 194 1 1 13 TRP CD1 C -5.101 0.060 -1.285 1.00 . A A . 21 TRP CD1 1 1
1 195 1 1 13 TRP CD2 C -6.402 1.688 -0.438 1.00 . A A . 21 TRP CD2 1 1
1 196 1 1 13 TRP CE2 C -6.635 0.533 0.347 1.00 . A A . 21 TRP CE2 1 1
1 197 1 1 13 TRP CE3 C -7.104 2.863 -0.112 1.00 . A A . 21 TRP CE3 1 1
1 198 1 1 13 TRP CG C -5.424 1.360 -1.468 1.00 . A A . 21 TRP CG 1 1
1 199 1 1 13 TRP CH2 C -8.219 1.718 1.727 1.00 . A A . 21 TRP CH2 1 1
1 200 1 1 13 TRP CZ2 C -7.530 0.543 1.416 1.00 . A A . 21 TRP CZ2 1 1
1 201 1 1 13 TRP CZ3 C -8.007 2.876 0.965 1.00 . A A . 21 TRP CZ3 1 1
1 202 1 1 13 TRP H H -5.060 0.220 -4.057 1.00 . A A . 21 TRP H 1 1
1 203 1 1 13 TRP HA H -6.788 2.296 -3.464 1.00 . A A . 21 TRP HA 1 1
1 204 1 1 13 TRP HB2 H -3.868 1.903 -2.796 1.00 . A A . 21 TRP HB2 1 1
1 205 1 1 13 TRP HB3 H -4.801 3.260 -2.166 1.00 . A A . 21 TRP HB3 1 1
1 206 1 1 13 TRP HD1 H -4.398 -0.502 -1.880 1.00 . A A . 21 TRP HD1 1 1
1 207 1 1 13 TRP HE1 H -5.767 -1.349 0.132 1.00 . A A . 21 TRP HE1 1 1
1 208 1 1 13 TRP HE3 H -6.948 3.759 -0.693 1.00 . A A . 21 TRP HE3 1 1
1 209 1 1 13 TRP HH2 H -8.915 1.736 2.553 1.00 . A A . 21 TRP HH2 1 1
1 210 1 1 13 TRP HZ2 H -7.690 -0.352 2.000 1.00 . A A . 21 TRP HZ2 1 1
1 211 1 1 13 TRP HZ3 H -8.540 3.783 1.206 1.00 . A A . 21 TRP HZ3 1 1
1 212 1 1 13 TRP N N -5.587 0.931 -4.471 1.00 . A A . 21 TRP N 1 1
1 213 1 1 13 TRP NE1 N -5.818 -0.432 -0.209 1.00 . A A . 21 TRP NE1 1 1
1 214 1 1 13 TRP O O -5.109 3.167 -5.876 1.00 . A A . 21 TRP O 1 1
1 215 1 1 14 THR C C -3.653 5.974 -5.068 1.00 . A A . 22 THR C 1 1
1 216 1 1 14 THR CA C -5.161 5.771 -4.948 1.00 . A A . 22 THR CA 1 1
1 217 1 1 14 THR CB C -5.790 7.003 -4.294 1.00 . A A . 22 THR CB 1 1
1 218 1 1 14 THR CG2 C -5.680 8.198 -5.241 1.00 . A A . 22 THR CG2 1 1
1 219 1 1 14 THR H H -5.716 4.678 -3.219 1.00 . A A . 22 THR H 1 1
1 220 1 1 14 THR HA H -5.576 5.653 -5.938 1.00 . A A . 22 THR HA 1 1
1 221 1 1 14 THR HB H -5.271 7.228 -3.375 1.00 . A A . 22 THR HB 1 1
1 222 1 1 14 THR HG1 H -7.304 5.796 -4.105 1.00 . A A . 22 THR HG1 1 1
1 223 1 1 14 THR HG21 H -6.242 9.029 -4.838 1.00 . A A . 22 THR HG21 1 1
1 224 1 1 14 THR HG22 H -6.079 7.930 -6.208 1.00 . A A . 22 THR HG22 1 1
1 225 1 1 14 THR HG23 H -4.644 8.482 -5.344 1.00 . A A . 22 THR HG23 1 1
1 226 1 1 14 THR N N -5.465 4.580 -4.161 1.00 . A A . 22 THR N 1 1
1 227 1 1 14 THR O O -3.180 6.668 -5.967 1.00 . A A . 22 THR O 1 1
1 228 1 1 14 THR OG1 O -7.158 6.740 -4.014 1.00 . A A . 22 THR OG1 1 1
1 229 1 1 15 THR C C -0.836 4.593 -5.237 1.00 . A A . 23 THR C 1 1
1 230 1 1 15 THR CA C -1.449 5.493 -4.168 1.00 . A A . 23 THR CA 1 1
1 231 1 1 15 THR CB C -0.879 5.120 -2.798 1.00 . A A . 23 THR CB 1 1
1 232 1 1 15 THR CG2 C -1.514 6.001 -1.722 1.00 . A A . 23 THR CG2 1 1
1 233 1 1 15 THR H H -3.332 4.827 -3.459 1.00 . A A . 23 THR H 1 1
1 234 1 1 15 THR HA H -1.189 6.518 -4.384 1.00 . A A . 23 THR HA 1 1
1 235 1 1 15 THR HB H 0.189 5.272 -2.797 1.00 . A A . 23 THR HB 1 1
1 236 1 1 15 THR HG1 H -1.202 3.644 -1.572 1.00 . A A . 23 THR HG1 1 1
1 237 1 1 15 THR HG21 H -1.322 7.040 -1.947 1.00 . A A . 23 THR HG21 1 1
1 238 1 1 15 THR HG22 H -1.090 5.756 -0.759 1.00 . A A . 23 THR HG22 1 1
1 239 1 1 15 THR HG23 H -2.580 5.829 -1.699 1.00 . A A . 23 THR HG23 1 1
1 240 1 1 15 THR N N -2.902 5.367 -4.154 1.00 . A A . 23 THR N 1 1
1 241 1 1 15 THR O O 0.020 5.024 -6.009 1.00 . A A . 23 THR O 1 1
1 242 1 1 15 THR OG1 O -1.164 3.755 -2.524 1.00 . A A . 23 THR OG1 1 1
1 243 1 1 16 ARG C C -1.603 2.412 -7.526 1.00 . A A . 24 ARG C 1 1
1 244 1 1 16 ARG CA C -0.766 2.373 -6.246 1.00 . A A . 24 ARG CA 1 1
1 245 1 1 16 ARG CB C -0.798 0.962 -5.632 1.00 . A A . 24 ARG CB 1 1
1 246 1 1 16 ARG CD C -2.333 -0.655 -4.486 1.00 . A A . 24 ARG CD 1 1
1 247 1 1 16 ARG CG C -2.023 0.826 -4.718 1.00 . A A . 24 ARG CG 1 1
1 248 1 1 16 ARG CZ C -1.188 -2.614 -3.621 1.00 . A A . 24 ARG CZ 1 1
1 249 1 1 16 ARG H H -1.958 3.051 -4.627 1.00 . A A . 24 ARG H 1 1
1 250 1 1 16 ARG HA H 0.257 2.624 -6.491 1.00 . A A . 24 ARG HA 1 1
1 251 1 1 16 ARG HB2 H -0.844 0.219 -6.419 1.00 . A A . 24 ARG HB2 1 1
1 252 1 1 16 ARG HB3 H 0.098 0.805 -5.047 1.00 . A A . 24 ARG HB3 1 1
1 253 1 1 16 ARG HD2 H -3.232 -0.744 -3.897 1.00 . A A . 24 ARG HD2 1 1
1 254 1 1 16 ARG HD3 H -2.480 -1.142 -5.438 1.00 . A A . 24 ARG HD3 1 1
1 255 1 1 16 ARG HE H -0.508 -0.744 -3.411 1.00 . A A . 24 ARG HE 1 1
1 256 1 1 16 ARG HG2 H -1.816 1.302 -3.771 1.00 . A A . 24 ARG HG2 1 1
1 257 1 1 16 ARG HG3 H -2.875 1.302 -5.180 1.00 . A A . 24 ARG HG3 1 1
1 258 1 1 16 ARG HH11 H -2.908 -2.937 -4.594 1.00 . A A . 24 ARG HH11 1 1
1 259 1 1 16 ARG HH12 H -2.113 -4.352 -3.988 1.00 . A A . 24 ARG HH12 1 1
1 260 1 1 16 ARG HH21 H 0.541 -2.593 -2.612 1.00 . A A . 24 ARG HH21 1 1
1 261 1 1 16 ARG HH22 H -0.159 -4.157 -2.865 1.00 . A A . 24 ARG HH22 1 1
1 262 1 1 16 ARG N N -1.278 3.338 -5.271 1.00 . A A . 24 ARG N 1 1
1 263 1 1 16 ARG NE N -1.230 -1.295 -3.778 1.00 . A A . 24 ARG NE 1 1
1 264 1 1 16 ARG NH1 N -2.144 -3.359 -4.105 1.00 . A A . 24 ARG NH1 1 1
1 265 1 1 16 ARG NH2 N -0.191 -3.164 -2.983 1.00 . A A . 24 ARG NH2 1 1
1 266 1 1 16 ARG O O -1.777 1.395 -8.199 1.00 . A A . 24 ARG O 1 1
1 267 1 1 17 CYS C C -2.034 3.940 -10.294 1.00 . A A . 25 CYS C 1 1
1 268 1 1 17 CYS CA C -2.933 3.748 -9.063 1.00 . A A . 25 CYS CA 1 1
1 269 1 1 17 CYS CB C -3.851 4.963 -8.908 1.00 . A A . 25 CYS CB 1 1
1 270 1 1 17 CYS H H -1.948 4.371 -7.290 1.00 . A A . 25 CYS H 1 1
1 271 1 1 17 CYS HA H -3.540 2.868 -9.183 1.00 . A A . 25 CYS HA 1 1
1 272 1 1 17 CYS HB2 H -4.608 4.748 -8.170 1.00 . A A . 25 CYS HB2 1 1
1 273 1 1 17 CYS HB3 H -3.270 5.815 -8.589 1.00 . A A . 25 CYS HB3 1 1
1 274 1 1 17 CYS N N -2.119 3.592 -7.860 1.00 . A A . 25 CYS N 1 1
1 275 1 1 17 CYS O O -1.068 4.700 -10.235 1.00 . A A . 25 CYS O 1 1
1 276 1 1 17 CYS SG S -4.642 5.332 -10.495 1.00 . A A . 25 CYS SG 1 1
1 277 1 1 18 PRO C C -1.725 4.775 -13.327 1.00 . A A . 26 PRO C 1 1
1 278 1 1 18 PRO CA C -1.490 3.430 -12.640 1.00 . A A . 26 PRO CA 1 1
1 279 1 1 18 PRO CB C -1.954 2.263 -13.520 1.00 . A A . 26 PRO CB 1 1
1 280 1 1 18 PRO CD C -3.440 2.347 -11.616 1.00 . A A . 26 PRO CD 1 1
1 281 1 1 18 PRO CG C -3.373 2.026 -13.114 1.00 . A A . 26 PRO CG 1 1
1 282 1 1 18 PRO HA H -0.444 3.312 -12.403 1.00 . A A . 26 PRO HA 1 1
1 283 1 1 18 PRO HB2 H -1.895 2.527 -14.570 1.00 . A A . 26 PRO HB2 1 1
1 284 1 1 18 PRO HB3 H -1.361 1.382 -13.321 1.00 . A A . 26 PRO HB3 1 1
1 285 1 1 18 PRO HD2 H -4.385 2.814 -11.371 1.00 . A A . 26 PRO HD2 1 1
1 286 1 1 18 PRO HD3 H -3.292 1.453 -11.028 1.00 . A A . 26 PRO HD3 1 1
1 287 1 1 18 PRO HG2 H -4.032 2.682 -13.670 1.00 . A A . 26 PRO HG2 1 1
1 288 1 1 18 PRO HG3 H -3.647 0.994 -13.280 1.00 . A A . 26 PRO HG3 1 1
1 289 1 1 18 PRO N N -2.318 3.286 -11.404 1.00 . A A . 26 PRO N 1 1
1 290 1 1 18 PRO O O -1.341 4.970 -14.480 1.00 . A A . 26 PRO O 1 1
1 291 1 1 19 TYR C C -2.651 8.066 -12.032 1.00 . A A . 27 TYR C 1 1
1 292 1 1 19 TYR CA C -2.644 7.027 -13.149 1.00 . A A . 27 TYR CA 1 1
1 293 1 1 19 TYR CB C -4.005 7.025 -13.851 1.00 . A A . 27 TYR CB 1 1
1 294 1 1 19 TYR CD1 C -3.154 6.072 -16.025 1.00 . A A . 27 TYR CD1 1 1
1 295 1 1 19 TYR CD2 C -4.898 4.875 -14.837 1.00 . A A . 27 TYR CD2 1 1
1 296 1 1 19 TYR CE1 C -3.166 5.093 -17.027 1.00 . A A . 27 TYR CE1 1 1
1 297 1 1 19 TYR CE2 C -4.908 3.897 -15.838 1.00 . A A . 27 TYR CE2 1 1
1 298 1 1 19 TYR CG C -4.020 5.964 -14.929 1.00 . A A . 27 TYR CG 1 1
1 299 1 1 19 TYR CZ C -4.042 4.006 -16.933 1.00 . A A . 27 TYR CZ 1 1
1 300 1 1 19 TYR H H -2.639 5.484 -11.693 1.00 . A A . 27 TYR H 1 1
1 301 1 1 19 TYR HA H -1.881 7.292 -13.867 1.00 . A A . 27 TYR HA 1 1
1 302 1 1 19 TYR HB2 H -4.781 6.821 -13.127 1.00 . A A . 27 TYR HB2 1 1
1 303 1 1 19 TYR HB3 H -4.178 7.993 -14.299 1.00 . A A . 27 TYR HB3 1 1
1 304 1 1 19 TYR HD1 H -2.477 6.911 -16.099 1.00 . A A . 27 TYR HD1 1 1
1 305 1 1 19 TYR HD2 H -5.568 4.791 -13.993 1.00 . A A . 27 TYR HD2 1 1
1 306 1 1 19 TYR HE1 H -2.497 5.177 -17.871 1.00 . A A . 27 TYR HE1 1 1
1 307 1 1 19 TYR HE2 H -5.586 3.059 -15.768 1.00 . A A . 27 TYR HE2 1 1
1 308 1 1 19 TYR HH H -4.101 3.487 -18.770 1.00 . A A . 27 TYR HH 1 1
1 309 1 1 19 TYR N N -2.359 5.699 -12.607 1.00 . A A . 27 TYR N 1 1
1 310 1 1 19 TYR O O -3.585 8.860 -11.915 1.00 . A A . 27 TYR O 1 1
1 311 1 1 19 TYR OH O -4.054 3.042 -17.920 1.00 . A A . 27 TYR OH 1 1
1 312 1 1 20 LYS C C -0.953 10.341 -10.610 1.00 . A A . 28 LYS C 1 1
1 313 1 1 20 LYS CA C -1.493 9.005 -10.108 1.00 . A A . 28 LYS CA 1 1
1 314 1 1 20 LYS CB C -0.576 8.440 -9.007 1.00 . A A . 28 LYS CB 1 1
1 315 1 1 20 LYS CD C 1.317 8.518 -10.655 1.00 . A A . 28 LYS CD 1 1
1 316 1 1 20 LYS CE C 2.666 7.879 -10.990 1.00 . A A . 28 LYS CE 1 1
1 317 1 1 20 LYS CG C 0.582 7.652 -9.629 1.00 . A A . 28 LYS CG 1 1
1 318 1 1 20 LYS H H -0.888 7.403 -11.361 1.00 . A A . 28 LYS H 1 1
1 319 1 1 20 LYS HA H -2.476 9.168 -9.692 1.00 . A A . 28 LYS HA 1 1
1 320 1 1 20 LYS HB2 H -0.179 9.251 -8.412 1.00 . A A . 28 LYS HB2 1 1
1 321 1 1 20 LYS HB3 H -1.150 7.782 -8.369 1.00 . A A . 28 LYS HB3 1 1
1 322 1 1 20 LYS HD2 H 0.723 8.594 -11.555 1.00 . A A . 28 LYS HD2 1 1
1 323 1 1 20 LYS HD3 H 1.482 9.502 -10.246 1.00 . A A . 28 LYS HD3 1 1
1 324 1 1 20 LYS HE2 H 2.530 6.821 -11.162 1.00 . A A . 28 LYS HE2 1 1
1 325 1 1 20 LYS HE3 H 3.072 8.339 -11.880 1.00 . A A . 28 LYS HE3 1 1
1 326 1 1 20 LYS HG2 H 1.271 7.358 -8.850 1.00 . A A . 28 LYS HG2 1 1
1 327 1 1 20 LYS HG3 H 0.197 6.769 -10.115 1.00 . A A . 28 LYS HG3 1 1
1 328 1 1 20 LYS HZ1 H 4.558 8.281 -10.221 1.00 . A A . 28 LYS HZ1 1 1
1 329 1 1 20 LYS HZ2 H 3.634 7.221 -9.268 1.00 . A A . 28 LYS HZ2 1 1
1 330 1 1 20 LYS HZ3 H 3.286 8.883 -9.275 1.00 . A A . 28 LYS HZ3 1 1
1 331 1 1 20 LYS N N -1.601 8.056 -11.215 1.00 . A A . 28 LYS N 1 1
1 332 1 1 20 LYS NZ N 3.607 8.081 -9.853 1.00 . A A . 28 LYS NZ 1 1
1 333 1 1 20 LYS O O -0.456 11.155 -9.832 1.00 . A A . 28 LYS O 1 1
1 334 1 1 21 ASP C C -1.308 12.989 -11.971 1.00 . A A . 29 ASP C 1 1
1 335 1 1 21 ASP CA C -0.577 11.772 -12.530 1.00 . A A . 29 ASP CA 1 1
1 336 1 1 21 ASP CB C -0.776 11.651 -14.046 1.00 . A A . 29 ASP CB 1 1
1 337 1 1 21 ASP CG C -2.183 12.087 -14.461 1.00 . A A . 29 ASP CG 1 1
1 338 1 1 21 ASP H H -1.450 9.867 -12.486 1.00 . A A . 29 ASP H 1 1
1 339 1 1 21 ASP HA H 0.472 11.875 -12.321 1.00 . A A . 29 ASP HA 1 1
1 340 1 1 21 ASP HB2 H -0.052 12.257 -14.546 1.00 . A A . 29 ASP HB2 1 1
1 341 1 1 21 ASP HB3 H -0.631 10.622 -14.331 1.00 . A A . 29 ASP HB3 1 1
1 342 1 1 21 ASP N N -1.051 10.551 -11.916 1.00 . A A . 29 ASP N 1 1
1 343 1 1 21 ASP O O -1.050 14.126 -12.367 1.00 . A A . 29 ASP O 1 1
1 344 1 1 21 ASP OD1 O -2.423 13.283 -14.501 1.00 . A A . 29 ASP OD1 1 1
1 345 1 1 21 ASP OD2 O -2.995 11.218 -14.733 1.00 . A A . 29 ASP OD2 1 1
1 346 1 1 22 THR C C -2.189 14.490 -9.337 1.00 . A A . 30 THR C 1 1
1 347 1 1 22 THR CA C -2.998 13.796 -10.428 1.00 . A A . 30 THR CA 1 1
1 348 1 1 22 THR CB C -4.281 13.221 -9.824 1.00 . A A . 30 THR CB 1 1
1 349 1 1 22 THR CG2 C -5.162 12.653 -10.937 1.00 . A A . 30 THR CG2 1 1
1 350 1 1 22 THR H H -2.372 11.803 -10.786 1.00 . A A . 30 THR H 1 1
1 351 1 1 22 THR HA H -3.264 14.523 -11.181 1.00 . A A . 30 THR HA 1 1
1 352 1 1 22 THR HB H -4.819 14.002 -9.309 1.00 . A A . 30 THR HB 1 1
1 353 1 1 22 THR HG1 H -2.995 12.081 -8.914 1.00 . A A . 30 THR HG1 1 1
1 354 1 1 22 THR HG21 H -5.346 13.418 -11.678 1.00 . A A . 30 THR HG21 1 1
1 355 1 1 22 THR HG22 H -6.102 12.322 -10.520 1.00 . A A . 30 THR HG22 1 1
1 356 1 1 22 THR HG23 H -4.661 11.817 -11.402 1.00 . A A . 30 THR HG23 1 1
1 357 1 1 22 THR N N -2.219 12.731 -11.050 1.00 . A A . 30 THR N 1 1
1 358 1 1 22 THR O O -2.750 15.112 -8.434 1.00 . A A . 30 THR O 1 1
1 359 1 1 22 THR OG1 O -3.949 12.189 -8.907 1.00 . A A . 30 THR OG1 1 1
1 360 1 1 23 LEU C C 0.091 16.508 -8.676 1.00 . A A . 31 LEU C 1 1
1 361 1 1 23 LEU CA C 0.008 15.003 -8.438 1.00 . A A . 31 LEU CA 1 1
1 362 1 1 23 LEU CB C 1.413 14.389 -8.521 1.00 . A A . 31 LEU CB 1 1
1 363 1 1 23 LEU CD1 C 2.560 12.151 -8.503 1.00 . A A . 31 LEU CD1 1 1
1 364 1 1 23 LEU CD2 C 1.609 13.056 -6.383 1.00 . A A . 31 LEU CD2 1 1
1 365 1 1 23 LEU CG C 1.416 12.974 -7.904 1.00 . A A . 31 LEU CG 1 1
1 366 1 1 23 LEU H H -0.474 13.873 -10.166 1.00 . A A . 31 LEU H 1 1
1 367 1 1 23 LEU HA H -0.394 14.826 -7.454 1.00 . A A . 31 LEU HA 1 1
1 368 1 1 23 LEU HB2 H 1.708 14.331 -9.561 1.00 . A A . 31 LEU HB2 1 1
1 369 1 1 23 LEU HB3 H 2.112 15.019 -7.990 1.00 . A A . 31 LEU HB3 1 1
1 370 1 1 23 LEU HD11 H 2.665 11.226 -7.954 1.00 . A A . 31 LEU HD11 1 1
1 371 1 1 23 LEU HD12 H 3.480 12.713 -8.439 1.00 . A A . 31 LEU HD12 1 1
1 372 1 1 23 LEU HD13 H 2.344 11.931 -9.538 1.00 . A A . 31 LEU HD13 1 1
1 373 1 1 23 LEU HD21 H 0.745 13.516 -5.930 1.00 . A A . 31 LEU HD21 1 1
1 374 1 1 23 LEU HD22 H 2.488 13.641 -6.159 1.00 . A A . 31 LEU HD22 1 1
1 375 1 1 23 LEU HD23 H 1.733 12.060 -5.984 1.00 . A A . 31 LEU HD23 1 1
1 376 1 1 23 LEU HG H 0.477 12.483 -8.123 1.00 . A A . 31 LEU HG 1 1
1 377 1 1 23 LEU N N -0.866 14.380 -9.425 1.00 . A A . 31 LEU N 1 1
1 378 1 1 23 LEU O O -0.122 17.303 -7.760 1.00 . A A . 31 LEU O 1 1
1 379 1 1 24 GLY C C 1.800 18.902 -9.708 1.00 . A A . 32 GLY C 1 1
1 380 1 1 24 GLY CA C 0.509 18.304 -10.256 1.00 . A A . 32 GLY CA 1 1
1 381 1 1 24 GLY H H 0.560 16.213 -10.599 1.00 . A A . 32 GLY H 1 1
1 382 1 1 24 GLY HA2 H 0.497 18.407 -11.331 1.00 . A A . 32 GLY HA2 1 1
1 383 1 1 24 GLY HA3 H -0.332 18.836 -9.838 1.00 . A A . 32 GLY HA3 1 1
1 384 1 1 24 GLY N N 0.401 16.892 -9.910 1.00 . A A . 32 GLY N 1 1
1 385 1 1 24 GLY O O 1.921 20.117 -9.724 1.00 . A A . 32 GLY O 1 1
1 386 1 1 24 GLY OXT O 2.649 18.139 -9.280 1.00 . A A . 32 GLY OXT 1 1
1 387 2 2 1 ZN ZN ZN -6.499 3.630 -10.340 1.00 . B A . 300 ZN ZN 1 1
2 388 1 1 1 LYS C C -12.567 -5.167 1.072 1.00 . A A . 9 LYS C 1 1
2 389 1 1 1 LYS CA C -11.759 -5.865 2.163 1.00 . A A . 9 LYS CA 1 1
2 390 1 1 1 LYS CB C -11.614 -7.358 1.845 1.00 . A A . 9 LYS CB 1 1
2 391 1 1 1 LYS CD C -12.894 -9.497 1.662 1.00 . A A . 9 LYS CD 1 1
2 392 1 1 1 LYS CE C -14.193 -10.211 2.041 1.00 . A A . 9 LYS CE 1 1
2 393 1 1 1 LYS CG C -12.878 -8.100 2.286 1.00 . A A . 9 LYS CG 1 1
2 394 1 1 1 LYS H1 H -11.951 -6.246 4.200 1.00 . A A . 9 LYS H1 1 1
2 395 1 1 1 LYS H2 H -13.431 -6.060 3.387 1.00 . A A . 9 LYS H2 1 1
2 396 1 1 1 LYS H3 H -12.472 -4.701 3.734 1.00 . A A . 9 LYS H3 1 1
2 397 1 1 1 LYS HA H -10.779 -5.415 2.224 1.00 . A A . 9 LYS HA 1 1
2 398 1 1 1 LYS HB2 H -11.467 -7.493 0.782 1.00 . A A . 9 LYS HB2 1 1
2 399 1 1 1 LYS HB3 H -10.764 -7.757 2.377 1.00 . A A . 9 LYS HB3 1 1
2 400 1 1 1 LYS HD2 H -12.830 -9.411 0.587 1.00 . A A . 9 LYS HD2 1 1
2 401 1 1 1 LYS HD3 H -12.053 -10.065 2.029 1.00 . A A . 9 LYS HD3 1 1
2 402 1 1 1 LYS HE2 H -14.158 -10.493 3.083 1.00 . A A . 9 LYS HE2 1 1
2 403 1 1 1 LYS HE3 H -15.029 -9.549 1.875 1.00 . A A . 9 LYS HE3 1 1
2 404 1 1 1 LYS HG2 H -12.887 -8.186 3.363 1.00 . A A . 9 LYS HG2 1 1
2 405 1 1 1 LYS HG3 H -13.750 -7.553 1.960 1.00 . A A . 9 LYS HG3 1 1
2 406 1 1 1 LYS HZ1 H -13.419 -11.853 1.022 1.00 . A A . 9 LYS HZ1 1 1
2 407 1 1 1 LYS HZ2 H -14.795 -11.172 0.295 1.00 . A A . 9 LYS HZ2 1 1
2 408 1 1 1 LYS HZ3 H -14.952 -12.119 1.697 1.00 . A A . 9 LYS HZ3 1 1
2 409 1 1 1 LYS N N -12.456 -5.706 3.470 1.00 . A A . 9 LYS N 1 1
2 410 1 1 1 LYS NZ N -14.351 -11.431 1.200 1.00 . A A . 9 LYS NZ 1 1
2 411 1 1 1 LYS O O -13.448 -5.767 0.457 1.00 . A A . 9 LYS O 1 1
2 412 1 1 2 ILE C C -12.003 -2.120 -0.841 1.00 . A A . 10 ILE C 1 1
2 413 1 1 2 ILE CA C -12.958 -3.110 -0.183 1.00 . A A . 10 ILE CA 1 1
2 414 1 1 2 ILE CB C -14.125 -2.347 0.448 1.00 . A A . 10 ILE CB 1 1
2 415 1 1 2 ILE CD1 C -16.172 -2.576 1.869 1.00 . A A . 10 ILE CD1 1 1
2 416 1 1 2 ILE CG1 C -14.920 -3.291 1.357 1.00 . A A . 10 ILE CG1 1 1
2 417 1 1 2 ILE CG2 C -15.038 -1.808 -0.654 1.00 . A A . 10 ILE CG2 1 1
2 418 1 1 2 ILE H H -11.546 -3.469 1.360 1.00 . A A . 10 ILE H 1 1
2 419 1 1 2 ILE HA H -13.346 -3.776 -0.942 1.00 . A A . 10 ILE HA 1 1
2 420 1 1 2 ILE HB H -13.740 -1.523 1.031 1.00 . A A . 10 ILE HB 1 1
2 421 1 1 2 ILE HD11 H -16.900 -2.511 1.074 1.00 . A A . 10 ILE HD11 1 1
2 422 1 1 2 ILE HD12 H -15.909 -1.582 2.199 1.00 . A A . 10 ILE HD12 1 1
2 423 1 1 2 ILE HD13 H -16.590 -3.131 2.696 1.00 . A A . 10 ILE HD13 1 1
2 424 1 1 2 ILE HG12 H -15.209 -4.169 0.798 1.00 . A A . 10 ILE HG12 1 1
2 425 1 1 2 ILE HG13 H -14.308 -3.583 2.196 1.00 . A A . 10 ILE HG13 1 1
2 426 1 1 2 ILE HG21 H -15.716 -1.079 -0.235 1.00 . A A . 10 ILE HG21 1 1
2 427 1 1 2 ILE HG22 H -15.604 -2.622 -1.082 1.00 . A A . 10 ILE HG22 1 1
2 428 1 1 2 ILE HG23 H -14.439 -1.343 -1.422 1.00 . A A . 10 ILE HG23 1 1
2 429 1 1 2 ILE N N -12.259 -3.892 0.837 1.00 . A A . 10 ILE N 1 1
2 430 1 1 2 ILE O O -12.038 -0.924 -0.554 1.00 . A A . 10 ILE O 1 1
2 431 1 1 3 VAL C C -10.843 -1.048 -3.576 1.00 . A A . 11 VAL C 1 1
2 432 1 1 3 VAL CA C -10.187 -1.779 -2.421 1.00 . A A . 11 VAL CA 1 1
2 433 1 1 3 VAL CB C -9.020 -2.616 -2.941 1.00 . A A . 11 VAL CB 1 1
2 434 1 1 3 VAL CG1 C -9.544 -3.709 -3.876 1.00 . A A . 11 VAL CG1 1 1
2 435 1 1 3 VAL CG2 C -8.049 -1.716 -3.708 1.00 . A A . 11 VAL CG2 1 1
2 436 1 1 3 VAL H H -11.168 -3.589 -1.914 1.00 . A A . 11 VAL H 1 1
2 437 1 1 3 VAL HA H -9.802 -1.042 -1.734 1.00 . A A . 11 VAL HA 1 1
2 438 1 1 3 VAL HB H -8.507 -3.070 -2.108 1.00 . A A . 11 VAL HB 1 1
2 439 1 1 3 VAL HG11 H -8.757 -4.421 -4.074 1.00 . A A . 11 VAL HG11 1 1
2 440 1 1 3 VAL HG12 H -9.866 -3.263 -4.806 1.00 . A A . 11 VAL HG12 1 1
2 441 1 1 3 VAL HG13 H -10.378 -4.213 -3.411 1.00 . A A . 11 VAL HG13 1 1
2 442 1 1 3 VAL HG21 H -7.118 -2.241 -3.866 1.00 . A A . 11 VAL HG21 1 1
2 443 1 1 3 VAL HG22 H -7.863 -0.818 -3.138 1.00 . A A . 11 VAL HG22 1 1
2 444 1 1 3 VAL HG23 H -8.480 -1.453 -4.664 1.00 . A A . 11 VAL HG23 1 1
2 445 1 1 3 VAL N N -11.150 -2.627 -1.726 1.00 . A A . 11 VAL N 1 1
2 446 1 1 3 VAL O O -11.535 -1.644 -4.401 1.00 . A A . 11 VAL O 1 1
2 447 1 1 4 SER C C -10.319 2.346 -4.835 1.00 . A A . 12 SER C 1 1
2 448 1 1 4 SER CA C -11.154 1.088 -4.676 1.00 . A A . 12 SER CA 1 1
2 449 1 1 4 SER CB C -12.594 1.474 -4.366 1.00 . A A . 12 SER CB 1 1
2 450 1 1 4 SER H H -10.037 0.658 -2.934 1.00 . A A . 12 SER H 1 1
2 451 1 1 4 SER HA H -11.135 0.539 -5.606 1.00 . A A . 12 SER HA 1 1
2 452 1 1 4 SER HB2 H -12.615 2.157 -3.533 1.00 . A A . 12 SER HB2 1 1
2 453 1 1 4 SER HB3 H -13.021 1.956 -5.235 1.00 . A A . 12 SER HB3 1 1
2 454 1 1 4 SER HG H -13.012 -0.024 -3.198 1.00 . A A . 12 SER HG 1 1
2 455 1 1 4 SER N N -10.605 0.252 -3.622 1.00 . A A . 12 SER N 1 1
2 456 1 1 4 SER O O -10.151 3.125 -3.897 1.00 . A A . 12 SER O 1 1
2 457 1 1 4 SER OG O -13.337 0.307 -4.039 1.00 . A A . 12 SER OG 1 1
2 458 1 1 5 CYS C C -9.774 4.974 -6.156 1.00 . A A . 13 CYS C 1 1
2 459 1 1 5 CYS CA C -8.977 3.684 -6.341 1.00 . A A . 13 CYS CA 1 1
2 460 1 1 5 CYS CB C -8.474 3.581 -7.782 1.00 . A A . 13 CYS CB 1 1
2 461 1 1 5 CYS H H -9.983 1.861 -6.725 1.00 . A A . 13 CYS H 1 1
2 462 1 1 5 CYS HA H -8.127 3.698 -5.676 1.00 . A A . 13 CYS HA 1 1
2 463 1 1 5 CYS HB2 H -8.191 2.560 -7.990 1.00 . A A . 13 CYS HB2 1 1
2 464 1 1 5 CYS HB3 H -9.256 3.879 -8.460 1.00 . A A . 13 CYS HB3 1 1
2 465 1 1 5 CYS N N -9.803 2.526 -6.033 1.00 . A A . 13 CYS N 1 1
2 466 1 1 5 CYS O O -10.896 4.948 -5.646 1.00 . A A . 13 CYS O 1 1
2 467 1 1 5 CYS SG S -7.040 4.657 -8.008 1.00 . A A . 13 CYS SG 1 1
2 468 1 1 6 ARG C C -9.631 8.252 -7.682 1.00 . A A . 14 ARG C 1 1
2 469 1 1 6 ARG CA C -9.865 7.400 -6.438 1.00 . A A . 14 ARG CA 1 1
2 470 1 1 6 ARG CB C -9.342 8.134 -5.187 1.00 . A A . 14 ARG CB 1 1
2 471 1 1 6 ARG CD C -9.811 9.994 -3.582 1.00 . A A . 14 ARG CD 1 1
2 472 1 1 6 ARG CG C -10.427 9.061 -4.625 1.00 . A A . 14 ARG CG 1 1
2 473 1 1 6 ARG CZ C -11.697 10.550 -2.157 1.00 . A A . 14 ARG CZ 1 1
2 474 1 1 6 ARG H H -8.296 6.063 -6.966 1.00 . A A . 14 ARG H 1 1
2 475 1 1 6 ARG HA H -10.930 7.236 -6.330 1.00 . A A . 14 ARG HA 1 1
2 476 1 1 6 ARG HB2 H -9.076 7.405 -4.437 1.00 . A A . 14 ARG HB2 1 1
2 477 1 1 6 ARG HB3 H -8.469 8.717 -5.442 1.00 . A A . 14 ARG HB3 1 1
2 478 1 1 6 ARG HD2 H -9.425 9.409 -2.761 1.00 . A A . 14 ARG HD2 1 1
2 479 1 1 6 ARG HD3 H -9.001 10.550 -4.034 1.00 . A A . 14 ARG HD3 1 1
2 480 1 1 6 ARG HE H -10.844 11.838 -3.429 1.00 . A A . 14 ARG HE 1 1
2 481 1 1 6 ARG HG2 H -10.850 9.647 -5.429 1.00 . A A . 14 ARG HG2 1 1
2 482 1 1 6 ARG HG3 H -11.203 8.470 -4.163 1.00 . A A . 14 ARG HG3 1 1
2 483 1 1 6 ARG HH11 H -10.984 8.685 -2.012 1.00 . A A . 14 ARG HH11 1 1
2 484 1 1 6 ARG HH12 H -12.331 9.053 -0.988 1.00 . A A . 14 ARG HH12 1 1
2 485 1 1 6 ARG HH21 H -12.612 12.330 -2.089 1.00 . A A . 14 ARG HH21 1 1
2 486 1 1 6 ARG HH22 H -13.253 11.117 -1.032 1.00 . A A . 14 ARG HH22 1 1
2 487 1 1 6 ARG N N -9.193 6.101 -6.567 1.00 . A A . 14 ARG N 1 1
2 488 1 1 6 ARG NE N -10.816 10.923 -3.080 1.00 . A A . 14 ARG NE 1 1
2 489 1 1 6 ARG NH1 N -11.669 9.335 -1.682 1.00 . A A . 14 ARG NH1 1 1
2 490 1 1 6 ARG NH2 N -12.590 11.398 -1.726 1.00 . A A . 14 ARG NH2 1 1
2 491 1 1 6 ARG O O -9.863 9.461 -7.674 1.00 . A A . 14 ARG O 1 1
2 492 1 1 7 ILE C C -9.574 7.558 -11.167 1.00 . A A . 15 ILE C 1 1
2 493 1 1 7 ILE CA C -8.905 8.300 -10.017 1.00 . A A . 15 ILE CA 1 1
2 494 1 1 7 ILE CB C -7.397 8.361 -10.268 1.00 . A A . 15 ILE CB 1 1
2 495 1 1 7 ILE CD1 C -5.201 8.760 -9.144 1.00 . A A . 15 ILE CD1 1 1
2 496 1 1 7 ILE CG1 C -6.703 9.046 -9.086 1.00 . A A . 15 ILE CG1 1 1
2 497 1 1 7 ILE CG2 C -7.125 9.154 -11.548 1.00 . A A . 15 ILE CG2 1 1
2 498 1 1 7 ILE H H -9.008 6.644 -8.695 1.00 . A A . 15 ILE H 1 1
2 499 1 1 7 ILE HA H -9.294 9.308 -9.974 1.00 . A A . 15 ILE HA 1 1
2 500 1 1 7 ILE HB H -7.013 7.357 -10.381 1.00 . A A . 15 ILE HB 1 1
2 501 1 1 7 ILE HD11 H -4.820 9.037 -10.115 1.00 . A A . 15 ILE HD11 1 1
2 502 1 1 7 ILE HD12 H -5.031 7.706 -8.978 1.00 . A A . 15 ILE HD12 1 1
2 503 1 1 7 ILE HD13 H -4.695 9.332 -8.381 1.00 . A A . 15 ILE HD13 1 1
2 504 1 1 7 ILE HG12 H -6.869 10.113 -9.138 1.00 . A A . 15 ILE HG12 1 1
2 505 1 1 7 ILE HG13 H -7.102 8.665 -8.160 1.00 . A A . 15 ILE HG13 1 1
2 506 1 1 7 ILE HG21 H -6.075 9.398 -11.605 1.00 . A A . 15 ILE HG21 1 1
2 507 1 1 7 ILE HG22 H -7.707 10.064 -11.538 1.00 . A A . 15 ILE HG22 1 1
2 508 1 1 7 ILE HG23 H -7.403 8.560 -12.406 1.00 . A A . 15 ILE HG23 1 1
2 509 1 1 7 ILE N N -9.171 7.608 -8.753 1.00 . A A . 15 ILE N 1 1
2 510 1 1 7 ILE O O -10.051 8.168 -12.123 1.00 . A A . 15 ILE O 1 1
2 511 1 1 8 CYS C C -11.091 4.321 -11.438 1.00 . A A . 16 CYS C 1 1
2 512 1 1 8 CYS CA C -10.203 5.382 -12.084 1.00 . A A . 16 CYS CA 1 1
2 513 1 1 8 CYS CB C -9.100 4.706 -12.896 1.00 . A A . 16 CYS CB 1 1
2 514 1 1 8 CYS H H -9.197 5.813 -10.275 1.00 . A A . 16 CYS H 1 1
2 515 1 1 8 CYS HA H -10.807 5.984 -12.749 1.00 . A A . 16 CYS HA 1 1
2 516 1 1 8 CYS HB2 H -9.531 4.212 -13.754 1.00 . A A . 16 CYS HB2 1 1
2 517 1 1 8 CYS HB3 H -8.392 5.450 -13.224 1.00 . A A . 16 CYS HB3 1 1
2 518 1 1 8 CYS N N -9.600 6.232 -11.061 1.00 . A A . 16 CYS N 1 1
2 519 1 1 8 CYS O O -11.876 3.659 -12.118 1.00 . A A . 16 CYS O 1 1
2 520 1 1 8 CYS SG S -8.253 3.489 -11.859 1.00 . A A . 16 CYS SG 1 1
2 521 1 1 9 LYS C C -11.482 1.782 -9.892 1.00 . A A . 17 LYS C 1 1
2 522 1 1 9 LYS CA C -11.766 3.193 -9.392 1.00 . A A . 17 LYS CA 1 1
2 523 1 1 9 LYS CB C -13.252 3.514 -9.554 1.00 . A A . 17 LYS CB 1 1
2 524 1 1 9 LYS CD C -14.961 5.339 -9.547 1.00 . A A . 17 LYS CD 1 1
2 525 1 1 9 LYS CE C -15.275 6.716 -8.957 1.00 . A A . 17 LYS CE 1 1
2 526 1 1 9 LYS CG C -13.484 5.011 -9.324 1.00 . A A . 17 LYS CG 1 1
2 527 1 1 9 LYS H H -10.331 4.723 -9.626 1.00 . A A . 17 LYS H 1 1
2 528 1 1 9 LYS HA H -11.513 3.249 -8.344 1.00 . A A . 17 LYS HA 1 1
2 529 1 1 9 LYS HB2 H -13.574 3.246 -10.550 1.00 . A A . 17 LYS HB2 1 1
2 530 1 1 9 LYS HB3 H -13.817 2.952 -8.831 1.00 . A A . 17 LYS HB3 1 1
2 531 1 1 9 LYS HD2 H -15.171 5.346 -10.607 1.00 . A A . 17 LYS HD2 1 1
2 532 1 1 9 LYS HD3 H -15.574 4.594 -9.063 1.00 . A A . 17 LYS HD3 1 1
2 533 1 1 9 LYS HE2 H -16.332 6.918 -9.054 1.00 . A A . 17 LYS HE2 1 1
2 534 1 1 9 LYS HE3 H -15.002 6.731 -7.912 1.00 . A A . 17 LYS HE3 1 1
2 535 1 1 9 LYS HG2 H -13.205 5.267 -8.313 1.00 . A A . 17 LYS HG2 1 1
2 536 1 1 9 LYS HG3 H -12.885 5.582 -10.019 1.00 . A A . 17 LYS HG3 1 1
2 537 1 1 9 LYS HZ1 H -14.944 8.687 -9.540 1.00 . A A . 17 LYS HZ1 1 1
2 538 1 1 9 LYS HZ2 H -14.494 7.535 -10.705 1.00 . A A . 17 LYS HZ2 1 1
2 539 1 1 9 LYS HZ3 H -13.526 7.782 -9.330 1.00 . A A . 17 LYS HZ3 1 1
2 540 1 1 9 LYS N N -10.967 4.168 -10.120 1.00 . A A . 17 LYS N 1 1
2 541 1 1 9 LYS NZ N -14.501 7.759 -9.688 1.00 . A A . 17 LYS NZ 1 1
2 542 1 1 9 LYS O O -12.402 1.018 -10.188 1.00 . A A . 17 LYS O 1 1
2 543 1 1 10 GLY C C -9.542 -0.818 -9.256 1.00 . A A . 18 GLY C 1 1
2 544 1 1 10 GLY CA C -9.788 0.114 -10.438 1.00 . A A . 18 GLY CA 1 1
2 545 1 1 10 GLY H H -9.511 2.091 -9.725 1.00 . A A . 18 GLY H 1 1
2 546 1 1 10 GLY HA2 H -10.559 -0.307 -11.070 1.00 . A A . 18 GLY HA2 1 1
2 547 1 1 10 GLY HA3 H -8.875 0.204 -11.008 1.00 . A A . 18 GLY HA3 1 1
2 548 1 1 10 GLY N N -10.199 1.439 -9.978 1.00 . A A . 18 GLY N 1 1
2 549 1 1 10 GLY O O -10.092 -0.620 -8.172 1.00 . A A . 18 GLY O 1 1
2 550 1 1 11 ASP C C -7.101 -2.403 -7.701 1.00 . A A . 19 ASP C 1 1
2 551 1 1 11 ASP CA C -8.387 -2.804 -8.425 1.00 . A A . 19 ASP CA 1 1
2 552 1 1 11 ASP CB C -8.235 -4.206 -9.048 1.00 . A A . 19 ASP CB 1 1
2 553 1 1 11 ASP CG C -8.603 -5.289 -8.036 1.00 . A A . 19 ASP CG 1 1
2 554 1 1 11 ASP H H -8.305 -1.937 -10.359 1.00 . A A . 19 ASP H 1 1
2 555 1 1 11 ASP HA H -9.196 -2.827 -7.706 1.00 . A A . 19 ASP HA 1 1
2 556 1 1 11 ASP HB2 H -8.894 -4.283 -9.901 1.00 . A A . 19 ASP HB2 1 1
2 557 1 1 11 ASP HB3 H -7.216 -4.352 -9.377 1.00 . A A . 19 ASP HB3 1 1
2 558 1 1 11 ASP N N -8.711 -1.835 -9.474 1.00 . A A . 19 ASP N 1 1
2 559 1 1 11 ASP O O -6.111 -3.133 -7.720 1.00 . A A . 19 ASP O 1 1
2 560 1 1 11 ASP OD1 O -9.745 -5.313 -7.611 1.00 . A A . 19 ASP OD1 1 1
2 561 1 1 11 ASP OD2 O -7.734 -6.078 -7.702 1.00 . A A . 19 ASP OD2 1 1
2 562 1 1 12 HIS C C -6.277 0.595 -5.682 1.00 . A A . 20 HIS C 1 1
2 563 1 1 12 HIS CA C -5.965 -0.747 -6.336 1.00 . A A . 20 HIS CA 1 1
2 564 1 1 12 HIS CB C -4.776 -0.587 -7.285 1.00 . A A . 20 HIS CB 1 1
2 565 1 1 12 HIS CD2 C -5.593 1.392 -8.808 1.00 . A A . 20 HIS CD2 1 1
2 566 1 1 12 HIS CE1 C -5.778 0.301 -10.670 1.00 . A A . 20 HIS CE1 1 1
2 567 1 1 12 HIS CG C -5.231 0.094 -8.546 1.00 . A A . 20 HIS CG 1 1
2 568 1 1 12 HIS H H -7.943 -0.698 -7.078 1.00 . A A . 20 HIS H 1 1
2 569 1 1 12 HIS HA H -5.704 -1.459 -5.567 1.00 . A A . 20 HIS HA 1 1
2 570 1 1 12 HIS HB2 H -4.011 0.009 -6.809 1.00 . A A . 20 HIS HB2 1 1
2 571 1 1 12 HIS HB3 H -4.372 -1.559 -7.527 1.00 . A A . 20 HIS HB3 1 1
2 572 1 1 12 HIS HD2 H -5.613 2.192 -8.082 1.00 . A A . 20 HIS HD2 1 1
2 573 1 1 12 HIS HE1 H -5.965 0.055 -11.705 1.00 . A A . 20 HIS HE1 1 1
2 574 1 1 12 HIS N N -7.127 -1.237 -7.063 1.00 . A A . 20 HIS N 1 1
2 575 1 1 12 HIS ND1 N -5.357 -0.584 -9.748 1.00 . A A . 20 HIS ND1 1 1
2 576 1 1 12 HIS NE2 N -5.937 1.521 -10.149 1.00 . A A . 20 HIS NE2 1 1
2 577 1 1 12 HIS O O -6.935 1.449 -6.275 1.00 . A A . 20 HIS O 1 1
2 578 1 1 13 TRP C C -5.550 3.205 -4.555 1.00 . A A . 21 TRP C 1 1
2 579 1 1 13 TRP CA C -6.023 2.011 -3.731 1.00 . A A . 21 TRP CA 1 1
2 580 1 1 13 TRP CB C -5.272 1.979 -2.396 1.00 . A A . 21 TRP CB 1 1
2 581 1 1 13 TRP CD1 C -5.770 -0.275 -1.363 1.00 . A A . 21 TRP CD1 1 1
2 582 1 1 13 TRP CD2 C -6.976 1.385 -0.440 1.00 . A A . 21 TRP CD2 1 1
2 583 1 1 13 TRP CE2 C -7.350 0.193 0.224 1.00 . A A . 21 TRP CE2 1 1
2 584 1 1 13 TRP CE3 C -7.594 2.585 -0.046 1.00 . A A . 21 TRP CE3 1 1
2 585 1 1 13 TRP CG C -5.971 1.061 -1.444 1.00 . A A . 21 TRP CG 1 1
2 586 1 1 13 TRP CH2 C -8.906 1.393 1.624 1.00 . A A . 21 TRP CH2 1 1
2 587 1 1 13 TRP CZ2 C -8.302 0.191 1.243 1.00 . A A . 21 TRP CZ2 1 1
2 588 1 1 13 TRP CZ3 C -8.553 2.588 0.980 1.00 . A A . 21 TRP CZ3 1 1
2 589 1 1 13 TRP H H -5.278 0.053 -4.043 1.00 . A A . 21 TRP H 1 1
2 590 1 1 13 TRP HA H -7.081 2.117 -3.537 1.00 . A A . 21 TRP HA 1 1
2 591 1 1 13 TRP HB2 H -4.265 1.626 -2.560 1.00 . A A . 21 TRP HB2 1 1
2 592 1 1 13 TRP HB3 H -5.239 2.974 -1.977 1.00 . A A . 21 TRP HB3 1 1
2 593 1 1 13 TRP HD1 H -5.083 -0.844 -1.972 1.00 . A A . 21 TRP HD1 1 1
2 594 1 1 13 TRP HE1 H -6.634 -1.734 -0.115 1.00 . A A . 21 TRP HE1 1 1
2 595 1 1 13 TRP HE3 H -7.329 3.511 -0.535 1.00 . A A . 21 TRP HE3 1 1
2 596 1 1 13 TRP HH2 H -9.644 1.401 2.411 1.00 . A A . 21 TRP HH2 1 1
2 597 1 1 13 TRP HZ2 H -8.571 -0.732 1.735 1.00 . A A . 21 TRP HZ2 1 1
2 598 1 1 13 TRP HZ3 H -9.021 3.515 1.275 1.00 . A A . 21 TRP HZ3 1 1
2 599 1 1 13 TRP N N -5.797 0.770 -4.461 1.00 . A A . 21 TRP N 1 1
2 600 1 1 13 TRP NE1 N -6.587 -0.791 -0.374 1.00 . A A . 21 TRP NE1 1 1
2 601 1 1 13 TRP O O -5.198 3.062 -5.726 1.00 . A A . 21 TRP O 1 1
2 602 1 1 14 THR C C -3.590 5.697 -4.621 1.00 . A A . 22 THR C 1 1
2 603 1 1 14 THR CA C -5.112 5.595 -4.622 1.00 . A A . 22 THR CA 1 1
2 604 1 1 14 THR CB C -5.713 6.825 -3.929 1.00 . A A . 22 THR CB 1 1
2 605 1 1 14 THR CG2 C -5.663 8.029 -4.873 1.00 . A A . 22 THR CG2 1 1
2 606 1 1 14 THR H H -5.836 4.434 -3.002 1.00 . A A . 22 THR H 1 1
2 607 1 1 14 THR HA H -5.462 5.564 -5.644 1.00 . A A . 22 THR HA 1 1
2 608 1 1 14 THR HB H -5.147 7.048 -3.037 1.00 . A A . 22 THR HB 1 1
2 609 1 1 14 THR HG1 H -7.316 5.727 -3.996 1.00 . A A . 22 THR HG1 1 1
2 610 1 1 14 THR HG21 H -6.292 7.841 -5.731 1.00 . A A . 22 THR HG21 1 1
2 611 1 1 14 THR HG22 H -4.645 8.187 -5.202 1.00 . A A . 22 THR HG22 1 1
2 612 1 1 14 THR HG23 H -6.014 8.908 -4.354 1.00 . A A . 22 THR HG23 1 1
2 613 1 1 14 THR N N -5.544 4.382 -3.937 1.00 . A A . 22 THR N 1 1
2 614 1 1 14 THR O O -2.987 6.150 -5.593 1.00 . A A . 22 THR O 1 1
2 615 1 1 14 THR OG1 O -7.062 6.553 -3.577 1.00 . A A . 22 THR OG1 1 1
2 616 1 1 15 THR C C -0.873 4.374 -4.410 1.00 . A A . 23 THR C 1 1
2 617 1 1 15 THR CA C -1.523 5.317 -3.402 1.00 . A A . 23 THR CA 1 1
2 618 1 1 15 THR CB C -1.108 4.923 -1.979 1.00 . A A . 23 THR CB 1 1
2 619 1 1 15 THR CG2 C 0.327 5.384 -1.703 1.00 . A A . 23 THR CG2 1 1
2 620 1 1 15 THR H H -3.509 4.919 -2.779 1.00 . A A . 23 THR H 1 1
2 621 1 1 15 THR HA H -1.190 6.324 -3.598 1.00 . A A . 23 THR HA 1 1
2 622 1 1 15 THR HB H -1.162 3.851 -1.873 1.00 . A A . 23 THR HB 1 1
2 623 1 1 15 THR HG1 H -2.587 4.859 -0.717 1.00 . A A . 23 THR HG1 1 1
2 624 1 1 15 THR HG21 H 1.009 4.843 -2.340 1.00 . A A . 23 THR HG21 1 1
2 625 1 1 15 THR HG22 H 0.573 5.191 -0.669 1.00 . A A . 23 THR HG22 1 1
2 626 1 1 15 THR HG23 H 0.411 6.442 -1.901 1.00 . A A . 23 THR HG23 1 1
2 627 1 1 15 THR N N -2.976 5.270 -3.522 1.00 . A A . 23 THR N 1 1
2 628 1 1 15 THR O O 0.351 4.329 -4.534 1.00 . A A . 23 THR O 1 1
2 629 1 1 15 THR OG1 O -1.989 5.534 -1.047 1.00 . A A . 23 THR OG1 1 1
2 630 1 1 16 ARG C C -2.088 2.698 -7.379 1.00 . A A . 24 ARG C 1 1
2 631 1 1 16 ARG CA C -1.202 2.675 -6.134 1.00 . A A . 24 ARG CA 1 1
2 632 1 1 16 ARG CB C -1.171 1.259 -5.537 1.00 . A A . 24 ARG CB 1 1
2 633 1 1 16 ARG CD C -2.545 -0.415 -4.289 1.00 . A A . 24 ARG CD 1 1
2 634 1 1 16 ARG CG C -2.377 1.070 -4.615 1.00 . A A . 24 ARG CG 1 1
2 635 1 1 16 ARG CZ C -1.302 -2.169 -3.161 1.00 . A A . 24 ARG CZ 1 1
2 636 1 1 16 ARG H H -2.669 3.701 -4.990 1.00 . A A . 24 ARG H 1 1
2 637 1 1 16 ARG HA H -0.197 2.953 -6.421 1.00 . A A . 24 ARG HA 1 1
2 638 1 1 16 ARG HB2 H -1.201 0.523 -6.330 1.00 . A A . 24 ARG HB2 1 1
2 639 1 1 16 ARG HB3 H -0.263 1.132 -4.963 1.00 . A A . 24 ARG HB3 1 1
2 640 1 1 16 ARG HD2 H -3.452 -0.556 -3.722 1.00 . A A . 24 ARG HD2 1 1
2 641 1 1 16 ARG HD3 H -2.609 -0.978 -5.208 1.00 . A A . 24 ARG HD3 1 1
2 642 1 1 16 ARG HE H -0.717 -0.257 -3.230 1.00 . A A . 24 ARG HE 1 1
2 643 1 1 16 ARG HG2 H -2.220 1.624 -3.701 1.00 . A A . 24 ARG HG2 1 1
2 644 1 1 16 ARG HG3 H -3.267 1.433 -5.107 1.00 . A A . 24 ARG HG3 1 1
2 645 1 1 16 ARG HH11 H -3.005 -2.716 -4.062 1.00 . A A . 24 ARG HH11 1 1
2 646 1 1 16 ARG HH12 H -2.138 -3.986 -3.265 1.00 . A A . 24 ARG HH12 1 1
2 647 1 1 16 ARG HH21 H 0.426 -1.917 -2.182 1.00 . A A . 24 ARG HH21 1 1
2 648 1 1 16 ARG HH22 H -0.195 -3.534 -2.200 1.00 . A A . 24 ARG HH22 1 1
2 649 1 1 16 ARG N N -1.701 3.621 -5.133 1.00 . A A . 24 ARG N 1 1
2 650 1 1 16 ARG NE N -1.411 -0.891 -3.506 1.00 . A A . 24 ARG NE 1 1
2 651 1 1 16 ARG NH1 N -2.220 -3.024 -3.524 1.00 . A A . 24 ARG NH1 1 1
2 652 1 1 16 ARG NH2 N -0.278 -2.572 -2.460 1.00 . A A . 24 ARG NH2 1 1
2 653 1 1 16 ARG O O -2.649 1.676 -7.774 1.00 . A A . 24 ARG O 1 1
2 654 1 1 17 CYS C C -2.114 4.045 -10.450 1.00 . A A . 25 CYS C 1 1
2 655 1 1 17 CYS CA C -3.017 4.026 -9.209 1.00 . A A . 25 CYS CA 1 1
2 656 1 1 17 CYS CB C -3.799 5.340 -9.143 1.00 . A A . 25 CYS CB 1 1
2 657 1 1 17 CYS H H -1.729 4.652 -7.641 1.00 . A A . 25 CYS H 1 1
2 658 1 1 17 CYS HA H -3.718 3.209 -9.271 1.00 . A A . 25 CYS HA 1 1
2 659 1 1 17 CYS HB2 H -4.454 5.327 -8.286 1.00 . A A . 25 CYS HB2 1 1
2 660 1 1 17 CYS HB3 H -3.110 6.166 -9.056 1.00 . A A . 25 CYS HB3 1 1
2 661 1 1 17 CYS N N -2.204 3.873 -8.000 1.00 . A A . 25 CYS N 1 1
2 662 1 1 17 CYS O O -1.098 4.737 -10.454 1.00 . A A . 25 CYS O 1 1
2 663 1 1 17 CYS SG S -4.782 5.535 -10.652 1.00 . A A . 25 CYS SG 1 1
2 664 1 1 18 PRO C C -1.769 4.602 -13.536 1.00 . A A . 26 PRO C 1 1
2 665 1 1 18 PRO CA C -1.610 3.309 -12.738 1.00 . A A . 26 PRO CA 1 1
2 666 1 1 18 PRO CB C -2.142 2.099 -13.517 1.00 . A A . 26 PRO CB 1 1
2 667 1 1 18 PRO CD C -3.626 2.443 -11.639 1.00 . A A . 26 PRO CD 1 1
2 668 1 1 18 PRO CG C -3.571 1.979 -13.098 1.00 . A A . 26 PRO CG 1 1
2 669 1 1 18 PRO HA H -0.572 3.152 -12.487 1.00 . A A . 26 PRO HA 1 1
2 670 1 1 18 PRO HB2 H -2.066 2.268 -14.584 1.00 . A A . 26 PRO HB2 1 1
2 671 1 1 18 PRO HB3 H -1.599 1.206 -13.240 1.00 . A A . 26 PRO HB3 1 1
2 672 1 1 18 PRO HD2 H -4.537 2.992 -11.450 1.00 . A A . 26 PRO HD2 1 1
2 673 1 1 18 PRO HD3 H -3.541 1.603 -10.967 1.00 . A A . 26 PRO HD3 1 1
2 674 1 1 18 PRO HG2 H -4.193 2.614 -13.720 1.00 . A A . 26 PRO HG2 1 1
2 675 1 1 18 PRO HG3 H -3.901 0.952 -13.168 1.00 . A A . 26 PRO HG3 1 1
2 676 1 1 18 PRO N N -2.444 3.321 -11.500 1.00 . A A . 26 PRO N 1 1
2 677 1 1 18 PRO O O -1.295 4.710 -14.667 1.00 . A A . 26 PRO O 1 1
2 678 1 1 19 TYR C C -2.733 7.989 -12.548 1.00 . A A . 27 TYR C 1 1
2 679 1 1 19 TYR CA C -2.663 6.872 -13.584 1.00 . A A . 27 TYR CA 1 1
2 680 1 1 19 TYR CB C -3.970 6.840 -14.378 1.00 . A A . 27 TYR CB 1 1
2 681 1 1 19 TYR CD1 C -3.000 5.686 -16.400 1.00 . A A . 27 TYR CD1 1 1
2 682 1 1 19 TYR CD2 C -4.855 4.634 -15.241 1.00 . A A . 27 TYR CD2 1 1
2 683 1 1 19 TYR CE1 C -2.971 4.626 -17.314 1.00 . A A . 27 TYR CE1 1 1
2 684 1 1 19 TYR CE2 C -4.825 3.576 -16.156 1.00 . A A . 27 TYR CE2 1 1
2 685 1 1 19 TYR CG C -3.941 5.692 -15.362 1.00 . A A . 27 TYR CG 1 1
2 686 1 1 19 TYR CZ C -3.884 3.571 -17.192 1.00 . A A . 27 TYR CZ 1 1
2 687 1 1 19 TYR H H -2.793 5.435 -12.030 1.00 . A A . 27 TYR H 1 1
2 688 1 1 19 TYR HA H -1.848 7.075 -14.262 1.00 . A A . 27 TYR HA 1 1
2 689 1 1 19 TYR HB2 H -4.800 6.717 -13.697 1.00 . A A . 27 TYR HB2 1 1
2 690 1 1 19 TYR HB3 H -4.082 7.769 -14.915 1.00 . A A . 27 TYR HB3 1 1
2 691 1 1 19 TYR HD1 H -2.297 6.499 -16.495 1.00 . A A . 27 TYR HD1 1 1
2 692 1 1 19 TYR HD2 H -5.582 4.637 -14.442 1.00 . A A . 27 TYR HD2 1 1
2 693 1 1 19 TYR HE1 H -2.245 4.623 -18.113 1.00 . A A . 27 TYR HE1 1 1
2 694 1 1 19 TYR HE2 H -5.528 2.761 -16.063 1.00 . A A . 27 TYR HE2 1 1
2 695 1 1 19 TYR HH H -3.046 2.030 -17.947 1.00 . A A . 27 TYR HH 1 1
2 696 1 1 19 TYR N N -2.441 5.583 -12.932 1.00 . A A . 27 TYR N 1 1
2 697 1 1 19 TYR O O -3.776 8.621 -12.371 1.00 . A A . 27 TYR O 1 1
2 698 1 1 19 TYR OH O -3.855 2.526 -18.094 1.00 . A A . 27 TYR OH 1 1
2 699 1 1 20 LYS C C -1.245 10.623 -11.506 1.00 . A A . 28 LYS C 1 1
2 700 1 1 20 LYS CA C -1.554 9.282 -10.856 1.00 . A A . 28 LYS CA 1 1
2 701 1 1 20 LYS CB C -0.475 8.961 -9.811 1.00 . A A . 28 LYS CB 1 1
2 702 1 1 20 LYS CD C 0.968 7.056 -10.637 1.00 . A A . 28 LYS CD 1 1
2 703 1 1 20 LYS CE C 2.176 6.707 -11.509 1.00 . A A . 28 LYS CE 1 1
2 704 1 1 20 LYS CG C 0.855 8.581 -10.501 1.00 . A A . 28 LYS CG 1 1
2 705 1 1 20 LYS H H -0.820 7.703 -12.061 1.00 . A A . 28 LYS H 1 1
2 706 1 1 20 LYS HA H -2.511 9.349 -10.358 1.00 . A A . 28 LYS HA 1 1
2 707 1 1 20 LYS HB2 H -0.322 9.834 -9.190 1.00 . A A . 28 LYS HB2 1 1
2 708 1 1 20 LYS HB3 H -0.813 8.143 -9.191 1.00 . A A . 28 LYS HB3 1 1
2 709 1 1 20 LYS HD2 H 1.091 6.619 -9.658 1.00 . A A . 28 LYS HD2 1 1
2 710 1 1 20 LYS HD3 H 0.072 6.667 -11.093 1.00 . A A . 28 LYS HD3 1 1
2 711 1 1 20 LYS HE2 H 3.081 7.029 -11.016 1.00 . A A . 28 LYS HE2 1 1
2 712 1 1 20 LYS HE3 H 2.212 5.639 -11.663 1.00 . A A . 28 LYS HE3 1 1
2 713 1 1 20 LYS HG2 H 0.903 9.032 -11.483 1.00 . A A . 28 LYS HG2 1 1
2 714 1 1 20 LYS HG3 H 1.684 8.941 -9.906 1.00 . A A . 28 LYS HG3 1 1
2 715 1 1 20 LYS HZ1 H 2.707 8.206 -12.854 1.00 . A A . 28 LYS HZ1 1 1
2 716 1 1 20 LYS HZ2 H 1.079 7.729 -12.954 1.00 . A A . 28 LYS HZ2 1 1
2 717 1 1 20 LYS HZ3 H 2.300 6.731 -13.587 1.00 . A A . 28 LYS HZ3 1 1
2 718 1 1 20 LYS N N -1.616 8.232 -11.871 1.00 . A A . 28 LYS N 1 1
2 719 1 1 20 LYS NZ N 2.057 7.395 -12.826 1.00 . A A . 28 LYS NZ 1 1
2 720 1 1 20 LYS O O -0.736 11.537 -10.857 1.00 . A A . 28 LYS O 1 1
2 721 1 1 21 ASP C C -2.079 13.118 -12.907 1.00 . A A . 29 ASP C 1 1
2 722 1 1 21 ASP CA C -1.316 11.954 -13.529 1.00 . A A . 29 ASP CA 1 1
2 723 1 1 21 ASP CB C -1.740 11.727 -14.982 1.00 . A A . 29 ASP CB 1 1
2 724 1 1 21 ASP CG C -3.245 11.936 -15.161 1.00 . A A . 29 ASP CG 1 1
2 725 1 1 21 ASP H H -1.957 9.979 -13.262 1.00 . A A . 29 ASP H 1 1
2 726 1 1 21 ASP HA H -0.265 12.174 -13.498 1.00 . A A . 29 ASP HA 1 1
2 727 1 1 21 ASP HB2 H -1.208 12.404 -15.613 1.00 . A A . 29 ASP HB2 1 1
2 728 1 1 21 ASP HB3 H -1.492 10.716 -15.261 1.00 . A A . 29 ASP HB3 1 1
2 729 1 1 21 ASP N N -1.557 10.735 -12.793 1.00 . A A . 29 ASP N 1 1
2 730 1 1 21 ASP O O -1.999 14.255 -13.371 1.00 . A A . 29 ASP O 1 1
2 731 1 1 21 ASP OD1 O -3.995 11.426 -14.346 1.00 . A A . 29 ASP OD1 1 1
2 732 1 1 21 ASP OD2 O -3.622 12.603 -16.110 1.00 . A A . 29 ASP OD2 1 1
2 733 1 1 22 THR C C -2.714 14.633 -10.215 1.00 . A A . 30 THR C 1 1
2 734 1 1 22 THR CA C -3.601 13.820 -11.153 1.00 . A A . 30 THR CA 1 1
2 735 1 1 22 THR CB C -4.716 13.147 -10.349 1.00 . A A . 30 THR CB 1 1
2 736 1 1 22 THR CG2 C -5.505 12.204 -11.258 1.00 . A A . 30 THR CG2 1 1
2 737 1 1 22 THR H H -2.828 11.883 -11.543 1.00 . A A . 30 THR H 1 1
2 738 1 1 22 THR HA H -4.046 14.485 -11.878 1.00 . A A . 30 THR HA 1 1
2 739 1 1 22 THR HB H -5.380 13.900 -9.954 1.00 . A A . 30 THR HB 1 1
2 740 1 1 22 THR HG1 H -4.246 11.474 -9.474 1.00 . A A . 30 THR HG1 1 1
2 741 1 1 22 THR HG21 H -5.886 12.756 -12.105 1.00 . A A . 30 THR HG21 1 1
2 742 1 1 22 THR HG22 H -6.330 11.779 -10.706 1.00 . A A . 30 THR HG22 1 1
2 743 1 1 22 THR HG23 H -4.859 11.412 -11.605 1.00 . A A . 30 THR HG23 1 1
2 744 1 1 22 THR N N -2.814 12.810 -11.853 1.00 . A A . 30 THR N 1 1
2 745 1 1 22 THR O O -3.001 15.794 -9.925 1.00 . A A . 30 THR O 1 1
2 746 1 1 22 THR OG1 O -4.144 12.408 -9.278 1.00 . A A . 30 THR OG1 1 1
2 747 1 1 23 LEU C C 0.204 15.631 -9.614 1.00 . A A . 31 LEU C 1 1
2 748 1 1 23 LEU CA C -0.714 14.689 -8.838 1.00 . A A . 31 LEU CA 1 1
2 749 1 1 23 LEU CB C 0.128 13.657 -8.083 1.00 . A A . 31 LEU CB 1 1
2 750 1 1 23 LEU CD1 C 0.056 11.523 -6.787 1.00 . A A . 31 LEU CD1 1 1
2 751 1 1 23 LEU CD2 C -1.942 13.024 -6.829 1.00 . A A . 31 LEU CD2 1 1
2 752 1 1 23 LEU CG C -0.761 12.490 -7.646 1.00 . A A . 31 LEU CG 1 1
2 753 1 1 23 LEU H H -1.459 13.088 -10.009 1.00 . A A . 31 LEU H 1 1
2 754 1 1 23 LEU HA H -1.282 15.265 -8.123 1.00 . A A . 31 LEU HA 1 1
2 755 1 1 23 LEU HB2 H 0.913 13.288 -8.729 1.00 . A A . 31 LEU HB2 1 1
2 756 1 1 23 LEU HB3 H 0.566 14.118 -7.211 1.00 . A A . 31 LEU HB3 1 1
2 757 1 1 23 LEU HD11 H 0.507 12.062 -5.967 1.00 . A A . 31 LEU HD11 1 1
2 758 1 1 23 LEU HD12 H 0.829 11.071 -7.390 1.00 . A A . 31 LEU HD12 1 1
2 759 1 1 23 LEU HD13 H -0.593 10.752 -6.396 1.00 . A A . 31 LEU HD13 1 1
2 760 1 1 23 LEU HD21 H -1.588 13.759 -6.120 1.00 . A A . 31 LEU HD21 1 1
2 761 1 1 23 LEU HD22 H -2.411 12.209 -6.299 1.00 . A A . 31 LEU HD22 1 1
2 762 1 1 23 LEU HD23 H -2.661 13.482 -7.493 1.00 . A A . 31 LEU HD23 1 1
2 763 1 1 23 LEU HG H -1.129 11.972 -8.519 1.00 . A A . 31 LEU HG 1 1
2 764 1 1 23 LEU N N -1.637 14.014 -9.743 1.00 . A A . 31 LEU N 1 1
2 765 1 1 23 LEU O O 0.089 16.851 -9.506 1.00 . A A . 31 LEU O 1 1
2 766 1 1 24 GLY C C 2.837 16.801 -10.292 1.00 . A A . 32 GLY C 1 1
2 767 1 1 24 GLY CA C 2.044 15.852 -11.182 1.00 . A A . 32 GLY CA 1 1
2 768 1 1 24 GLY H H 1.156 14.077 -10.440 1.00 . A A . 32 GLY H 1 1
2 769 1 1 24 GLY HA2 H 2.727 15.192 -11.697 1.00 . A A . 32 GLY HA2 1 1
2 770 1 1 24 GLY HA3 H 1.492 16.429 -11.908 1.00 . A A . 32 GLY HA3 1 1
2 771 1 1 24 GLY N N 1.112 15.054 -10.394 1.00 . A A . 32 GLY N 1 1
2 772 1 1 24 GLY O O 4.000 16.522 -10.048 1.00 . A A . 32 GLY O 1 1
2 773 1 1 24 GLY OXT O 2.271 17.795 -9.865 1.00 . A A . 32 GLY OXT 1 1
2 774 2 2 1 ZN ZN ZN -6.452 3.817 -10.359 1.00 . B A . 300 ZN ZN 1 1
3 775 1 1 1 LYS C C -11.616 -3.983 2.121 1.00 . A A . 9 LYS C 1 1
3 776 1 1 1 LYS CA C -10.635 -4.928 2.806 1.00 . A A . 9 LYS CA 1 1
3 777 1 1 1 LYS CB C -9.563 -4.124 3.545 1.00 . A A . 9 LYS CB 1 1
3 778 1 1 1 LYS CD C -7.397 -4.351 4.780 1.00 . A A . 9 LYS CD 1 1
3 779 1 1 1 LYS CE C -7.744 -3.041 5.494 1.00 . A A . 9 LYS CE 1 1
3 780 1 1 1 LYS CG C -8.682 -5.072 4.363 1.00 . A A . 9 LYS CG 1 1
3 781 1 1 1 LYS H1 H -9.841 -6.746 2.172 1.00 . A A . 9 LYS H1 1 1
3 782 1 1 1 LYS H2 H -9.065 -5.385 1.516 1.00 . A A . 9 LYS H2 1 1
3 783 1 1 1 LYS H3 H -10.593 -5.855 0.941 1.00 . A A . 9 LYS H3 1 1
3 784 1 1 1 LYS HA H -11.168 -5.548 3.512 1.00 . A A . 9 LYS HA 1 1
3 785 1 1 1 LYS HB2 H -8.953 -3.593 2.827 1.00 . A A . 9 LYS HB2 1 1
3 786 1 1 1 LYS HB3 H -10.039 -3.416 4.207 1.00 . A A . 9 LYS HB3 1 1
3 787 1 1 1 LYS HD2 H -6.831 -4.985 5.447 1.00 . A A . 9 LYS HD2 1 1
3 788 1 1 1 LYS HD3 H -6.806 -4.134 3.903 1.00 . A A . 9 LYS HD3 1 1
3 789 1 1 1 LYS HE2 H -8.578 -3.201 6.161 1.00 . A A . 9 LYS HE2 1 1
3 790 1 1 1 LYS HE3 H -6.890 -2.704 6.063 1.00 . A A . 9 LYS HE3 1 1
3 791 1 1 1 LYS HG2 H -9.220 -5.390 5.245 1.00 . A A . 9 LYS HG2 1 1
3 792 1 1 1 LYS HG3 H -8.429 -5.935 3.765 1.00 . A A . 9 LYS HG3 1 1
3 793 1 1 1 LYS HZ1 H -9.135 -1.860 4.490 1.00 . A A . 9 LYS HZ1 1 1
3 794 1 1 1 LYS HZ2 H -7.804 -2.324 3.541 1.00 . A A . 9 LYS HZ2 1 1
3 795 1 1 1 LYS HZ3 H -7.630 -1.112 4.718 1.00 . A A . 9 LYS HZ3 1 1
3 796 1 1 1 LYS N N -9.985 -5.794 1.782 1.00 . A A . 9 LYS N 1 1
3 797 1 1 1 LYS NZ N -8.105 -2.006 4.485 1.00 . A A . 9 LYS NZ 1 1
3 798 1 1 1 LYS O O -12.775 -4.332 1.898 1.00 . A A . 9 LYS O 1 1
3 799 1 1 2 ILE C C -11.151 -0.947 0.159 1.00 . A A . 10 ILE C 1 1
3 800 1 1 2 ILE CA C -11.983 -1.786 1.125 1.00 . A A . 10 ILE CA 1 1
3 801 1 1 2 ILE CB C -12.630 -0.870 2.169 1.00 . A A . 10 ILE CB 1 1
3 802 1 1 2 ILE CD1 C -13.934 -0.827 4.305 1.00 . A A . 10 ILE CD1 1 1
3 803 1 1 2 ILE CG1 C -13.156 -1.717 3.334 1.00 . A A . 10 ILE CG1 1 1
3 804 1 1 2 ILE CG2 C -13.791 -0.103 1.530 1.00 . A A . 10 ILE CG2 1 1
3 805 1 1 2 ILE H H -10.209 -2.564 1.990 1.00 . A A . 10 ILE H 1 1
3 806 1 1 2 ILE HA H -12.761 -2.288 0.567 1.00 . A A . 10 ILE HA 1 1
3 807 1 1 2 ILE HB H -11.895 -0.168 2.536 1.00 . A A . 10 ILE HB 1 1
3 808 1 1 2 ILE HD11 H -14.887 -0.566 3.868 1.00 . A A . 10 ILE HD11 1 1
3 809 1 1 2 ILE HD12 H -13.369 0.073 4.501 1.00 . A A . 10 ILE HD12 1 1
3 810 1 1 2 ILE HD13 H -14.096 -1.359 5.230 1.00 . A A . 10 ILE HD13 1 1
3 811 1 1 2 ILE HG12 H -13.806 -2.490 2.951 1.00 . A A . 10 ILE HG12 1 1
3 812 1 1 2 ILE HG13 H -12.324 -2.169 3.853 1.00 . A A . 10 ILE HG13 1 1
3 813 1 1 2 ILE HG21 H -14.076 0.719 2.171 1.00 . A A . 10 ILE HG21 1 1
3 814 1 1 2 ILE HG22 H -14.634 -0.767 1.401 1.00 . A A . 10 ILE HG22 1 1
3 815 1 1 2 ILE HG23 H -13.485 0.279 0.568 1.00 . A A . 10 ILE HG23 1 1
3 816 1 1 2 ILE N N -11.142 -2.784 1.787 1.00 . A A . 10 ILE N 1 1
3 817 1 1 2 ILE O O -11.153 0.282 0.228 1.00 . A A . 10 ILE O 1 1
3 818 1 1 3 VAL C C -10.442 -0.405 -2.867 1.00 . A A . 11 VAL C 1 1
3 819 1 1 3 VAL CA C -9.606 -0.928 -1.717 1.00 . A A . 11 VAL CA 1 1
3 820 1 1 3 VAL CB C -8.524 -1.863 -2.253 1.00 . A A . 11 VAL CB 1 1
3 821 1 1 3 VAL CG1 C -9.170 -3.103 -2.877 1.00 . A A . 11 VAL CG1 1 1
3 822 1 1 3 VAL CG2 C -7.698 -1.133 -3.315 1.00 . A A . 11 VAL CG2 1 1
3 823 1 1 3 VAL H H -10.478 -2.599 -0.747 1.00 . A A . 11 VAL H 1 1
3 824 1 1 3 VAL HA H -9.128 -0.086 -1.241 1.00 . A A . 11 VAL HA 1 1
3 825 1 1 3 VAL HB H -7.880 -2.162 -1.441 1.00 . A A . 11 VAL HB 1 1
3 826 1 1 3 VAL HG11 H -9.614 -2.839 -3.825 1.00 . A A . 11 VAL HG11 1 1
3 827 1 1 3 VAL HG12 H -9.934 -3.484 -2.216 1.00 . A A . 11 VAL HG12 1 1
3 828 1 1 3 VAL HG13 H -8.417 -3.863 -3.031 1.00 . A A . 11 VAL HG13 1 1
3 829 1 1 3 VAL HG21 H -6.792 -1.687 -3.509 1.00 . A A . 11 VAL HG21 1 1
3 830 1 1 3 VAL HG22 H -7.447 -0.145 -2.959 1.00 . A A . 11 VAL HG22 1 1
3 831 1 1 3 VAL HG23 H -8.273 -1.053 -4.226 1.00 . A A . 11 VAL HG23 1 1
3 832 1 1 3 VAL N N -10.441 -1.621 -0.740 1.00 . A A . 11 VAL N 1 1
3 833 1 1 3 VAL O O -11.212 -1.140 -3.487 1.00 . A A . 11 VAL O 1 1
3 834 1 1 4 SER C C -10.288 2.795 -4.655 1.00 . A A . 12 SER C 1 1
3 835 1 1 4 SER CA C -10.992 1.518 -4.231 1.00 . A A . 12 SER CA 1 1
3 836 1 1 4 SER CB C -12.418 1.846 -3.809 1.00 . A A . 12 SER CB 1 1
3 837 1 1 4 SER H H -9.632 1.397 -2.618 1.00 . A A . 12 SER H 1 1
3 838 1 1 4 SER HA H -11.027 0.845 -5.075 1.00 . A A . 12 SER HA 1 1
3 839 1 1 4 SER HB2 H -12.408 2.642 -3.085 1.00 . A A . 12 SER HB2 1 1
3 840 1 1 4 SER HB3 H -12.978 2.161 -4.680 1.00 . A A . 12 SER HB3 1 1
3 841 1 1 4 SER HG H -13.542 0.260 -3.912 1.00 . A A . 12 SER HG 1 1
3 842 1 1 4 SER N N -10.269 0.876 -3.148 1.00 . A A . 12 SER N 1 1
3 843 1 1 4 SER O O -10.085 3.710 -3.857 1.00 . A A . 12 SER O 1 1
3 844 1 1 4 SER OG O -13.018 0.693 -3.233 1.00 . A A . 12 SER OG 1 1
3 845 1 1 5 CYS C C -10.244 5.124 -6.730 1.00 . A A . 13 CYS C 1 1
3 846 1 1 5 CYS CA C -9.243 3.997 -6.483 1.00 . A A . 13 CYS CA 1 1
3 847 1 1 5 CYS CB C -8.557 3.596 -7.790 1.00 . A A . 13 CYS CB 1 1
3 848 1 1 5 CYS H H -10.127 2.072 -6.491 1.00 . A A . 13 CYS H 1 1
3 849 1 1 5 CYS HA H -8.494 4.336 -5.785 1.00 . A A . 13 CYS HA 1 1
3 850 1 1 5 CYS HB2 H -7.702 2.976 -7.570 1.00 . A A . 13 CYS HB2 1 1
3 851 1 1 5 CYS HB3 H -9.250 3.044 -8.406 1.00 . A A . 13 CYS HB3 1 1
3 852 1 1 5 CYS N N -9.926 2.839 -5.921 1.00 . A A . 13 CYS N 1 1
3 853 1 1 5 CYS O O -11.444 4.878 -6.847 1.00 . A A . 13 CYS O 1 1
3 854 1 1 5 CYS SG S -8.010 5.072 -8.678 1.00 . A A . 13 CYS SG 1 1
3 855 1 1 6 ARG C C -10.346 8.169 -8.376 1.00 . A A . 14 ARG C 1 1
3 856 1 1 6 ARG CA C -10.628 7.529 -7.020 1.00 . A A . 14 ARG CA 1 1
3 857 1 1 6 ARG CB C -10.422 8.563 -5.905 1.00 . A A . 14 ARG CB 1 1
3 858 1 1 6 ARG CD C -8.758 10.086 -4.811 1.00 . A A . 14 ARG CD 1 1
3 859 1 1 6 ARG CG C -9.051 9.237 -6.052 1.00 . A A . 14 ARG CG 1 1
3 860 1 1 6 ARG CZ C -9.447 12.220 -3.880 1.00 . A A . 14 ARG CZ 1 1
3 861 1 1 6 ARG H H -8.785 6.506 -6.690 1.00 . A A . 14 ARG H 1 1
3 862 1 1 6 ARG HA H -11.662 7.209 -7.002 1.00 . A A . 14 ARG HA 1 1
3 863 1 1 6 ARG HB2 H -11.198 9.313 -5.967 1.00 . A A . 14 ARG HB2 1 1
3 864 1 1 6 ARG HB3 H -10.478 8.069 -4.947 1.00 . A A . 14 ARG HB3 1 1
3 865 1 1 6 ARG HD2 H -8.964 9.510 -3.922 1.00 . A A . 14 ARG HD2 1 1
3 866 1 1 6 ARG HD3 H -7.717 10.375 -4.815 1.00 . A A . 14 ARG HD3 1 1
3 867 1 1 6 ARG HE H -10.273 11.396 -5.506 1.00 . A A . 14 ARG HE 1 1
3 868 1 1 6 ARG HG2 H -8.288 8.482 -6.161 1.00 . A A . 14 ARG HG2 1 1
3 869 1 1 6 ARG HG3 H -9.053 9.875 -6.924 1.00 . A A . 14 ARG HG3 1 1
3 870 1 1 6 ARG HH11 H -7.965 11.267 -2.931 1.00 . A A . 14 ARG HH11 1 1
3 871 1 1 6 ARG HH12 H -8.435 12.787 -2.248 1.00 . A A . 14 ARG HH12 1 1
3 872 1 1 6 ARG HH21 H -10.897 13.389 -4.615 1.00 . A A . 14 ARG HH21 1 1
3 873 1 1 6 ARG HH22 H -10.096 13.989 -3.200 1.00 . A A . 14 ARG HH22 1 1
3 874 1 1 6 ARG N N -9.752 6.366 -6.798 1.00 . A A . 14 ARG N 1 1
3 875 1 1 6 ARG NE N -9.593 11.282 -4.809 1.00 . A A . 14 ARG NE 1 1
3 876 1 1 6 ARG NH1 N -8.545 12.080 -2.947 1.00 . A A . 14 ARG NH1 1 1
3 877 1 1 6 ARG NH2 N -10.206 13.283 -3.900 1.00 . A A . 14 ARG NH2 1 1
3 878 1 1 6 ARG O O -11.108 9.014 -8.843 1.00 . A A . 14 ARG O 1 1
3 879 1 1 7 ILE C C -9.486 7.478 -11.421 1.00 . A A . 15 ILE C 1 1
3 880 1 1 7 ILE CA C -8.862 8.302 -10.300 1.00 . A A . 15 ILE CA 1 1
3 881 1 1 7 ILE CB C -7.339 8.273 -10.441 1.00 . A A . 15 ILE CB 1 1
3 882 1 1 7 ILE CD1 C -5.215 8.686 -9.187 1.00 . A A . 15 ILE CD1 1 1
3 883 1 1 7 ILE CG1 C -6.696 9.054 -9.287 1.00 . A A . 15 ILE CG1 1 1
3 884 1 1 7 ILE CG2 C -6.939 8.912 -11.772 1.00 . A A . 15 ILE CG2 1 1
3 885 1 1 7 ILE H H -8.677 7.091 -8.573 1.00 . A A . 15 ILE H 1 1
3 886 1 1 7 ILE HA H -9.202 9.325 -10.381 1.00 . A A . 15 ILE HA 1 1
3 887 1 1 7 ILE HB H -6.999 7.248 -10.419 1.00 . A A . 15 ILE HB 1 1
3 888 1 1 7 ILE HD11 H -5.117 7.618 -9.064 1.00 . A A . 15 ILE HD11 1 1
3 889 1 1 7 ILE HD12 H -4.775 9.190 -8.339 1.00 . A A . 15 ILE HD12 1 1
3 890 1 1 7 ILE HD13 H -4.708 8.992 -10.090 1.00 . A A . 15 ILE HD13 1 1
3 891 1 1 7 ILE HG12 H -6.794 10.114 -9.468 1.00 . A A . 15 ILE HG12 1 1
3 892 1 1 7 ILE HG13 H -7.188 8.801 -8.360 1.00 . A A . 15 ILE HG13 1 1
3 893 1 1 7 ILE HG21 H -7.483 9.834 -11.907 1.00 . A A . 15 ILE HG21 1 1
3 894 1 1 7 ILE HG22 H -7.173 8.234 -12.580 1.00 . A A . 15 ILE HG22 1 1
3 895 1 1 7 ILE HG23 H -5.878 9.116 -11.769 1.00 . A A . 15 ILE HG23 1 1
3 896 1 1 7 ILE N N -9.246 7.764 -8.998 1.00 . A A . 15 ILE N 1 1
3 897 1 1 7 ILE O O -9.833 8.007 -12.476 1.00 . A A . 15 ILE O 1 1
3 898 1 1 8 CYS C C -11.141 4.263 -11.516 1.00 . A A . 16 CYS C 1 1
3 899 1 1 8 CYS CA C -10.193 5.265 -12.176 1.00 . A A . 16 CYS CA 1 1
3 900 1 1 8 CYS CB C -9.070 4.517 -12.891 1.00 . A A . 16 CYS CB 1 1
3 901 1 1 8 CYS H H -9.314 5.815 -10.328 1.00 . A A . 16 CYS H 1 1
3 902 1 1 8 CYS HA H -10.749 5.836 -12.907 1.00 . A A . 16 CYS HA 1 1
3 903 1 1 8 CYS HB2 H -9.463 4.029 -13.770 1.00 . A A . 16 CYS HB2 1 1
3 904 1 1 8 CYS HB3 H -8.303 5.221 -13.180 1.00 . A A . 16 CYS HB3 1 1
3 905 1 1 8 CYS N N -9.617 6.174 -11.183 1.00 . A A . 16 CYS N 1 1
3 906 1 1 8 CYS O O -12.007 3.693 -12.181 1.00 . A A . 16 CYS O 1 1
3 907 1 1 8 CYS SG S -8.360 3.283 -11.777 1.00 . A A . 16 CYS SG 1 1
3 908 1 1 9 LYS C C -11.657 1.700 -10.002 1.00 . A A . 17 LYS C 1 1
3 909 1 1 9 LYS CA C -11.841 3.123 -9.485 1.00 . A A . 17 LYS CA 1 1
3 910 1 1 9 LYS CB C -13.307 3.544 -9.628 1.00 . A A . 17 LYS CB 1 1
3 911 1 1 9 LYS CD C -14.870 5.451 -9.187 1.00 . A A . 17 LYS CD 1 1
3 912 1 1 9 LYS CE C -15.058 6.956 -9.393 1.00 . A A . 17 LYS CE 1 1
3 913 1 1 9 LYS CG C -13.423 5.069 -9.502 1.00 . A A . 17 LYS CG 1 1
3 914 1 1 9 LYS H H -10.281 4.532 -9.723 1.00 . A A . 17 LYS H 1 1
3 915 1 1 9 LYS HA H -11.577 3.149 -8.439 1.00 . A A . 17 LYS HA 1 1
3 916 1 1 9 LYS HB2 H -13.679 3.233 -10.594 1.00 . A A . 17 LYS HB2 1 1
3 917 1 1 9 LYS HB3 H -13.889 3.075 -8.851 1.00 . A A . 17 LYS HB3 1 1
3 918 1 1 9 LYS HD2 H -15.535 4.912 -9.846 1.00 . A A . 17 LYS HD2 1 1
3 919 1 1 9 LYS HD3 H -15.093 5.199 -8.163 1.00 . A A . 17 LYS HD3 1 1
3 920 1 1 9 LYS HE2 H -14.774 7.220 -10.400 1.00 . A A . 17 LYS HE2 1 1
3 921 1 1 9 LYS HE3 H -16.095 7.214 -9.230 1.00 . A A . 17 LYS HE3 1 1
3 922 1 1 9 LYS HG2 H -12.780 5.417 -8.707 1.00 . A A . 17 LYS HG2 1 1
3 923 1 1 9 LYS HG3 H -13.127 5.532 -10.431 1.00 . A A . 17 LYS HG3 1 1
3 924 1 1 9 LYS HZ1 H -14.240 7.230 -7.497 1.00 . A A . 17 LYS HZ1 1 1
3 925 1 1 9 LYS HZ2 H -14.551 8.675 -8.334 1.00 . A A . 17 LYS HZ2 1 1
3 926 1 1 9 LYS HZ3 H -13.221 7.710 -8.766 1.00 . A A . 17 LYS HZ3 1 1
3 927 1 1 9 LYS N N -10.982 4.053 -10.209 1.00 . A A . 17 LYS N 1 1
3 928 1 1 9 LYS NZ N -14.203 7.699 -8.425 1.00 . A A . 17 LYS NZ 1 1
3 929 1 1 9 LYS O O -12.625 1.024 -10.349 1.00 . A A . 17 LYS O 1 1
3 930 1 1 10 GLY C C -9.937 -1.058 -9.339 1.00 . A A . 18 GLY C 1 1
3 931 1 1 10 GLY CA C -10.090 -0.099 -10.515 1.00 . A A . 18 GLY CA 1 1
3 932 1 1 10 GLY H H -9.676 1.835 -9.752 1.00 . A A . 18 GLY H 1 1
3 933 1 1 10 GLY HA2 H -10.882 -0.454 -11.163 1.00 . A A . 18 GLY HA2 1 1
3 934 1 1 10 GLY HA3 H -9.164 -0.075 -11.070 1.00 . A A . 18 GLY HA3 1 1
3 935 1 1 10 GLY N N -10.404 1.250 -10.045 1.00 . A A . 18 GLY N 1 1
3 936 1 1 10 GLY O O -10.814 -1.148 -8.480 1.00 . A A . 18 GLY O 1 1
3 937 1 1 11 ASP C C -7.192 -2.421 -7.577 1.00 . A A . 19 ASP C 1 1
3 938 1 1 11 ASP CA C -8.536 -2.732 -8.232 1.00 . A A . 19 ASP CA 1 1
3 939 1 1 11 ASP CB C -8.510 -4.151 -8.804 1.00 . A A . 19 ASP CB 1 1
3 940 1 1 11 ASP CG C -7.338 -4.306 -9.767 1.00 . A A . 19 ASP CG 1 1
3 941 1 1 11 ASP H H -8.153 -1.658 -10.021 1.00 . A A . 19 ASP H 1 1
3 942 1 1 11 ASP HA H -9.312 -2.674 -7.481 1.00 . A A . 19 ASP HA 1 1
3 943 1 1 11 ASP HB2 H -8.408 -4.861 -7.997 1.00 . A A . 19 ASP HB2 1 1
3 944 1 1 11 ASP HB3 H -9.431 -4.337 -9.333 1.00 . A A . 19 ASP HB3 1 1
3 945 1 1 11 ASP N N -8.812 -1.774 -9.306 1.00 . A A . 19 ASP N 1 1
3 946 1 1 11 ASP O O -6.256 -3.217 -7.647 1.00 . A A . 19 ASP O 1 1
3 947 1 1 11 ASP OD1 O -7.147 -3.419 -10.584 1.00 . A A . 19 ASP OD1 1 1
3 948 1 1 11 ASP OD2 O -6.648 -5.308 -9.675 1.00 . A A . 19 ASP OD2 1 1
3 949 1 1 12 HIS C C -6.080 0.503 -5.594 1.00 . A A . 20 HIS C 1 1
3 950 1 1 12 HIS CA C -5.880 -0.844 -6.277 1.00 . A A . 20 HIS CA 1 1
3 951 1 1 12 HIS CB C -4.744 -0.730 -7.296 1.00 . A A . 20 HIS CB 1 1
3 952 1 1 12 HIS CD2 C -5.479 1.407 -8.634 1.00 . A A . 20 HIS CD2 1 1
3 953 1 1 12 HIS CE1 C -5.866 0.468 -10.547 1.00 . A A . 20 HIS CE1 1 1
3 954 1 1 12 HIS CG C -5.214 0.069 -8.481 1.00 . A A . 20 HIS CG 1 1
3 955 1 1 12 HIS H H -7.885 -0.663 -6.915 1.00 . A A . 20 HIS H 1 1
3 956 1 1 12 HIS HA H -5.612 -1.581 -5.535 1.00 . A A . 20 HIS HA 1 1
3 957 1 1 12 HIS HB2 H -3.901 -0.233 -6.841 1.00 . A A . 20 HIS HB2 1 1
3 958 1 1 12 HIS HB3 H -4.446 -1.715 -7.621 1.00 . A A . 20 HIS HB3 1 1
3 959 1 1 12 HIS HD2 H -5.379 2.153 -7.861 1.00 . A A . 20 HIS HD2 1 1
3 960 1 1 12 HIS HE1 H -6.134 0.310 -11.580 1.00 . A A . 20 HIS HE1 1 1
3 961 1 1 12 HIS N N -7.108 -1.256 -6.940 1.00 . A A . 20 HIS N 1 1
3 962 1 1 12 HIS ND1 N -5.467 -0.511 -9.713 1.00 . A A . 20 HIS ND1 1 1
3 963 1 1 12 HIS NE2 N -5.890 1.657 -9.938 1.00 . A A . 20 HIS NE2 1 1
3 964 1 1 12 HIS O O -6.754 1.384 -6.125 1.00 . A A . 20 HIS O 1 1
3 965 1 1 13 TRP C C -5.227 3.086 -4.574 1.00 . A A . 21 TRP C 1 1
3 966 1 1 13 TRP CA C -5.610 1.911 -3.679 1.00 . A A . 21 TRP CA 1 1
3 967 1 1 13 TRP CB C -4.705 1.886 -2.445 1.00 . A A . 21 TRP CB 1 1
3 968 1 1 13 TRP CD1 C -5.291 -0.386 -1.501 1.00 . A A . 21 TRP CD1 1 1
3 969 1 1 13 TRP CD2 C -5.924 1.301 -0.153 1.00 . A A . 21 TRP CD2 1 1
3 970 1 1 13 TRP CE2 C -6.309 0.101 0.489 1.00 . A A . 21 TRP CE2 1 1
3 971 1 1 13 TRP CE3 C -6.210 2.519 0.490 1.00 . A A . 21 TRP CE3 1 1
3 972 1 1 13 TRP CG C -5.280 0.965 -1.416 1.00 . A A . 21 TRP CG 1 1
3 973 1 1 13 TRP CH2 C -7.231 1.326 2.352 1.00 . A A . 21 TRP CH2 1 1
3 974 1 1 13 TRP CZ2 C -6.954 0.108 1.727 1.00 . A A . 21 TRP CZ2 1 1
3 975 1 1 13 TRP CZ3 C -6.859 2.530 1.735 1.00 . A A . 21 TRP CZ3 1 1
3 976 1 1 13 TRP H H -4.965 -0.076 -4.043 1.00 . A A . 21 TRP H 1 1
3 977 1 1 13 TRP HA H -6.636 2.033 -3.361 1.00 . A A . 21 TRP HA 1 1
3 978 1 1 13 TRP HB2 H -3.723 1.540 -2.728 1.00 . A A . 21 TRP HB2 1 1
3 979 1 1 13 TRP HB3 H -4.629 2.882 -2.035 1.00 . A A . 21 TRP HB3 1 1
3 980 1 1 13 TRP HD1 H -4.890 -0.967 -2.317 1.00 . A A . 21 TRP HD1 1 1
3 981 1 1 13 TRP HE1 H -6.038 -1.852 -0.186 1.00 . A A . 21 TRP HE1 1 1
3 982 1 1 13 TRP HE3 H -5.928 3.451 0.023 1.00 . A A . 21 TRP HE3 1 1
3 983 1 1 13 TRP HH2 H -7.730 1.341 3.310 1.00 . A A . 21 TRP HH2 1 1
3 984 1 1 13 TRP HZ2 H -7.239 -0.822 2.197 1.00 . A A . 21 TRP HZ2 1 1
3 985 1 1 13 TRP HZ3 H -7.074 3.471 2.221 1.00 . A A . 21 TRP HZ3 1 1
3 986 1 1 13 TRP N N -5.490 0.659 -4.418 1.00 . A A . 21 TRP N 1 1
3 987 1 1 13 TRP NE1 N -5.901 -0.899 -0.371 1.00 . A A . 21 TRP NE1 1 1
3 988 1 1 13 TRP O O -4.789 2.896 -5.708 1.00 . A A . 21 TRP O 1 1
3 989 1 1 14 THR C C -3.560 5.711 -4.888 1.00 . A A . 22 THR C 1 1
3 990 1 1 14 THR CA C -5.069 5.494 -4.834 1.00 . A A . 22 THR CA 1 1
3 991 1 1 14 THR CB C -5.740 6.718 -4.208 1.00 . A A . 22 THR CB 1 1
3 992 1 1 14 THR CG2 C -7.256 6.610 -4.376 1.00 . A A . 22 THR CG2 1 1
3 993 1 1 14 THR H H -5.754 4.395 -3.154 1.00 . A A . 22 THR H 1 1
3 994 1 1 14 THR HA H -5.439 5.372 -5.840 1.00 . A A . 22 THR HA 1 1
3 995 1 1 14 THR HB H -5.390 7.612 -4.702 1.00 . A A . 22 THR HB 1 1
3 996 1 1 14 THR HG1 H -5.748 5.983 -2.408 1.00 . A A . 22 THR HG1 1 1
3 997 1 1 14 THR HG21 H -7.491 6.418 -5.412 1.00 . A A . 22 THR HG21 1 1
3 998 1 1 14 THR HG22 H -7.718 7.536 -4.067 1.00 . A A . 22 THR HG22 1 1
3 999 1 1 14 THR HG23 H -7.629 5.801 -3.765 1.00 . A A . 22 THR HG23 1 1
3 1000 1 1 14 THR N N -5.398 4.300 -4.063 1.00 . A A . 22 THR N 1 1
3 1001 1 1 14 THR O O -3.066 6.492 -5.700 1.00 . A A . 22 THR O 1 1
3 1002 1 1 14 THR OG1 O -5.415 6.780 -2.827 1.00 . A A . 22 THR OG1 1 1
3 1003 1 1 15 THR C C -0.732 4.300 -5.070 1.00 . A A . 23 THR C 1 1
3 1004 1 1 15 THR CA C -1.380 5.147 -3.978 1.00 . A A . 23 THR CA 1 1
3 1005 1 1 15 THR CB C -0.855 4.705 -2.610 1.00 . A A . 23 THR CB 1 1
3 1006 1 1 15 THR CG2 C -1.260 5.731 -1.550 1.00 . A A . 23 THR CG2 1 1
3 1007 1 1 15 THR H H -3.280 4.410 -3.392 1.00 . A A . 23 THR H 1 1
3 1008 1 1 15 THR HA H -1.113 6.182 -4.134 1.00 . A A . 23 THR HA 1 1
3 1009 1 1 15 THR HB H 0.221 4.634 -2.642 1.00 . A A . 23 THR HB 1 1
3 1010 1 1 15 THR HG1 H -2.160 3.582 -1.703 1.00 . A A . 23 THR HG1 1 1
3 1011 1 1 15 THR HG21 H -2.335 5.837 -1.545 1.00 . A A . 23 THR HG21 1 1
3 1012 1 1 15 THR HG22 H -0.806 6.684 -1.780 1.00 . A A . 23 THR HG22 1 1
3 1013 1 1 15 THR HG23 H -0.927 5.397 -0.580 1.00 . A A . 23 THR HG23 1 1
3 1014 1 1 15 THR N N -2.833 5.018 -4.018 1.00 . A A . 23 THR N 1 1
3 1015 1 1 15 THR O O 0.219 4.731 -5.721 1.00 . A A . 23 THR O 1 1
3 1016 1 1 15 THR OG1 O -1.406 3.438 -2.280 1.00 . A A . 23 THR OG1 1 1
3 1017 1 1 16 ARG C C -1.466 2.329 -7.595 1.00 . A A . 24 ARG C 1 1
3 1018 1 1 16 ARG CA C -0.715 2.173 -6.270 1.00 . A A . 24 ARG CA 1 1
3 1019 1 1 16 ARG CB C -0.819 0.716 -5.766 1.00 . A A . 24 ARG CB 1 1
3 1020 1 1 16 ARG CD C -2.280 -0.887 -4.515 1.00 . A A . 24 ARG CD 1 1
3 1021 1 1 16 ARG CG C -1.987 0.591 -4.783 1.00 . A A . 24 ARG CG 1 1
3 1022 1 1 16 ARG CZ C -1.020 -2.816 -3.749 1.00 . A A . 24 ARG CZ 1 1
3 1023 1 1 16 ARG H H -2.005 2.798 -4.704 1.00 . A A . 24 ARG H 1 1
3 1024 1 1 16 ARG HA H 0.329 2.406 -6.439 1.00 . A A . 24 ARG HA 1 1
3 1025 1 1 16 ARG HB2 H -0.981 0.044 -6.601 1.00 . A A . 24 ARG HB2 1 1
3 1026 1 1 16 ARG HB3 H 0.096 0.440 -5.261 1.00 . A A . 24 ARG HB3 1 1
3 1027 1 1 16 ARG HD2 H -3.179 -0.971 -3.926 1.00 . A A . 24 ARG HD2 1 1
3 1028 1 1 16 ARG HD3 H -2.420 -1.401 -5.455 1.00 . A A . 24 ARG HD3 1 1
3 1029 1 1 16 ARG HE H -0.527 -0.923 -3.324 1.00 . A A . 24 ARG HE 1 1
3 1030 1 1 16 ARG HG2 H -1.725 1.079 -3.855 1.00 . A A . 24 ARG HG2 1 1
3 1031 1 1 16 ARG HG3 H -2.863 1.061 -5.200 1.00 . A A . 24 ARG HG3 1 1
3 1032 1 1 16 ARG HH11 H -2.640 -3.189 -4.864 1.00 . A A . 24 ARG HH11 1 1
3 1033 1 1 16 ARG HH12 H -1.760 -4.582 -4.333 1.00 . A A . 24 ARG HH12 1 1
3 1034 1 1 16 ARG HH21 H 0.634 -2.746 -2.624 1.00 . A A . 24 ARG HH21 1 1
3 1035 1 1 16 ARG HH22 H 0.094 -4.332 -3.064 1.00 . A A . 24 ARG HH22 1 1
3 1036 1 1 16 ARG N N -1.251 3.088 -5.259 1.00 . A A . 24 ARG N 1 1
3 1037 1 1 16 ARG NE N -1.171 -1.496 -3.789 1.00 . A A . 24 ARG NE 1 1
3 1038 1 1 16 ARG NH1 N -1.874 -3.590 -4.363 1.00 . A A . 24 ARG NH1 1 1
3 1039 1 1 16 ARG NH2 N -0.019 -3.339 -3.094 1.00 . A A . 24 ARG NH2 1 1
3 1040 1 1 16 ARG O O -1.414 1.444 -8.450 1.00 . A A . 24 ARG O 1 1
3 1041 1 1 17 CYS C C -1.939 4.180 -10.105 1.00 . A A . 25 CYS C 1 1
3 1042 1 1 17 CYS CA C -2.895 3.694 -9.006 1.00 . A A . 25 CYS CA 1 1
3 1043 1 1 17 CYS CB C -3.982 4.749 -8.773 1.00 . A A . 25 CYS CB 1 1
3 1044 1 1 17 CYS H H -2.161 4.133 -7.061 1.00 . A A . 25 CYS H 1 1
3 1045 1 1 17 CYS HA H -3.365 2.774 -9.304 1.00 . A A . 25 CYS HA 1 1
3 1046 1 1 17 CYS HB2 H -4.693 4.380 -8.051 1.00 . A A . 25 CYS HB2 1 1
3 1047 1 1 17 CYS HB3 H -3.533 5.658 -8.403 1.00 . A A . 25 CYS HB3 1 1
3 1048 1 1 17 CYS N N -2.155 3.455 -7.768 1.00 . A A . 25 CYS N 1 1
3 1049 1 1 17 CYS O O -1.116 5.061 -9.853 1.00 . A A . 25 CYS O 1 1
3 1050 1 1 17 CYS SG S -4.832 5.090 -10.336 1.00 . A A . 25 CYS SG 1 1
3 1051 1 1 18 PRO C C -1.497 5.435 -12.979 1.00 . A A . 26 PRO C 1 1
3 1052 1 1 18 PRO CA C -1.108 4.067 -12.419 1.00 . A A . 26 PRO CA 1 1
3 1053 1 1 18 PRO CB C -1.289 2.961 -13.467 1.00 . A A . 26 PRO CB 1 1
3 1054 1 1 18 PRO CD C -2.943 2.580 -11.749 1.00 . A A . 26 PRO CD 1 1
3 1055 1 1 18 PRO CG C -2.680 2.463 -13.253 1.00 . A A . 26 PRO CG 1 1
3 1056 1 1 18 PRO HA H -0.085 4.082 -12.081 1.00 . A A . 26 PRO HA 1 1
3 1057 1 1 18 PRO HB2 H -1.172 3.360 -14.469 1.00 . A A . 26 PRO HB2 1 1
3 1058 1 1 18 PRO HB3 H -0.580 2.164 -13.298 1.00 . A A . 26 PRO HB3 1 1
3 1059 1 1 18 PRO HD2 H -3.969 2.868 -11.564 1.00 . A A . 26 PRO HD2 1 1
3 1060 1 1 18 PRO HD3 H -2.712 1.652 -11.249 1.00 . A A . 26 PRO HD3 1 1
3 1061 1 1 18 PRO HG2 H -3.382 3.076 -13.807 1.00 . A A . 26 PRO HG2 1 1
3 1062 1 1 18 PRO HG3 H -2.764 1.431 -13.561 1.00 . A A . 26 PRO HG3 1 1
3 1063 1 1 18 PRO N N -2.011 3.641 -11.307 1.00 . A A . 26 PRO N 1 1
3 1064 1 1 18 PRO O O -0.703 6.087 -13.658 1.00 . A A . 26 PRO O 1 1
3 1065 1 1 19 TYR C C -2.890 8.255 -12.162 1.00 . A A . 27 TYR C 1 1
3 1066 1 1 19 TYR CA C -3.213 7.155 -13.168 1.00 . A A . 27 TYR CA 1 1
3 1067 1 1 19 TYR CB C -4.725 7.090 -13.385 1.00 . A A . 27 TYR CB 1 1
3 1068 1 1 19 TYR CD1 C -4.929 6.310 -15.773 1.00 . A A . 27 TYR CD1 1 1
3 1069 1 1 19 TYR CD2 C -5.448 4.751 -13.989 1.00 . A A . 27 TYR CD2 1 1
3 1070 1 1 19 TYR CE1 C -5.221 5.322 -16.720 1.00 . A A . 27 TYR CE1 1 1
3 1071 1 1 19 TYR CE2 C -5.741 3.764 -14.937 1.00 . A A . 27 TYR CE2 1 1
3 1072 1 1 19 TYR CG C -5.042 6.024 -14.408 1.00 . A A . 27 TYR CG 1 1
3 1073 1 1 19 TYR CZ C -5.627 4.049 -16.303 1.00 . A A . 27 TYR CZ 1 1
3 1074 1 1 19 TYR H H -3.312 5.300 -12.146 1.00 . A A . 27 TYR H 1 1
3 1075 1 1 19 TYR HA H -2.737 7.391 -14.109 1.00 . A A . 27 TYR HA 1 1
3 1076 1 1 19 TYR HB2 H -5.212 6.851 -12.451 1.00 . A A . 27 TYR HB2 1 1
3 1077 1 1 19 TYR HB3 H -5.080 8.046 -13.742 1.00 . A A . 27 TYR HB3 1 1
3 1078 1 1 19 TYR HD1 H -4.615 7.292 -16.095 1.00 . A A . 27 TYR HD1 1 1
3 1079 1 1 19 TYR HD2 H -5.535 4.532 -12.935 1.00 . A A . 27 TYR HD2 1 1
3 1080 1 1 19 TYR HE1 H -5.134 5.542 -17.775 1.00 . A A . 27 TYR HE1 1 1
3 1081 1 1 19 TYR HE2 H -6.054 2.782 -14.615 1.00 . A A . 27 TYR HE2 1 1
3 1082 1 1 19 TYR HH H -5.183 2.456 -17.257 1.00 . A A . 27 TYR HH 1 1
3 1083 1 1 19 TYR N N -2.723 5.863 -12.690 1.00 . A A . 27 TYR N 1 1
3 1084 1 1 19 TYR O O -3.555 9.289 -12.124 1.00 . A A . 27 TYR O 1 1
3 1085 1 1 19 TYR OH O -5.916 3.075 -17.238 1.00 . A A . 27 TYR OH 1 1
3 1086 1 1 20 LYS C C -0.774 10.194 -11.005 1.00 . A A . 28 LYS C 1 1
3 1087 1 1 20 LYS CA C -1.459 8.997 -10.350 1.00 . A A . 28 LYS CA 1 1
3 1088 1 1 20 LYS CB C -0.524 8.334 -9.325 1.00 . A A . 28 LYS CB 1 1
3 1089 1 1 20 LYS CD C 0.829 7.399 -11.242 1.00 . A A . 28 LYS CD 1 1
3 1090 1 1 20 LYS CE C 2.242 6.981 -11.652 1.00 . A A . 28 LYS CE 1 1
3 1091 1 1 20 LYS CG C 0.888 8.141 -9.904 1.00 . A A . 28 LYS CG 1 1
3 1092 1 1 20 LYS H H -1.369 7.183 -11.427 1.00 . A A . 28 LYS H 1 1
3 1093 1 1 20 LYS HA H -2.339 9.347 -9.836 1.00 . A A . 28 LYS HA 1 1
3 1094 1 1 20 LYS HB2 H -0.463 8.958 -8.446 1.00 . A A . 28 LYS HB2 1 1
3 1095 1 1 20 LYS HB3 H -0.928 7.372 -9.049 1.00 . A A . 28 LYS HB3 1 1
3 1096 1 1 20 LYS HD2 H 0.212 6.520 -11.141 1.00 . A A . 28 LYS HD2 1 1
3 1097 1 1 20 LYS HD3 H 0.418 8.049 -12.000 1.00 . A A . 28 LYS HD3 1 1
3 1098 1 1 20 LYS HE2 H 2.570 6.162 -11.029 1.00 . A A . 28 LYS HE2 1 1
3 1099 1 1 20 LYS HE3 H 2.241 6.669 -12.685 1.00 . A A . 28 LYS HE3 1 1
3 1100 1 1 20 LYS HG2 H 1.354 9.102 -10.049 1.00 . A A . 28 LYS HG2 1 1
3 1101 1 1 20 LYS HG3 H 1.476 7.564 -9.209 1.00 . A A . 28 LYS HG3 1 1
3 1102 1 1 20 LYS HZ1 H 3.885 8.120 -12.237 1.00 . A A . 28 LYS HZ1 1 1
3 1103 1 1 20 LYS HZ2 H 3.641 8.068 -10.557 1.00 . A A . 28 LYS HZ2 1 1
3 1104 1 1 20 LYS HZ3 H 2.633 9.023 -11.536 1.00 . A A . 28 LYS HZ3 1 1
3 1105 1 1 20 LYS N N -1.864 8.024 -11.351 1.00 . A A . 28 LYS N 1 1
3 1106 1 1 20 LYS NZ N 3.171 8.135 -11.483 1.00 . A A . 28 LYS NZ 1 1
3 1107 1 1 20 LYS O O -0.065 10.955 -10.346 1.00 . A A . 28 LYS O 1 1
3 1108 1 1 21 ASP C C -0.860 12.785 -12.492 1.00 . A A . 29 ASP C 1 1
3 1109 1 1 21 ASP CA C -0.402 11.443 -13.047 1.00 . A A . 29 ASP CA 1 1
3 1110 1 1 21 ASP CB C -0.797 11.290 -14.517 1.00 . A A . 29 ASP CB 1 1
3 1111 1 1 21 ASP CG C -2.194 11.855 -14.777 1.00 . A A . 29 ASP CG 1 1
3 1112 1 1 21 ASP H H -1.560 9.719 -12.780 1.00 . A A . 29 ASP H 1 1
3 1113 1 1 21 ASP HA H 0.666 11.381 -12.962 1.00 . A A . 29 ASP HA 1 1
3 1114 1 1 21 ASP HB2 H -0.087 11.801 -15.127 1.00 . A A . 29 ASP HB2 1 1
3 1115 1 1 21 ASP HB3 H -0.792 10.242 -14.771 1.00 . A A . 29 ASP HB3 1 1
3 1116 1 1 21 ASP N N -0.991 10.351 -12.305 1.00 . A A . 29 ASP N 1 1
3 1117 1 1 21 ASP O O -0.441 13.846 -12.956 1.00 . A A . 29 ASP O 1 1
3 1118 1 1 21 ASP OD1 O -3.080 11.582 -13.982 1.00 . A A . 29 ASP OD1 1 1
3 1119 1 1 21 ASP OD2 O -2.357 12.550 -15.765 1.00 . A A . 29 ASP OD2 1 1
3 1120 1 1 22 THR C C -1.280 14.448 -9.813 1.00 . A A . 30 THR C 1 1
3 1121 1 1 22 THR CA C -2.256 13.921 -10.861 1.00 . A A . 30 THR CA 1 1
3 1122 1 1 22 THR CB C -3.600 13.610 -10.198 1.00 . A A . 30 THR CB 1 1
3 1123 1 1 22 THR CG2 C -4.563 13.038 -11.238 1.00 . A A . 30 THR CG2 1 1
3 1124 1 1 22 THR H H -2.011 11.839 -11.182 1.00 . A A . 30 THR H 1 1
3 1125 1 1 22 THR HA H -2.406 14.682 -11.613 1.00 . A A . 30 THR HA 1 1
3 1126 1 1 22 THR HB H -4.017 14.517 -9.788 1.00 . A A . 30 THR HB 1 1
3 1127 1 1 22 THR HG1 H -3.606 11.793 -9.506 1.00 . A A . 30 THR HG1 1 1
3 1128 1 1 22 THR HG21 H -4.775 13.788 -11.985 1.00 . A A . 30 THR HG21 1 1
3 1129 1 1 22 THR HG22 H -5.482 12.741 -10.753 1.00 . A A . 30 THR HG22 1 1
3 1130 1 1 22 THR HG23 H -4.113 12.177 -11.710 1.00 . A A . 30 THR HG23 1 1
3 1131 1 1 22 THR N N -1.725 12.719 -11.496 1.00 . A A . 30 THR N 1 1
3 1132 1 1 22 THR O O -0.531 15.391 -10.067 1.00 . A A . 30 THR O 1 1
3 1133 1 1 22 THR OG1 O -3.404 12.664 -9.157 1.00 . A A . 30 THR OG1 1 1
3 1134 1 1 23 LEU C C 1.021 13.785 -7.829 1.00 . A A . 31 LEU C 1 1
3 1135 1 1 23 LEU CA C -0.407 14.247 -7.555 1.00 . A A . 31 LEU CA 1 1
3 1136 1 1 23 LEU CB C -0.893 13.664 -6.226 1.00 . A A . 31 LEU CB 1 1
3 1137 1 1 23 LEU CD1 C -2.892 13.302 -4.769 1.00 . A A . 31 LEU CD1 1 1
3 1138 1 1 23 LEU CD2 C -2.844 15.221 -6.370 1.00 . A A . 31 LEU CD2 1 1
3 1139 1 1 23 LEU CG C -2.418 13.768 -6.148 1.00 . A A . 31 LEU CG 1 1
3 1140 1 1 23 LEU H H -1.914 13.085 -8.490 1.00 . A A . 31 LEU H 1 1
3 1141 1 1 23 LEU HA H -0.418 15.324 -7.488 1.00 . A A . 31 LEU HA 1 1
3 1142 1 1 23 LEU HB2 H -0.600 12.625 -6.158 1.00 . A A . 31 LEU HB2 1 1
3 1143 1 1 23 LEU HB3 H -0.455 14.216 -5.409 1.00 . A A . 31 LEU HB3 1 1
3 1144 1 1 23 LEU HD11 H -2.353 13.841 -4.003 1.00 . A A . 31 LEU HD11 1 1
3 1145 1 1 23 LEU HD12 H -2.705 12.243 -4.663 1.00 . A A . 31 LEU HD12 1 1
3 1146 1 1 23 LEU HD13 H -3.949 13.493 -4.668 1.00 . A A . 31 LEU HD13 1 1
3 1147 1 1 23 LEU HD21 H -2.756 15.467 -7.418 1.00 . A A . 31 LEU HD21 1 1
3 1148 1 1 23 LEU HD22 H -2.208 15.876 -5.793 1.00 . A A . 31 LEU HD22 1 1
3 1149 1 1 23 LEU HD23 H -3.870 15.348 -6.056 1.00 . A A . 31 LEU HD23 1 1
3 1150 1 1 23 LEU HG H -2.860 13.140 -6.910 1.00 . A A . 31 LEU HG 1 1
3 1151 1 1 23 LEU N N -1.295 13.832 -8.636 1.00 . A A . 31 LEU N 1 1
3 1152 1 1 23 LEU O O 1.297 13.163 -8.855 1.00 . A A . 31 LEU O 1 1
3 1153 1 1 24 GLY C C 3.861 14.130 -8.416 1.00 . A A . 32 GLY C 1 1
3 1154 1 1 24 GLY CA C 3.321 13.702 -7.055 1.00 . A A . 32 GLY CA 1 1
3 1155 1 1 24 GLY H H 1.647 14.587 -6.105 1.00 . A A . 32 GLY H 1 1
3 1156 1 1 24 GLY HA2 H 3.906 14.169 -6.276 1.00 . A A . 32 GLY HA2 1 1
3 1157 1 1 24 GLY HA3 H 3.403 12.629 -6.966 1.00 . A A . 32 GLY HA3 1 1
3 1158 1 1 24 GLY N N 1.925 14.091 -6.903 1.00 . A A . 32 GLY N 1 1
3 1159 1 1 24 GLY O O 5.016 13.848 -8.688 1.00 . A A . 32 GLY O 1 1
3 1160 1 1 24 GLY OXT O 3.112 14.734 -9.165 1.00 . A A . 32 GLY OXT 1 1
3 1161 2 2 1 ZN ZN ZN -6.658 3.832 -10.465 1.00 . B A . 300 ZN ZN 1 1
4 1162 1 1 1 LYS C C -11.418 -4.753 0.239 1.00 . A A . 9 LYS C 1 1
4 1163 1 1 1 LYS CA C -10.605 -5.826 0.957 1.00 . A A . 9 LYS CA 1 1
4 1164 1 1 1 LYS CB C -11.534 -6.727 1.784 1.00 . A A . 9 LYS CB 1 1
4 1165 1 1 1 LYS CD C -10.665 -6.741 4.169 1.00 . A A . 9 LYS CD 1 1
4 1166 1 1 1 LYS CE C -11.919 -7.034 5.002 1.00 . A A . 9 LYS CE 1 1
4 1167 1 1 1 LYS CG C -10.721 -7.517 2.837 1.00 . A A . 9 LYS CG 1 1
4 1168 1 1 1 LYS H1 H -10.033 -4.321 2.277 1.00 . A A . 9 LYS H1 1 1
4 1169 1 1 1 LYS H2 H -8.769 -4.910 1.306 1.00 . A A . 9 LYS H2 1 1
4 1170 1 1 1 LYS H3 H -9.343 -5.833 2.612 1.00 . A A . 9 LYS H3 1 1
4 1171 1 1 1 LYS HA H -10.083 -6.426 0.227 1.00 . A A . 9 LYS HA 1 1
4 1172 1 1 1 LYS HB2 H -12.279 -6.117 2.278 1.00 . A A . 9 LYS HB2 1 1
4 1173 1 1 1 LYS HB3 H -12.031 -7.422 1.122 1.00 . A A . 9 LYS HB3 1 1
4 1174 1 1 1 LYS HD2 H -9.789 -7.046 4.724 1.00 . A A . 9 LYS HD2 1 1
4 1175 1 1 1 LYS HD3 H -10.610 -5.681 3.970 1.00 . A A . 9 LYS HD3 1 1
4 1176 1 1 1 LYS HE2 H -12.786 -7.057 4.358 1.00 . A A . 9 LYS HE2 1 1
4 1177 1 1 1 LYS HE3 H -11.810 -7.990 5.491 1.00 . A A . 9 LYS HE3 1 1
4 1178 1 1 1 LYS HG2 H -11.188 -8.479 3.001 1.00 . A A . 9 LYS HG2 1 1
4 1179 1 1 1 LYS HG3 H -9.713 -7.674 2.475 1.00 . A A . 9 LYS HG3 1 1
4 1180 1 1 1 LYS HZ1 H -11.235 -5.381 6.067 1.00 . A A . 9 LYS HZ1 1 1
4 1181 1 1 1 LYS HZ2 H -12.257 -6.406 6.958 1.00 . A A . 9 LYS HZ2 1 1
4 1182 1 1 1 LYS HZ3 H -12.906 -5.373 5.777 1.00 . A A . 9 LYS HZ3 1 1
4 1183 1 1 1 LYS N N -9.613 -5.173 1.856 1.00 . A A . 9 LYS N 1 1
4 1184 1 1 1 LYS NZ N -12.092 -5.969 6.029 1.00 . A A . 9 LYS NZ 1 1
4 1185 1 1 1 LYS O O -11.605 -4.813 -0.977 1.00 . A A . 9 LYS O 1 1
4 1186 1 1 2 ILE C C -11.792 -1.723 -0.343 1.00 . A A . 10 ILE C 1 1
4 1187 1 1 2 ILE CA C -12.689 -2.693 0.420 1.00 . A A . 10 ILE CA 1 1
4 1188 1 1 2 ILE CB C -13.436 -1.943 1.526 1.00 . A A . 10 ILE CB 1 1
4 1189 1 1 2 ILE CD1 C -14.850 -2.212 3.570 1.00 . A A . 10 ILE CD1 1 1
4 1190 1 1 2 ILE CG1 C -14.032 -2.953 2.510 1.00 . A A . 10 ILE CG1 1 1
4 1191 1 1 2 ILE CG2 C -14.562 -1.104 0.915 1.00 . A A . 10 ILE CG2 1 1
4 1192 1 1 2 ILE H H -11.718 -3.776 1.960 1.00 . A A . 10 ILE H 1 1
4 1193 1 1 2 ILE HA H -13.410 -3.116 -0.265 1.00 . A A . 10 ILE HA 1 1
4 1194 1 1 2 ILE HB H -12.748 -1.293 2.049 1.00 . A A . 10 ILE HB 1 1
4 1195 1 1 2 ILE HD11 H -14.284 -1.369 3.938 1.00 . A A . 10 ILE HD11 1 1
4 1196 1 1 2 ILE HD12 H -15.071 -2.882 4.388 1.00 . A A . 10 ILE HD12 1 1
4 1197 1 1 2 ILE HD13 H -15.773 -1.862 3.133 1.00 . A A . 10 ILE HD13 1 1
4 1198 1 1 2 ILE HG12 H -14.671 -3.641 1.977 1.00 . A A . 10 ILE HG12 1 1
4 1199 1 1 2 ILE HG13 H -13.236 -3.500 2.991 1.00 . A A . 10 ILE HG13 1 1
4 1200 1 1 2 ILE HG21 H -15.373 -1.752 0.618 1.00 . A A . 10 ILE HG21 1 1
4 1201 1 1 2 ILE HG22 H -14.189 -0.576 0.050 1.00 . A A . 10 ILE HG22 1 1
4 1202 1 1 2 ILE HG23 H -14.919 -0.393 1.646 1.00 . A A . 10 ILE HG23 1 1
4 1203 1 1 2 ILE N N -11.898 -3.773 0.997 1.00 . A A . 10 ILE N 1 1
4 1204 1 1 2 ILE O O -11.844 -0.512 -0.127 1.00 . A A . 10 ILE O 1 1
4 1205 1 1 3 VAL C C -10.790 -0.797 -3.189 1.00 . A A . 11 VAL C 1 1
4 1206 1 1 3 VAL CA C -10.062 -1.438 -2.026 1.00 . A A . 11 VAL CA 1 1
4 1207 1 1 3 VAL CB C -8.898 -2.277 -2.550 1.00 . A A . 11 VAL CB 1 1
4 1208 1 1 3 VAL CG1 C -9.434 -3.434 -3.394 1.00 . A A . 11 VAL CG1 1 1
4 1209 1 1 3 VAL CG2 C -7.986 -1.400 -3.412 1.00 . A A . 11 VAL CG2 1 1
4 1210 1 1 3 VAL H H -10.971 -3.235 -1.364 1.00 . A A . 11 VAL H 1 1
4 1211 1 1 3 VAL HA H -9.666 -0.650 -1.405 1.00 . A A . 11 VAL HA 1 1
4 1212 1 1 3 VAL HB H -8.337 -2.668 -1.716 1.00 . A A . 11 VAL HB 1 1
4 1213 1 1 3 VAL HG11 H -8.642 -4.145 -3.575 1.00 . A A . 11 VAL HG11 1 1
4 1214 1 1 3 VAL HG12 H -9.797 -3.052 -4.337 1.00 . A A . 11 VAL HG12 1 1
4 1215 1 1 3 VAL HG13 H -10.242 -3.920 -2.868 1.00 . A A . 11 VAL HG13 1 1
4 1216 1 1 3 VAL HG21 H -8.463 -1.209 -4.363 1.00 . A A . 11 VAL HG21 1 1
4 1217 1 1 3 VAL HG22 H -7.047 -1.909 -3.575 1.00 . A A . 11 VAL HG22 1 1
4 1218 1 1 3 VAL HG23 H -7.804 -0.463 -2.907 1.00 . A A . 11 VAL HG23 1 1
4 1219 1 1 3 VAL N N -10.968 -2.265 -1.235 1.00 . A A . 11 VAL N 1 1
4 1220 1 1 3 VAL O O -11.497 -1.462 -3.947 1.00 . A A . 11 VAL O 1 1
4 1221 1 1 4 SER C C -10.431 2.528 -4.667 1.00 . A A . 12 SER C 1 1
4 1222 1 1 4 SER CA C -11.217 1.259 -4.396 1.00 . A A . 12 SER CA 1 1
4 1223 1 1 4 SER CB C -12.654 1.620 -4.044 1.00 . A A . 12 SER CB 1 1
4 1224 1 1 4 SER H H -10.012 0.966 -2.685 1.00 . A A . 12 SER H 1 1
4 1225 1 1 4 SER HA H -11.221 0.656 -5.293 1.00 . A A . 12 SER HA 1 1
4 1226 1 1 4 SER HB2 H -13.031 2.318 -4.772 1.00 . A A . 12 SER HB2 1 1
4 1227 1 1 4 SER HB3 H -13.261 0.726 -4.054 1.00 . A A . 12 SER HB3 1 1
4 1228 1 1 4 SER HG H -13.397 2.869 -2.748 1.00 . A A . 12 SER HG 1 1
4 1229 1 1 4 SER N N -10.596 0.504 -3.323 1.00 . A A . 12 SER N 1 1
4 1230 1 1 4 SER O O -10.241 3.365 -3.785 1.00 . A A . 12 SER O 1 1
4 1231 1 1 4 SER OG O -12.688 2.222 -2.756 1.00 . A A . 12 SER OG 1 1
4 1232 1 1 5 CYS C C -10.093 5.060 -6.322 1.00 . A A . 13 CYS C 1 1
4 1233 1 1 5 CYS CA C -9.208 3.817 -6.314 1.00 . A A . 13 CYS CA 1 1
4 1234 1 1 5 CYS CB C -8.630 3.574 -7.708 1.00 . A A . 13 CYS CB 1 1
4 1235 1 1 5 CYS H H -10.174 1.946 -6.543 1.00 . A A . 13 CYS H 1 1
4 1236 1 1 5 CYS HA H -8.396 3.967 -5.619 1.00 . A A . 13 CYS HA 1 1
4 1237 1 1 5 CYS HB2 H -8.258 2.562 -7.771 1.00 . A A . 13 CYS HB2 1 1
4 1238 1 1 5 CYS HB3 H -9.400 3.716 -8.448 1.00 . A A . 13 CYS HB3 1 1
4 1239 1 1 5 CYS N N -9.980 2.654 -5.898 1.00 . A A . 13 CYS N 1 1
4 1240 1 1 5 CYS O O -11.296 4.973 -6.081 1.00 . A A . 13 CYS O 1 1
4 1241 1 1 5 CYS SG S -7.276 4.730 -8.019 1.00 . A A . 13 CYS SG 1 1
4 1242 1 1 6 ARG C C -9.913 8.268 -7.890 1.00 . A A . 14 ARG C 1 1
4 1243 1 1 6 ARG CA C -10.246 7.479 -6.629 1.00 . A A . 14 ARG CA 1 1
4 1244 1 1 6 ARG CB C -9.910 8.323 -5.397 1.00 . A A . 14 ARG CB 1 1
4 1245 1 1 6 ARG CD C -10.339 8.607 -2.947 1.00 . A A . 14 ARG CD 1 1
4 1246 1 1 6 ARG CG C -10.551 7.693 -4.156 1.00 . A A . 14 ARG CG 1 1
4 1247 1 1 6 ARG CZ C -8.564 7.507 -1.705 1.00 . A A . 14 ARG CZ 1 1
4 1248 1 1 6 ARG H H -8.526 6.230 -6.781 1.00 . A A . 14 ARG H 1 1
4 1249 1 1 6 ARG HA H -11.307 7.267 -6.627 1.00 . A A . 14 ARG HA 1 1
4 1250 1 1 6 ARG HB2 H -8.839 8.362 -5.270 1.00 . A A . 14 ARG HB2 1 1
4 1251 1 1 6 ARG HB3 H -10.295 9.322 -5.530 1.00 . A A . 14 ARG HB3 1 1
4 1252 1 1 6 ARG HD2 H -10.550 9.627 -3.226 1.00 . A A . 14 ARG HD2 1 1
4 1253 1 1 6 ARG HD3 H -11.010 8.309 -2.153 1.00 . A A . 14 ARG HD3 1 1
4 1254 1 1 6 ARG HE H -8.316 9.203 -2.737 1.00 . A A . 14 ARG HE 1 1
4 1255 1 1 6 ARG HG2 H -11.610 7.561 -4.325 1.00 . A A . 14 ARG HG2 1 1
4 1256 1 1 6 ARG HG3 H -10.095 6.734 -3.963 1.00 . A A . 14 ARG HG3 1 1
4 1257 1 1 6 ARG HH11 H -10.363 6.629 -1.663 1.00 . A A . 14 ARG HH11 1 1
4 1258 1 1 6 ARG HH12 H -9.116 5.824 -0.771 1.00 . A A . 14 ARG HH12 1 1
4 1259 1 1 6 ARG HH21 H -6.675 8.153 -1.569 1.00 . A A . 14 ARG HH21 1 1
4 1260 1 1 6 ARG HH22 H -7.028 6.687 -0.718 1.00 . A A . 14 ARG HH22 1 1
4 1261 1 1 6 ARG N N -9.493 6.219 -6.597 1.00 . A A . 14 ARG N 1 1
4 1262 1 1 6 ARG NE N -8.961 8.513 -2.478 1.00 . A A . 14 ARG NE 1 1
4 1263 1 1 6 ARG NH1 N -9.414 6.581 -1.352 1.00 . A A . 14 ARG NH1 1 1
4 1264 1 1 6 ARG NH2 N -7.326 7.444 -1.299 1.00 . A A . 14 ARG NH2 1 1
4 1265 1 1 6 ARG O O -10.105 9.482 -7.944 1.00 . A A . 14 ARG O 1 1
4 1266 1 1 7 ILE C C -9.654 7.412 -11.334 1.00 . A A . 15 ILE C 1 1
4 1267 1 1 7 ILE CA C -9.050 8.195 -10.174 1.00 . A A . 15 ILE CA 1 1
4 1268 1 1 7 ILE CB C -7.527 8.224 -10.326 1.00 . A A . 15 ILE CB 1 1
4 1269 1 1 7 ILE CD1 C -5.401 8.669 -9.094 1.00 . A A . 15 ILE CD1 1 1
4 1270 1 1 7 ILE CG1 C -6.904 8.949 -9.129 1.00 . A A . 15 ILE CG1 1 1
4 1271 1 1 7 ILE CG2 C -7.158 8.962 -11.615 1.00 . A A . 15 ILE CG2 1 1
4 1272 1 1 7 ILE H H -9.284 6.599 -8.796 1.00 . A A . 15 ILE H 1 1
4 1273 1 1 7 ILE HA H -9.425 9.208 -10.202 1.00 . A A . 15 ILE HA 1 1
4 1274 1 1 7 ILE HB H -7.151 7.212 -10.373 1.00 . A A . 15 ILE HB 1 1
4 1275 1 1 7 ILE HD11 H -4.955 9.199 -8.266 1.00 . A A . 15 ILE HD11 1 1
4 1276 1 1 7 ILE HD12 H -4.953 9.001 -10.018 1.00 . A A . 15 ILE HD12 1 1
4 1277 1 1 7 ILE HD13 H -5.236 7.609 -8.975 1.00 . A A . 15 ILE HD13 1 1
4 1278 1 1 7 ILE HG12 H -7.072 10.012 -9.223 1.00 . A A . 15 ILE HG12 1 1
4 1279 1 1 7 ILE HG13 H -7.353 8.593 -8.215 1.00 . A A . 15 ILE HG13 1 1
4 1280 1 1 7 ILE HG21 H -7.694 9.898 -11.659 1.00 . A A . 15 ILE HG21 1 1
4 1281 1 1 7 ILE HG22 H -7.425 8.353 -12.467 1.00 . A A . 15 ILE HG22 1 1
4 1282 1 1 7 ILE HG23 H -6.096 9.155 -11.628 1.00 . A A . 15 ILE HG23 1 1
4 1283 1 1 7 ILE N N -9.412 7.565 -8.903 1.00 . A A . 15 ILE N 1 1
4 1284 1 1 7 ILE O O -10.095 7.991 -12.327 1.00 . A A . 15 ILE O 1 1
4 1285 1 1 8 CYS C C -11.153 4.172 -11.619 1.00 . A A . 16 CYS C 1 1
4 1286 1 1 8 CYS CA C -10.210 5.207 -12.232 1.00 . A A . 16 CYS CA 1 1
4 1287 1 1 8 CYS CB C -9.060 4.498 -12.945 1.00 . A A . 16 CYS CB 1 1
4 1288 1 1 8 CYS H H -9.294 5.691 -10.386 1.00 . A A . 16 CYS H 1 1
4 1289 1 1 8 CYS HA H -10.759 5.793 -12.956 1.00 . A A . 16 CYS HA 1 1
4 1290 1 1 8 CYS HB2 H -9.446 3.930 -13.778 1.00 . A A . 16 CYS HB2 1 1
4 1291 1 1 8 CYS HB3 H -8.356 5.234 -13.303 1.00 . A A . 16 CYS HB3 1 1
4 1292 1 1 8 CYS N N -9.665 6.087 -11.197 1.00 . A A . 16 CYS N 1 1
4 1293 1 1 8 CYS O O -11.989 3.598 -12.315 1.00 . A A . 16 CYS O 1 1
4 1294 1 1 8 CYS SG S -8.229 3.387 -11.787 1.00 . A A . 16 CYS SG 1 1
4 1295 1 1 9 LYS C C -11.660 1.575 -10.183 1.00 . A A . 17 LYS C 1 1
4 1296 1 1 9 LYS CA C -11.867 2.979 -9.625 1.00 . A A . 17 LYS CA 1 1
4 1297 1 1 9 LYS CB C -13.336 3.381 -9.772 1.00 . A A . 17 LYS CB 1 1
4 1298 1 1 9 LYS CD C -14.949 5.243 -9.330 1.00 . A A . 17 LYS CD 1 1
4 1299 1 1 9 LYS CE C -15.795 4.718 -10.492 1.00 . A A . 17 LYS CE 1 1
4 1300 1 1 9 LYS CG C -13.478 4.893 -9.570 1.00 . A A . 17 LYS CG 1 1
4 1301 1 1 9 LYS H H -10.337 4.426 -9.804 1.00 . A A . 17 LYS H 1 1
4 1302 1 1 9 LYS HA H -11.613 2.976 -8.576 1.00 . A A . 17 LYS HA 1 1
4 1303 1 1 9 LYS HB2 H -13.686 3.114 -10.757 1.00 . A A . 17 LYS HB2 1 1
4 1304 1 1 9 LYS HB3 H -13.921 2.866 -9.029 1.00 . A A . 17 LYS HB3 1 1
4 1305 1 1 9 LYS HD2 H -15.280 4.788 -8.407 1.00 . A A . 17 LYS HD2 1 1
4 1306 1 1 9 LYS HD3 H -15.057 6.315 -9.263 1.00 . A A . 17 LYS HD3 1 1
4 1307 1 1 9 LYS HE2 H -15.939 3.654 -10.380 1.00 . A A . 17 LYS HE2 1 1
4 1308 1 1 9 LYS HE3 H -16.754 5.214 -10.490 1.00 . A A . 17 LYS HE3 1 1
4 1309 1 1 9 LYS HG2 H -12.892 5.199 -8.715 1.00 . A A . 17 LYS HG2 1 1
4 1310 1 1 9 LYS HG3 H -13.127 5.410 -10.449 1.00 . A A . 17 LYS HG3 1 1
4 1311 1 1 9 LYS HZ1 H -14.983 6.019 -11.900 1.00 . A A . 17 LYS HZ1 1 1
4 1312 1 1 9 LYS HZ2 H -15.660 4.611 -12.567 1.00 . A A . 17 LYS HZ2 1 1
4 1313 1 1 9 LYS HZ3 H -14.161 4.541 -11.770 1.00 . A A . 17 LYS HZ3 1 1
4 1314 1 1 9 LYS N N -11.017 3.941 -10.314 1.00 . A A . 17 LYS N 1 1
4 1315 1 1 9 LYS NZ N -15.097 4.994 -11.779 1.00 . A A . 17 LYS NZ 1 1
4 1316 1 1 9 LYS O O -12.621 0.850 -10.442 1.00 . A A . 17 LYS O 1 1
4 1317 1 1 10 GLY C C -9.973 -1.151 -9.760 1.00 . A A . 18 GLY C 1 1
4 1318 1 1 10 GLY CA C -10.070 -0.130 -10.888 1.00 . A A . 18 GLY CA 1 1
4 1319 1 1 10 GLY H H -9.673 1.813 -10.138 1.00 . A A . 18 GLY H 1 1
4 1320 1 1 10 GLY HA2 H -10.836 -0.440 -11.586 1.00 . A A . 18 GLY HA2 1 1
4 1321 1 1 10 GLY HA3 H -9.121 -0.082 -11.402 1.00 . A A . 18 GLY HA3 1 1
4 1322 1 1 10 GLY N N -10.398 1.194 -10.364 1.00 . A A . 18 GLY N 1 1
4 1323 1 1 10 GLY O O -10.986 -1.570 -9.198 1.00 . A A . 18 GLY O 1 1
4 1324 1 1 11 ASP C C -7.199 -2.219 -7.645 1.00 . A A . 19 ASP C 1 1
4 1325 1 1 11 ASP CA C -8.512 -2.525 -8.368 1.00 . A A . 19 ASP CA 1 1
4 1326 1 1 11 ASP CB C -8.475 -3.939 -8.974 1.00 . A A . 19 ASP CB 1 1
4 1327 1 1 11 ASP CG C -8.927 -4.977 -7.948 1.00 . A A . 19 ASP CG 1 1
4 1328 1 1 11 ASP H H -7.977 -1.182 -9.917 1.00 . A A . 19 ASP H 1 1
4 1329 1 1 11 ASP HA H -9.322 -2.466 -7.654 1.00 . A A . 19 ASP HA 1 1
4 1330 1 1 11 ASP HB2 H -9.140 -3.973 -9.825 1.00 . A A . 19 ASP HB2 1 1
4 1331 1 1 11 ASP HB3 H -7.473 -4.169 -9.303 1.00 . A A . 19 ASP HB3 1 1
4 1332 1 1 11 ASP N N -8.745 -1.549 -9.431 1.00 . A A . 19 ASP N 1 1
4 1333 1 1 11 ASP O O -6.250 -3.002 -7.696 1.00 . A A . 19 ASP O 1 1
4 1334 1 1 11 ASP OD1 O -8.655 -4.779 -6.775 1.00 . A A . 19 ASP OD1 1 1
4 1335 1 1 11 ASP OD2 O -9.537 -5.954 -8.351 1.00 . A A . 19 ASP OD2 1 1
4 1336 1 1 12 HIS C C -6.186 0.698 -5.597 1.00 . A A . 20 HIS C 1 1
4 1337 1 1 12 HIS CA C -5.965 -0.666 -6.242 1.00 . A A . 20 HIS CA 1 1
4 1338 1 1 12 HIS CB C -4.764 -0.597 -7.193 1.00 . A A . 20 HIS CB 1 1
4 1339 1 1 12 HIS CD2 C -5.599 1.309 -8.801 1.00 . A A . 20 HIS CD2 1 1
4 1340 1 1 12 HIS CE1 C -5.637 0.169 -10.642 1.00 . A A . 20 HIS CE1 1 1
4 1341 1 1 12 HIS CG C -5.187 0.035 -8.490 1.00 . A A . 20 HIS CG 1 1
4 1342 1 1 12 HIS H H -7.941 -0.489 -6.963 1.00 . A A . 20 HIS H 1 1
4 1343 1 1 12 HIS HA H -5.759 -1.392 -5.471 1.00 . A A . 20 HIS HA 1 1
4 1344 1 1 12 HIS HB2 H -3.978 -0.005 -6.744 1.00 . A A . 20 HIS HB2 1 1
4 1345 1 1 12 HIS HB3 H -4.396 -1.593 -7.383 1.00 . A A . 20 HIS HB3 1 1
4 1346 1 1 12 HIS HD2 H -5.689 2.124 -8.099 1.00 . A A . 20 HIS HD2 1 1
4 1347 1 1 12 HIS HE1 H -5.759 -0.108 -11.680 1.00 . A A . 20 HIS HE1 1 1
4 1348 1 1 12 HIS N N -7.156 -1.073 -6.971 1.00 . A A . 20 HIS N 1 1
4 1349 1 1 12 HIS ND1 N -5.220 -0.673 -9.680 1.00 . A A . 20 HIS ND1 1 1
4 1350 1 1 12 HIS NE2 N -5.881 1.390 -10.160 1.00 . A A . 20 HIS NE2 1 1
4 1351 1 1 12 HIS O O -6.865 1.559 -6.155 1.00 . A A . 20 HIS O 1 1
4 1352 1 1 13 TRP C C -5.215 3.294 -4.575 1.00 . A A . 21 TRP C 1 1
4 1353 1 1 13 TRP CA C -5.741 2.150 -3.711 1.00 . A A . 21 TRP CA 1 1
4 1354 1 1 13 TRP CB C -4.958 2.097 -2.393 1.00 . A A . 21 TRP CB 1 1
4 1355 1 1 13 TRP CD1 C -5.747 -0.037 -1.287 1.00 . A A . 21 TRP CD1 1 1
4 1356 1 1 13 TRP CD2 C -6.583 1.806 -0.303 1.00 . A A . 21 TRP CD2 1 1
4 1357 1 1 13 TRP CE2 C -7.099 0.697 0.407 1.00 . A A . 21 TRP CE2 1 1
4 1358 1 1 13 TRP CE3 C -6.957 3.095 0.116 1.00 . A A . 21 TRP CE3 1 1
4 1359 1 1 13 TRP CG C -5.727 1.312 -1.375 1.00 . A A . 21 TRP CG 1 1
4 1360 1 1 13 TRP CH2 C -8.319 2.148 1.900 1.00 . A A . 21 TRP CH2 1 1
4 1361 1 1 13 TRP CZ2 C -7.956 0.860 1.496 1.00 . A A . 21 TRP CZ2 1 1
4 1362 1 1 13 TRP CZ3 C -7.821 3.264 1.211 1.00 . A A . 21 TRP CZ3 1 1
4 1363 1 1 13 TRP H H -5.080 0.163 -4.028 1.00 . A A . 21 TRP H 1 1
4 1364 1 1 13 TRP HA H -6.786 2.326 -3.496 1.00 . A A . 21 TRP HA 1 1
4 1365 1 1 13 TRP HB2 H -4.005 1.619 -2.563 1.00 . A A . 21 TRP HB2 1 1
4 1366 1 1 13 TRP HB3 H -4.795 3.100 -2.026 1.00 . A A . 21 TRP HB3 1 1
4 1367 1 1 13 TRP HD1 H -5.215 -0.717 -1.935 1.00 . A A . 21 TRP HD1 1 1
4 1368 1 1 13 TRP HE1 H -6.745 -1.326 0.048 1.00 . A A . 21 TRP HE1 1 1
4 1369 1 1 13 TRP HE3 H -6.579 3.961 -0.407 1.00 . A A . 21 TRP HE3 1 1
4 1370 1 1 13 TRP HH2 H -8.982 2.284 2.741 1.00 . A A . 21 TRP HH2 1 1
4 1371 1 1 13 TRP HZ2 H -8.338 -0.002 2.022 1.00 . A A . 21 TRP HZ2 1 1
4 1372 1 1 13 TRP HZ3 H -8.102 4.257 1.525 1.00 . A A . 21 TRP HZ3 1 1
4 1373 1 1 13 TRP N N -5.607 0.886 -4.422 1.00 . A A . 21 TRP N 1 1
4 1374 1 1 13 TRP NE1 N -6.561 -0.404 -0.229 1.00 . A A . 21 TRP NE1 1 1
4 1375 1 1 13 TRP O O -4.874 3.097 -5.742 1.00 . A A . 21 TRP O 1 1
4 1376 1 1 14 THR C C -3.135 5.672 -4.739 1.00 . A A . 22 THR C 1 1
4 1377 1 1 14 THR CA C -4.660 5.655 -4.720 1.00 . A A . 22 THR CA 1 1
4 1378 1 1 14 THR CB C -5.174 6.935 -4.058 1.00 . A A . 22 THR CB 1 1
4 1379 1 1 14 THR CG2 C -6.688 7.036 -4.244 1.00 . A A . 22 THR CG2 1 1
4 1380 1 1 14 THR H H -5.432 4.585 -3.061 1.00 . A A . 22 THR H 1 1
4 1381 1 1 14 THR HA H -5.024 5.618 -5.736 1.00 . A A . 22 THR HA 1 1
4 1382 1 1 14 THR HB H -4.702 7.791 -4.514 1.00 . A A . 22 THR HB 1 1
4 1383 1 1 14 THR HG1 H -5.552 6.402 -2.226 1.00 . A A . 22 THR HG1 1 1
4 1384 1 1 14 THR HG21 H -7.169 6.210 -3.742 1.00 . A A . 22 THR HG21 1 1
4 1385 1 1 14 THR HG22 H -6.923 7.004 -5.298 1.00 . A A . 22 THR HG22 1 1
4 1386 1 1 14 THR HG23 H -7.040 7.966 -3.824 1.00 . A A . 22 THR HG23 1 1
4 1387 1 1 14 THR N N -5.149 4.488 -3.994 1.00 . A A . 22 THR N 1 1
4 1388 1 1 14 THR O O -2.521 6.076 -5.727 1.00 . A A . 22 THR O 1 1
4 1389 1 1 14 THR OG1 O -4.866 6.905 -2.671 1.00 . A A . 22 THR OG1 1 1
4 1390 1 1 15 THR C C -0.489 4.173 -4.498 1.00 . A A . 23 THR C 1 1
4 1391 1 1 15 THR CA C -1.077 5.203 -3.539 1.00 . A A . 23 THR CA 1 1
4 1392 1 1 15 THR CB C -0.663 4.861 -2.105 1.00 . A A . 23 THR CB 1 1
4 1393 1 1 15 THR CG2 C -1.121 5.973 -1.161 1.00 . A A . 23 THR CG2 1 1
4 1394 1 1 15 THR H H -3.074 4.924 -2.885 1.00 . A A . 23 THR H 1 1
4 1395 1 1 15 THR HA H -0.689 6.178 -3.790 1.00 . A A . 23 THR HA 1 1
4 1396 1 1 15 THR HB H 0.410 4.770 -2.053 1.00 . A A . 23 THR HB 1 1
4 1397 1 1 15 THR HG1 H -2.075 3.529 -2.224 1.00 . A A . 23 THR HG1 1 1
4 1398 1 1 15 THR HG21 H -0.607 6.890 -1.407 1.00 . A A . 23 THR HG21 1 1
4 1399 1 1 15 THR HG22 H -0.895 5.696 -0.142 1.00 . A A . 23 THR HG22 1 1
4 1400 1 1 15 THR HG23 H -2.187 6.119 -1.266 1.00 . A A . 23 THR HG23 1 1
4 1401 1 1 15 THR N N -2.531 5.232 -3.641 1.00 . A A . 23 THR N 1 1
4 1402 1 1 15 THR O O 0.725 3.976 -4.540 1.00 . A A . 23 THR O 1 1
4 1403 1 1 15 THR OG1 O -1.265 3.632 -1.721 1.00 . A A . 23 THR OG1 1 1
4 1404 1 1 16 ARG C C -1.760 2.544 -7.496 1.00 . A A . 24 ARG C 1 1
4 1405 1 1 16 ARG CA C -0.907 2.501 -6.226 1.00 . A A . 24 ARG CA 1 1
4 1406 1 1 16 ARG CB C -0.988 1.110 -5.576 1.00 . A A . 24 ARG CB 1 1
4 1407 1 1 16 ARG CD C -2.476 -0.399 -4.252 1.00 . A A . 24 ARG CD 1 1
4 1408 1 1 16 ARG CG C -2.202 1.053 -4.649 1.00 . A A . 24 ARG CG 1 1
4 1409 1 1 16 ARG CZ C -1.197 -2.223 -3.284 1.00 . A A . 24 ARG CZ 1 1
4 1410 1 1 16 ARG H H -2.314 3.713 -5.188 1.00 . A A . 24 ARG H 1 1
4 1411 1 1 16 ARG HA H 0.122 2.699 -6.498 1.00 . A A . 24 ARG HA 1 1
4 1412 1 1 16 ARG HB2 H -1.077 0.348 -6.339 1.00 . A A . 24 ARG HB2 1 1
4 1413 1 1 16 ARG HB3 H -0.092 0.931 -4.996 1.00 . A A . 24 ARG HB3 1 1
4 1414 1 1 16 ARG HD2 H -3.392 -0.448 -3.684 1.00 . A A . 24 ARG HD2 1 1
4 1415 1 1 16 ARG HD3 H -2.578 -1.000 -5.145 1.00 . A A . 24 ARG HD3 1 1
4 1416 1 1 16 ARG HE H -0.766 -0.289 -3.006 1.00 . A A . 24 ARG HE 1 1
4 1417 1 1 16 ARG HG2 H -2.003 1.637 -3.763 1.00 . A A . 24 ARG HG2 1 1
4 1418 1 1 16 ARG HG3 H -3.064 1.454 -5.158 1.00 . A A . 24 ARG HG3 1 1
4 1419 1 1 16 ARG HH11 H -2.768 -2.733 -4.417 1.00 . A A . 24 ARG HH11 1 1
4 1420 1 1 16 ARG HH12 H -1.873 -4.052 -3.740 1.00 . A A . 24 ARG HH12 1 1
4 1421 1 1 16 ARG HH21 H 0.413 -2.014 -2.114 1.00 . A A . 24 ARG HH21 1 1
4 1422 1 1 16 ARG HH22 H -0.072 -3.645 -2.436 1.00 . A A . 24 ARG HH22 1 1
4 1423 1 1 16 ARG N N -1.356 3.516 -5.268 1.00 . A A . 24 ARG N 1 1
4 1424 1 1 16 ARG NE N -1.379 -0.916 -3.442 1.00 . A A . 24 ARG NE 1 1
4 1425 1 1 16 ARG NH1 N -2.010 -3.069 -3.859 1.00 . A A . 24 ARG NH1 1 1
4 1426 1 1 16 ARG NH2 N -0.209 -2.662 -2.554 1.00 . A A . 24 ARG NH2 1 1
4 1427 1 1 16 ARG O O -1.991 1.519 -8.137 1.00 . A A . 24 ARG O 1 1
4 1428 1 1 17 CYS C C -2.123 4.027 -10.299 1.00 . A A . 25 CYS C 1 1
4 1429 1 1 17 CYS CA C -3.031 3.900 -9.067 1.00 . A A . 25 CYS CA 1 1
4 1430 1 1 17 CYS CB C -3.897 5.157 -8.945 1.00 . A A . 25 CYS CB 1 1
4 1431 1 1 17 CYS H H -1.996 4.526 -7.323 1.00 . A A . 25 CYS H 1 1
4 1432 1 1 17 CYS HA H -3.674 3.042 -9.167 1.00 . A A . 25 CYS HA 1 1
4 1433 1 1 17 CYS HB2 H -4.609 5.025 -8.144 1.00 . A A . 25 CYS HB2 1 1
4 1434 1 1 17 CYS HB3 H -3.271 6.009 -8.732 1.00 . A A . 25 CYS HB3 1 1
4 1435 1 1 17 CYS N N -2.216 3.740 -7.864 1.00 . A A . 25 CYS N 1 1
4 1436 1 1 17 CYS O O -1.138 4.763 -10.258 1.00 . A A . 25 CYS O 1 1
4 1437 1 1 17 CYS SG S -4.783 5.437 -10.500 1.00 . A A . 25 CYS SG 1 1
4 1438 1 1 18 PRO C C -1.773 4.755 -13.352 1.00 . A A . 26 PRO C 1 1
4 1439 1 1 18 PRO CA C -1.572 3.430 -12.618 1.00 . A A . 26 PRO CA 1 1
4 1440 1 1 18 PRO CB C -2.048 2.241 -13.462 1.00 . A A . 26 PRO CB 1 1
4 1441 1 1 18 PRO CD C -3.556 2.426 -11.582 1.00 . A A . 26 PRO CD 1 1
4 1442 1 1 18 PRO CG C -3.474 2.044 -13.063 1.00 . A A . 26 PRO CG 1 1
4 1443 1 1 18 PRO HA H -0.531 3.301 -12.366 1.00 . A A . 26 PRO HA 1 1
4 1444 1 1 18 PRO HB2 H -1.973 2.468 -14.520 1.00 . A A . 26 PRO HB2 1 1
4 1445 1 1 18 PRO HB3 H -1.473 1.358 -13.227 1.00 . A A . 26 PRO HB3 1 1
4 1446 1 1 18 PRO HD2 H -4.490 2.926 -11.371 1.00 . A A . 26 PRO HD2 1 1
4 1447 1 1 18 PRO HD3 H -3.440 1.554 -10.956 1.00 . A A . 26 PRO HD3 1 1
4 1448 1 1 18 PRO HG2 H -4.117 2.686 -13.654 1.00 . A A . 26 PRO HG2 1 1
4 1449 1 1 18 PRO HG3 H -3.763 1.011 -13.191 1.00 . A A . 26 PRO HG3 1 1
4 1450 1 1 18 PRO N N -2.414 3.345 -11.388 1.00 . A A . 26 PRO N 1 1
4 1451 1 1 18 PRO O O -1.329 4.921 -14.489 1.00 . A A . 26 PRO O 1 1
4 1452 1 1 19 TYR C C -2.793 8.080 -12.206 1.00 . A A . 27 TYR C 1 1
4 1453 1 1 19 TYR CA C -2.706 7.007 -13.287 1.00 . A A . 27 TYR CA 1 1
4 1454 1 1 19 TYR CB C -4.017 6.975 -14.074 1.00 . A A . 27 TYR CB 1 1
4 1455 1 1 19 TYR CD1 C -3.028 5.992 -16.174 1.00 . A A . 27 TYR CD1 1 1
4 1456 1 1 19 TYR CD2 C -4.807 4.784 -15.054 1.00 . A A . 27 TYR CD2 1 1
4 1457 1 1 19 TYR CE1 C -2.962 4.990 -17.150 1.00 . A A . 27 TYR CE1 1 1
4 1458 1 1 19 TYR CE2 C -4.741 3.783 -16.030 1.00 . A A . 27 TYR CE2 1 1
4 1459 1 1 19 TYR CG C -3.950 5.890 -15.125 1.00 . A A . 27 TYR CG 1 1
4 1460 1 1 19 TYR CZ C -3.818 3.886 -17.078 1.00 . A A . 27 TYR CZ 1 1
4 1461 1 1 19 TYR H H -2.776 5.506 -11.789 1.00 . A A . 27 TYR H 1 1
4 1462 1 1 19 TYR HA H -1.901 7.258 -13.962 1.00 . A A . 27 TYR HA 1 1
4 1463 1 1 19 TYR HB2 H -4.837 6.779 -13.399 1.00 . A A . 27 TYR HB2 1 1
4 1464 1 1 19 TYR HB3 H -4.167 7.931 -14.553 1.00 . A A . 27 TYR HB3 1 1
4 1465 1 1 19 TYR HD1 H -2.366 6.844 -16.230 1.00 . A A . 27 TYR HD1 1 1
4 1466 1 1 19 TYR HD2 H -5.521 4.703 -14.246 1.00 . A A . 27 TYR HD2 1 1
4 1467 1 1 19 TYR HE1 H -2.249 5.070 -17.958 1.00 . A A . 27 TYR HE1 1 1
4 1468 1 1 19 TYR HE2 H -5.403 2.930 -15.975 1.00 . A A . 27 TYR HE2 1 1
4 1469 1 1 19 TYR HH H -4.551 2.947 -18.571 1.00 . A A . 27 TYR HH 1 1
4 1470 1 1 19 TYR N N -2.447 5.697 -12.693 1.00 . A A . 27 TYR N 1 1
4 1471 1 1 19 TYR O O -3.815 8.750 -12.065 1.00 . A A . 27 TYR O 1 1
4 1472 1 1 19 TYR OH O -3.753 2.898 -18.039 1.00 . A A . 27 TYR OH 1 1
4 1473 1 1 20 LYS C C -1.430 10.624 -10.971 1.00 . A A . 28 LYS C 1 1
4 1474 1 1 20 LYS CA C -1.676 9.238 -10.387 1.00 . A A . 28 LYS CA 1 1
4 1475 1 1 20 LYS CB C -0.569 8.908 -9.374 1.00 . A A . 28 LYS CB 1 1
4 1476 1 1 20 LYS CD C 1.024 7.211 -10.390 1.00 . A A . 28 LYS CD 1 1
4 1477 1 1 20 LYS CE C 1.649 6.532 -9.168 1.00 . A A . 28 LYS CE 1 1
4 1478 1 1 20 LYS CG C 0.786 8.706 -10.099 1.00 . A A . 28 LYS CG 1 1
4 1479 1 1 20 LYS H H -0.930 7.681 -11.612 1.00 . A A . 28 LYS H 1 1
4 1480 1 1 20 LYS HA H -2.625 9.240 -9.875 1.00 . A A . 28 LYS HA 1 1
4 1481 1 1 20 LYS HB2 H -0.482 9.726 -8.673 1.00 . A A . 28 LYS HB2 1 1
4 1482 1 1 20 LYS HB3 H -0.834 8.009 -8.837 1.00 . A A . 28 LYS HB3 1 1
4 1483 1 1 20 LYS HD2 H 0.084 6.733 -10.620 1.00 . A A . 28 LYS HD2 1 1
4 1484 1 1 20 LYS HD3 H 1.691 7.111 -11.233 1.00 . A A . 28 LYS HD3 1 1
4 1485 1 1 20 LYS HE2 H 2.685 6.823 -9.083 1.00 . A A . 28 LYS HE2 1 1
4 1486 1 1 20 LYS HE3 H 1.118 6.832 -8.276 1.00 . A A . 28 LYS HE3 1 1
4 1487 1 1 20 LYS HG2 H 0.786 9.254 -11.033 1.00 . A A . 28 LYS HG2 1 1
4 1488 1 1 20 LYS HG3 H 1.586 9.079 -9.474 1.00 . A A . 28 LYS HG3 1 1
4 1489 1 1 20 LYS HZ1 H 0.925 4.664 -8.598 1.00 . A A . 28 LYS HZ1 1 1
4 1490 1 1 20 LYS HZ2 H 2.508 4.635 -9.211 1.00 . A A . 28 LYS HZ2 1 1
4 1491 1 1 20 LYS HZ3 H 1.190 4.823 -10.266 1.00 . A A . 28 LYS HZ3 1 1
4 1492 1 1 20 LYS N N -1.713 8.240 -11.450 1.00 . A A . 28 LYS N 1 1
4 1493 1 1 20 LYS NZ N 1.561 5.052 -9.322 1.00 . A A . 28 LYS NZ 1 1
4 1494 1 1 20 LYS O O -0.965 11.528 -10.276 1.00 . A A . 28 LYS O 1 1
4 1495 1 1 21 ASP C C -2.344 13.150 -12.224 1.00 . A A . 29 ASP C 1 1
4 1496 1 1 21 ASP CA C -1.561 12.047 -12.924 1.00 . A A . 29 ASP CA 1 1
4 1497 1 1 21 ASP CB C -2.011 11.888 -14.378 1.00 . A A . 29 ASP CB 1 1
4 1498 1 1 21 ASP CG C -3.530 12.023 -14.504 1.00 . A A . 29 ASP CG 1 1
4 1499 1 1 21 ASP H H -2.110 10.034 -12.758 1.00 . A A . 29 ASP H 1 1
4 1500 1 1 21 ASP HA H -0.517 12.300 -12.905 1.00 . A A . 29 ASP HA 1 1
4 1501 1 1 21 ASP HB2 H -1.536 12.633 -14.977 1.00 . A A . 29 ASP HB2 1 1
4 1502 1 1 21 ASP HB3 H -1.716 10.912 -14.728 1.00 . A A . 29 ASP HB3 1 1
4 1503 1 1 21 ASP N N -1.745 10.783 -12.251 1.00 . A A . 29 ASP N 1 1
4 1504 1 1 21 ASP O O -2.272 14.321 -12.596 1.00 . A A . 29 ASP O 1 1
4 1505 1 1 21 ASP OD1 O -4.207 11.017 -14.365 1.00 . A A . 29 ASP OD1 1 1
4 1506 1 1 21 ASP OD2 O -3.989 13.128 -14.736 1.00 . A A . 29 ASP OD2 1 1
4 1507 1 1 22 THR C C -3.075 14.301 -9.303 1.00 . A A . 30 THR C 1 1
4 1508 1 1 22 THR CA C -3.897 13.692 -10.433 1.00 . A A . 30 THR CA 1 1
4 1509 1 1 22 THR CB C -5.114 12.971 -9.848 1.00 . A A . 30 THR CB 1 1
4 1510 1 1 22 THR CG2 C -5.817 12.177 -10.951 1.00 . A A . 30 THR CG2 1 1
4 1511 1 1 22 THR H H -3.091 11.803 -10.972 1.00 . A A . 30 THR H 1 1
4 1512 1 1 22 THR HA H -4.242 14.484 -11.083 1.00 . A A . 30 THR HA 1 1
4 1513 1 1 22 THR HB H -5.800 13.695 -9.439 1.00 . A A . 30 THR HB 1 1
4 1514 1 1 22 THR HG1 H -5.441 11.906 -8.254 1.00 . A A . 30 THR HG1 1 1
4 1515 1 1 22 THR HG21 H -6.800 11.884 -10.612 1.00 . A A . 30 THR HG21 1 1
4 1516 1 1 22 THR HG22 H -5.239 11.294 -11.184 1.00 . A A . 30 THR HG22 1 1
4 1517 1 1 22 THR HG23 H -5.909 12.790 -11.834 1.00 . A A . 30 THR HG23 1 1
4 1518 1 1 22 THR N N -3.088 12.752 -11.207 1.00 . A A . 30 THR N 1 1
4 1519 1 1 22 THR O O -3.184 15.493 -9.016 1.00 . A A . 30 THR O 1 1
4 1520 1 1 22 THR OG1 O -4.689 12.086 -8.822 1.00 . A A . 30 THR OG1 1 1
4 1521 1 1 23 LEU C C -0.270 14.803 -8.093 1.00 . A A . 31 LEU C 1 1
4 1522 1 1 23 LEU CA C -1.416 13.943 -7.566 1.00 . A A . 31 LEU CA 1 1
4 1523 1 1 23 LEU CB C -0.851 12.748 -6.793 1.00 . A A . 31 LEU CB 1 1
4 1524 1 1 23 LEU CD1 C -1.405 10.538 -5.767 1.00 . A A . 31 LEU CD1 1 1
4 1525 1 1 23 LEU CD2 C -3.166 12.303 -5.958 1.00 . A A . 31 LEU CD2 1 1
4 1526 1 1 23 LEU CG C -1.938 11.683 -6.632 1.00 . A A . 31 LEU CG 1 1
4 1527 1 1 23 LEU H H -2.208 12.535 -8.937 1.00 . A A . 31 LEU H 1 1
4 1528 1 1 23 LEU HA H -2.018 14.538 -6.896 1.00 . A A . 31 LEU HA 1 1
4 1529 1 1 23 LEU HB2 H -0.015 12.329 -7.335 1.00 . A A . 31 LEU HB2 1 1
4 1530 1 1 23 LEU HB3 H -0.522 13.073 -5.817 1.00 . A A . 31 LEU HB3 1 1
4 1531 1 1 23 LEU HD11 H -1.111 10.923 -4.802 1.00 . A A . 31 LEU HD11 1 1
4 1532 1 1 23 LEU HD12 H -0.551 10.089 -6.252 1.00 . A A . 31 LEU HD12 1 1
4 1533 1 1 23 LEU HD13 H -2.179 9.795 -5.638 1.00 . A A . 31 LEU HD13 1 1
4 1534 1 1 23 LEU HD21 H -3.818 11.517 -5.605 1.00 . A A . 31 LEU HD21 1 1
4 1535 1 1 23 LEU HD22 H -3.696 12.917 -6.670 1.00 . A A . 31 LEU HD22 1 1
4 1536 1 1 23 LEU HD23 H -2.850 12.910 -5.122 1.00 . A A . 31 LEU HD23 1 1
4 1537 1 1 23 LEU HG H -2.214 11.301 -7.604 1.00 . A A . 31 LEU HG 1 1
4 1538 1 1 23 LEU N N -2.253 13.475 -8.664 1.00 . A A . 31 LEU N 1 1
4 1539 1 1 23 LEU O O 0.046 15.849 -7.526 1.00 . A A . 31 LEU O 1 1
4 1540 1 1 24 GLY C C 1.064 16.536 -10.055 1.00 . A A . 32 GLY C 1 1
4 1541 1 1 24 GLY CA C 1.457 15.090 -9.775 1.00 . A A . 32 GLY CA 1 1
4 1542 1 1 24 GLY H H 0.053 13.513 -9.589 1.00 . A A . 32 GLY H 1 1
4 1543 1 1 24 GLY HA2 H 2.298 15.074 -9.096 1.00 . A A . 32 GLY HA2 1 1
4 1544 1 1 24 GLY HA3 H 1.741 14.616 -10.703 1.00 . A A . 32 GLY HA3 1 1
4 1545 1 1 24 GLY N N 0.347 14.354 -9.180 1.00 . A A . 32 GLY N 1 1
4 1546 1 1 24 GLY O O 1.737 17.420 -9.551 1.00 . A A . 32 GLY O 1 1
4 1547 1 1 24 GLY OXT O 0.096 16.738 -10.769 1.00 . A A . 32 GLY OXT 1 1
4 1548 2 2 1 ZN ZN ZN -6.533 3.662 -10.233 1.00 . B A . 300 ZN ZN 1 1
5 1549 1 1 1 LYS C C -13.066 -4.957 1.318 1.00 . A A . 9 LYS C 1 1
5 1550 1 1 1 LYS CA C -13.055 -4.920 2.843 1.00 . A A . 9 LYS CA 1 1
5 1551 1 1 1 LYS CB C -11.614 -4.973 3.359 1.00 . A A . 9 LYS CB 1 1
5 1552 1 1 1 LYS CD C -12.518 -4.408 5.623 1.00 . A A . 9 LYS CD 1 1
5 1553 1 1 1 LYS CE C -12.233 -4.544 7.121 1.00 . A A . 9 LYS CE 1 1
5 1554 1 1 1 LYS CG C -11.613 -5.363 4.840 1.00 . A A . 9 LYS CG 1 1
5 1555 1 1 1 LYS H1 H -14.354 -5.802 4.210 1.00 . A A . 9 LYS H1 1 1
5 1556 1 1 1 LYS H2 H -13.145 -6.846 3.630 1.00 . A A . 9 LYS H2 1 1
5 1557 1 1 1 LYS H3 H -14.465 -6.439 2.642 1.00 . A A . 9 LYS H3 1 1
5 1558 1 1 1 LYS HA H -13.524 -4.008 3.181 1.00 . A A . 9 LYS HA 1 1
5 1559 1 1 1 LYS HB2 H -11.055 -5.705 2.794 1.00 . A A . 9 LYS HB2 1 1
5 1560 1 1 1 LYS HB3 H -11.154 -4.003 3.246 1.00 . A A . 9 LYS HB3 1 1
5 1561 1 1 1 LYS HD2 H -12.325 -3.391 5.311 1.00 . A A . 9 LYS HD2 1 1
5 1562 1 1 1 LYS HD3 H -13.552 -4.653 5.434 1.00 . A A . 9 LYS HD3 1 1
5 1563 1 1 1 LYS HE2 H -12.176 -5.590 7.382 1.00 . A A . 9 LYS HE2 1 1
5 1564 1 1 1 LYS HE3 H -11.294 -4.063 7.354 1.00 . A A . 9 LYS HE3 1 1
5 1565 1 1 1 LYS HG2 H -11.980 -6.374 4.946 1.00 . A A . 9 LYS HG2 1 1
5 1566 1 1 1 LYS HG3 H -10.608 -5.303 5.227 1.00 . A A . 9 LYS HG3 1 1
5 1567 1 1 1 LYS HZ1 H -13.154 -4.021 8.913 1.00 . A A . 9 LYS HZ1 1 1
5 1568 1 1 1 LYS HZ2 H -14.238 -4.335 7.643 1.00 . A A . 9 LYS HZ2 1 1
5 1569 1 1 1 LYS HZ3 H -13.358 -2.881 7.673 1.00 . A A . 9 LYS HZ3 1 1
5 1570 1 1 1 LYS N N -13.812 -6.090 3.371 1.00 . A A . 9 LYS N 1 1
5 1571 1 1 1 LYS NZ N -13.328 -3.896 7.896 1.00 . A A . 9 LYS NZ 1 1
5 1572 1 1 1 LYS O O -13.050 -6.029 0.713 1.00 . A A . 9 LYS O 1 1
5 1573 1 1 2 ILE C C -12.298 -2.465 -1.210 1.00 . A A . 10 ILE C 1 1
5 1574 1 1 2 ILE CA C -13.114 -3.671 -0.754 1.00 . A A . 10 ILE CA 1 1
5 1575 1 1 2 ILE CB C -14.565 -3.549 -1.239 1.00 . A A . 10 ILE CB 1 1
5 1576 1 1 2 ILE CD1 C -16.083 -3.792 -3.210 1.00 . A A . 10 ILE CD1 1 1
5 1577 1 1 2 ILE CG1 C -14.626 -3.820 -2.745 1.00 . A A . 10 ILE CG1 1 1
5 1578 1 1 2 ILE CG2 C -15.112 -2.144 -0.944 1.00 . A A . 10 ILE CG2 1 1
5 1579 1 1 2 ILE H H -13.113 -2.959 1.235 1.00 . A A . 10 ILE H 1 1
5 1580 1 1 2 ILE HA H -12.680 -4.565 -1.182 1.00 . A A . 10 ILE HA 1 1
5 1581 1 1 2 ILE HB H -15.168 -4.276 -0.718 1.00 . A A . 10 ILE HB 1 1
5 1582 1 1 2 ILE HD11 H -16.148 -4.185 -4.215 1.00 . A A . 10 ILE HD11 1 1
5 1583 1 1 2 ILE HD12 H -16.445 -2.775 -3.198 1.00 . A A . 10 ILE HD12 1 1
5 1584 1 1 2 ILE HD13 H -16.684 -4.396 -2.548 1.00 . A A . 10 ILE HD13 1 1
5 1585 1 1 2 ILE HG12 H -14.065 -3.061 -3.271 1.00 . A A . 10 ILE HG12 1 1
5 1586 1 1 2 ILE HG13 H -14.202 -4.791 -2.955 1.00 . A A . 10 ILE HG13 1 1
5 1587 1 1 2 ILE HG21 H -14.757 -1.812 0.021 1.00 . A A . 10 ILE HG21 1 1
5 1588 1 1 2 ILE HG22 H -16.192 -2.175 -0.936 1.00 . A A . 10 ILE HG22 1 1
5 1589 1 1 2 ILE HG23 H -14.780 -1.455 -1.706 1.00 . A A . 10 ILE HG23 1 1
5 1590 1 1 2 ILE N N -13.098 -3.776 0.702 1.00 . A A . 10 ILE N 1 1
5 1591 1 1 2 ILE O O -12.600 -1.325 -0.859 1.00 . A A . 10 ILE O 1 1
5 1592 1 1 3 VAL C C -11.026 -0.969 -3.678 1.00 . A A . 11 VAL C 1 1
5 1593 1 1 3 VAL CA C -10.394 -1.662 -2.488 1.00 . A A . 11 VAL CA 1 1
5 1594 1 1 3 VAL CB C -9.031 -2.226 -2.887 1.00 . A A . 11 VAL CB 1 1
5 1595 1 1 3 VAL CG1 C -9.212 -3.316 -3.946 1.00 . A A . 11 VAL CG1 1 1
5 1596 1 1 3 VAL CG2 C -8.163 -1.102 -3.459 1.00 . A A . 11 VAL CG2 1 1
5 1597 1 1 3 VAL H H -11.062 -3.657 -2.229 1.00 . A A . 11 VAL H 1 1
5 1598 1 1 3 VAL HA H -10.250 -0.930 -1.712 1.00 . A A . 11 VAL HA 1 1
5 1599 1 1 3 VAL HB H -8.550 -2.644 -2.018 1.00 . A A . 11 VAL HB 1 1
5 1600 1 1 3 VAL HG11 H -8.276 -3.834 -4.092 1.00 . A A . 11 VAL HG11 1 1
5 1601 1 1 3 VAL HG12 H -9.523 -2.865 -4.877 1.00 . A A . 11 VAL HG12 1 1
5 1602 1 1 3 VAL HG13 H -9.964 -4.017 -3.617 1.00 . A A . 11 VAL HG13 1 1
5 1603 1 1 3 VAL HG21 H -8.223 -0.238 -2.814 1.00 . A A . 11 VAL HG21 1 1
5 1604 1 1 3 VAL HG22 H -8.517 -0.841 -4.446 1.00 . A A . 11 VAL HG22 1 1
5 1605 1 1 3 VAL HG23 H -7.138 -1.435 -3.522 1.00 . A A . 11 VAL HG23 1 1
5 1606 1 1 3 VAL N N -11.257 -2.729 -1.989 1.00 . A A . 11 VAL N 1 1
5 1607 1 1 3 VAL O O -11.502 -1.611 -4.616 1.00 . A A . 11 VAL O 1 1
5 1608 1 1 4 SER C C -10.722 2.405 -4.921 1.00 . A A . 12 SER C 1 1
5 1609 1 1 4 SER CA C -11.573 1.168 -4.705 1.00 . A A . 12 SER CA 1 1
5 1610 1 1 4 SER CB C -12.999 1.590 -4.377 1.00 . A A . 12 SER CB 1 1
5 1611 1 1 4 SER H H -10.611 0.800 -2.856 1.00 . A A . 12 SER H 1 1
5 1612 1 1 4 SER HA H -11.583 0.592 -5.621 1.00 . A A . 12 SER HA 1 1
5 1613 1 1 4 SER HB2 H -12.989 2.308 -3.575 1.00 . A A . 12 SER HB2 1 1
5 1614 1 1 4 SER HB3 H -13.439 2.041 -5.256 1.00 . A A . 12 SER HB3 1 1
5 1615 1 1 4 SER HG H -13.737 -0.180 -4.707 1.00 . A A . 12 SER HG 1 1
5 1616 1 1 4 SER N N -11.015 0.356 -3.631 1.00 . A A . 12 SER N 1 1
5 1617 1 1 4 SER O O -10.540 3.224 -4.020 1.00 . A A . 12 SER O 1 1
5 1618 1 1 4 SER OG O -13.752 0.451 -3.983 1.00 . A A . 12 SER OG 1 1
5 1619 1 1 5 CYS C C -10.180 4.942 -6.505 1.00 . A A . 13 CYS C 1 1
5 1620 1 1 5 CYS CA C -9.365 3.653 -6.492 1.00 . A A . 13 CYS CA 1 1
5 1621 1 1 5 CYS CB C -8.750 3.414 -7.871 1.00 . A A . 13 CYS CB 1 1
5 1622 1 1 5 CYS H H -10.399 1.828 -6.785 1.00 . A A . 13 CYS H 1 1
5 1623 1 1 5 CYS HA H -8.570 3.748 -5.768 1.00 . A A . 13 CYS HA 1 1
5 1624 1 1 5 CYS HB2 H -8.405 2.393 -7.939 1.00 . A A . 13 CYS HB2 1 1
5 1625 1 1 5 CYS HB3 H -9.493 3.590 -8.631 1.00 . A A . 13 CYS HB3 1 1
5 1626 1 1 5 CYS N N -10.206 2.521 -6.126 1.00 . A A . 13 CYS N 1 1
5 1627 1 1 5 CYS O O -11.404 4.911 -6.632 1.00 . A A . 13 CYS O 1 1
5 1628 1 1 5 CYS SG S -7.356 4.539 -8.120 1.00 . A A . 13 CYS SG 1 1
5 1629 1 1 6 ARG C C -9.714 8.197 -7.592 1.00 . A A . 14 ARG C 1 1
5 1630 1 1 6 ARG CA C -10.155 7.389 -6.371 1.00 . A A . 14 ARG CA 1 1
5 1631 1 1 6 ARG CB C -9.798 8.140 -5.066 1.00 . A A . 14 ARG CB 1 1
5 1632 1 1 6 ARG CD C -11.325 10.085 -5.516 1.00 . A A . 14 ARG CD 1 1
5 1633 1 1 6 ARG CG C -11.002 8.946 -4.547 1.00 . A A . 14 ARG CG 1 1
5 1634 1 1 6 ARG CZ C -13.102 9.082 -6.835 1.00 . A A . 14 ARG CZ 1 1
5 1635 1 1 6 ARG H H -8.516 6.036 -6.279 1.00 . A A . 14 ARG H 1 1
5 1636 1 1 6 ARG HA H -11.227 7.247 -6.422 1.00 . A A . 14 ARG HA 1 1
5 1637 1 1 6 ARG HB2 H -9.510 7.421 -4.315 1.00 . A A . 14 ARG HB2 1 1
5 1638 1 1 6 ARG HB3 H -8.971 8.814 -5.242 1.00 . A A . 14 ARG HB3 1 1
5 1639 1 1 6 ARG HD2 H -12.057 10.738 -5.067 1.00 . A A . 14 ARG HD2 1 1
5 1640 1 1 6 ARG HD3 H -10.426 10.647 -5.720 1.00 . A A . 14 ARG HD3 1 1
5 1641 1 1 6 ARG HE H -11.296 9.542 -7.565 1.00 . A A . 14 ARG HE 1 1
5 1642 1 1 6 ARG HG2 H -11.861 8.296 -4.455 1.00 . A A . 14 ARG HG2 1 1
5 1643 1 1 6 ARG HG3 H -10.764 9.361 -3.579 1.00 . A A . 14 ARG HG3 1 1
5 1644 1 1 6 ARG HH11 H -13.516 9.451 -4.912 1.00 . A A . 14 ARG HH11 1 1
5 1645 1 1 6 ARG HH12 H -14.798 8.736 -5.830 1.00 . A A . 14 ARG HH12 1 1
5 1646 1 1 6 ARG HH21 H -12.972 8.607 -8.775 1.00 . A A . 14 ARG HH21 1 1
5 1647 1 1 6 ARG HH22 H -14.491 8.258 -8.018 1.00 . A A . 14 ARG HH22 1 1
5 1648 1 1 6 ARG N N -9.492 6.078 -6.375 1.00 . A A . 14 ARG N 1 1
5 1649 1 1 6 ARG NE N -11.861 9.553 -6.764 1.00 . A A . 14 ARG NE 1 1
5 1650 1 1 6 ARG NH1 N -13.865 9.090 -5.776 1.00 . A A . 14 ARG NH1 1 1
5 1651 1 1 6 ARG NH2 N -13.558 8.612 -7.965 1.00 . A A . 14 ARG NH2 1 1
5 1652 1 1 6 ARG O O -9.562 9.416 -7.523 1.00 . A A . 14 ARG O 1 1
5 1653 1 1 7 ILE C C -9.713 7.453 -11.150 1.00 . A A . 15 ILE C 1 1
5 1654 1 1 7 ILE CA C -9.082 8.150 -9.949 1.00 . A A . 15 ILE CA 1 1
5 1655 1 1 7 ILE CB C -7.554 8.088 -10.073 1.00 . A A . 15 ILE CB 1 1
5 1656 1 1 7 ILE CD1 C -5.393 8.386 -8.860 1.00 . A A . 15 ILE CD1 1 1
5 1657 1 1 7 ILE CG1 C -6.914 8.401 -8.718 1.00 . A A . 15 ILE CG1 1 1
5 1658 1 1 7 ILE CG2 C -7.079 9.111 -11.108 1.00 . A A . 15 ILE CG2 1 1
5 1659 1 1 7 ILE H H -9.643 6.532 -8.699 1.00 . A A . 15 ILE H 1 1
5 1660 1 1 7 ILE HA H -9.394 9.185 -9.941 1.00 . A A . 15 ILE HA 1 1
5 1661 1 1 7 ILE HB H -7.258 7.097 -10.389 1.00 . A A . 15 ILE HB 1 1
5 1662 1 1 7 ILE HD11 H -5.088 7.479 -9.361 1.00 . A A . 15 ILE HD11 1 1
5 1663 1 1 7 ILE HD12 H -4.939 8.425 -7.881 1.00 . A A . 15 ILE HD12 1 1
5 1664 1 1 7 ILE HD13 H -5.076 9.240 -9.439 1.00 . A A . 15 ILE HD13 1 1
5 1665 1 1 7 ILE HG12 H -7.237 9.374 -8.381 1.00 . A A . 15 ILE HG12 1 1
5 1666 1 1 7 ILE HG13 H -7.210 7.653 -7.998 1.00 . A A . 15 ILE HG13 1 1
5 1667 1 1 7 ILE HG21 H -7.668 9.012 -12.008 1.00 . A A . 15 ILE HG21 1 1
5 1668 1 1 7 ILE HG22 H -6.039 8.934 -11.337 1.00 . A A . 15 ILE HG22 1 1
5 1669 1 1 7 ILE HG23 H -7.195 10.107 -10.709 1.00 . A A . 15 ILE HG23 1 1
5 1670 1 1 7 ILE N N -9.508 7.501 -8.709 1.00 . A A . 15 ILE N 1 1
5 1671 1 1 7 ILE O O -10.202 8.102 -12.074 1.00 . A A . 15 ILE O 1 1
5 1672 1 1 8 CYS C C -11.206 4.265 -11.647 1.00 . A A . 16 CYS C 1 1
5 1673 1 1 8 CYS CA C -10.253 5.316 -12.208 1.00 . A A . 16 CYS CA 1 1
5 1674 1 1 8 CYS CB C -9.120 4.628 -12.968 1.00 . A A . 16 CYS CB 1 1
5 1675 1 1 8 CYS H H -9.282 5.668 -10.361 1.00 . A A . 16 CYS H 1 1
5 1676 1 1 8 CYS HA H -10.797 5.952 -12.893 1.00 . A A . 16 CYS HA 1 1
5 1677 1 1 8 CYS HB2 H -9.521 4.112 -13.828 1.00 . A A . 16 CYS HB2 1 1
5 1678 1 1 8 CYS HB3 H -8.405 5.370 -13.292 1.00 . A A . 16 CYS HB3 1 1
5 1679 1 1 8 CYS N N -9.690 6.122 -11.125 1.00 . A A . 16 CYS N 1 1
5 1680 1 1 8 CYS O O -11.998 3.676 -12.382 1.00 . A A . 16 CYS O 1 1
5 1681 1 1 8 CYS SG S -8.299 3.439 -11.880 1.00 . A A . 16 CYS SG 1 1
5 1682 1 1 9 LYS C C -11.766 1.675 -10.265 1.00 . A A . 17 LYS C 1 1
5 1683 1 1 9 LYS CA C -11.993 3.067 -9.687 1.00 . A A . 17 LYS CA 1 1
5 1684 1 1 9 LYS CB C -13.456 3.475 -9.865 1.00 . A A . 17 LYS CB 1 1
5 1685 1 1 9 LYS CD C -15.066 5.348 -9.466 1.00 . A A . 17 LYS CD 1 1
5 1686 1 1 9 LYS CE C -15.896 4.807 -10.631 1.00 . A A . 17 LYS CE 1 1
5 1687 1 1 9 LYS CG C -13.593 4.988 -9.675 1.00 . A A . 17 LYS CG 1 1
5 1688 1 1 9 LYS H H -10.483 4.540 -9.798 1.00 . A A . 17 LYS H 1 1
5 1689 1 1 9 LYS HA H -11.765 3.047 -8.633 1.00 . A A . 17 LYS HA 1 1
5 1690 1 1 9 LYS HB2 H -13.790 3.203 -10.856 1.00 . A A . 17 LYS HB2 1 1
5 1691 1 1 9 LYS HB3 H -14.058 2.968 -9.130 1.00 . A A . 17 LYS HB3 1 1
5 1692 1 1 9 LYS HD2 H -15.414 4.912 -8.541 1.00 . A A . 17 LYS HD2 1 1
5 1693 1 1 9 LYS HD3 H -15.169 6.422 -9.420 1.00 . A A . 17 LYS HD3 1 1
5 1694 1 1 9 LYS HE2 H -16.049 3.746 -10.501 1.00 . A A . 17 LYS HE2 1 1
5 1695 1 1 9 LYS HE3 H -16.851 5.310 -10.657 1.00 . A A . 17 LYS HE3 1 1
5 1696 1 1 9 LYS HG2 H -13.021 5.297 -8.813 1.00 . A A . 17 LYS HG2 1 1
5 1697 1 1 9 LYS HG3 H -13.223 5.497 -10.553 1.00 . A A . 17 LYS HG3 1 1
5 1698 1 1 9 LYS HZ1 H -14.522 5.854 -11.795 1.00 . A A . 17 LYS HZ1 1 1
5 1699 1 1 9 LYS HZ2 H -15.860 5.265 -12.662 1.00 . A A . 17 LYS HZ2 1 1
5 1700 1 1 9 LYS HZ3 H -14.629 4.203 -12.169 1.00 . A A . 17 LYS HZ3 1 1
5 1701 1 1 9 LYS N N -11.129 4.041 -10.337 1.00 . A A . 17 LYS N 1 1
5 1702 1 1 9 LYS NZ N -15.172 5.051 -11.911 1.00 . A A . 17 LYS NZ 1 1
5 1703 1 1 9 LYS O O -12.628 1.127 -10.952 1.00 . A A . 17 LYS O 1 1
5 1704 1 1 10 GLY C C -9.979 -1.177 -9.297 1.00 . A A . 18 GLY C 1 1
5 1705 1 1 10 GLY CA C -10.242 -0.230 -10.464 1.00 . A A . 18 GLY CA 1 1
5 1706 1 1 10 GLY H H -9.952 1.597 -9.423 1.00 . A A . 18 GLY H 1 1
5 1707 1 1 10 GLY HA2 H -11.048 -0.627 -11.068 1.00 . A A . 18 GLY HA2 1 1
5 1708 1 1 10 GLY HA3 H -9.348 -0.162 -11.066 1.00 . A A . 18 GLY HA3 1 1
5 1709 1 1 10 GLY N N -10.595 1.106 -9.977 1.00 . A A . 18 GLY N 1 1
5 1710 1 1 10 GLY O O -10.859 -1.415 -8.470 1.00 . A A . 18 GLY O 1 1
5 1711 1 1 11 ASP C C -7.059 -2.214 -7.535 1.00 . A A . 19 ASP C 1 1
5 1712 1 1 11 ASP CA C -8.378 -2.644 -8.173 1.00 . A A . 19 ASP CA 1 1
5 1713 1 1 11 ASP CB C -8.234 -4.053 -8.750 1.00 . A A . 19 ASP CB 1 1
5 1714 1 1 11 ASP CG C -7.041 -4.111 -9.699 1.00 . A A . 19 ASP CG 1 1
5 1715 1 1 11 ASP H H -8.106 -1.489 -9.930 1.00 . A A . 19 ASP H 1 1
5 1716 1 1 11 ASP HA H -9.144 -2.658 -7.408 1.00 . A A . 19 ASP HA 1 1
5 1717 1 1 11 ASP HB2 H -8.087 -4.757 -7.944 1.00 . A A . 19 ASP HB2 1 1
5 1718 1 1 11 ASP HB3 H -9.131 -4.308 -9.291 1.00 . A A . 19 ASP HB3 1 1
5 1719 1 1 11 ASP N N -8.762 -1.717 -9.239 1.00 . A A . 19 ASP N 1 1
5 1720 1 1 11 ASP O O -6.075 -2.953 -7.562 1.00 . A A . 19 ASP O 1 1
5 1721 1 1 11 ASP OD1 O -7.183 -3.664 -10.825 1.00 . A A . 19 ASP OD1 1 1
5 1722 1 1 11 ASP OD2 O -6.003 -4.602 -9.286 1.00 . A A . 19 ASP OD2 1 1
5 1723 1 1 12 HIS C C -6.109 0.895 -5.751 1.00 . A A . 20 HIS C 1 1
5 1724 1 1 12 HIS CA C -5.847 -0.497 -6.317 1.00 . A A . 20 HIS CA 1 1
5 1725 1 1 12 HIS CB C -4.694 -0.440 -7.325 1.00 . A A . 20 HIS CB 1 1
5 1726 1 1 12 HIS CD2 C -5.655 1.306 -9.039 1.00 . A A . 20 HIS CD2 1 1
5 1727 1 1 12 HIS CE1 C -5.765 0.012 -10.774 1.00 . A A . 20 HIS CE1 1 1
5 1728 1 1 12 HIS CG C -5.201 0.071 -8.645 1.00 . A A . 20 HIS CG 1 1
5 1729 1 1 12 HIS H H -7.860 -0.469 -6.964 1.00 . A A . 20 HIS H 1 1
5 1730 1 1 12 HIS HA H -5.572 -1.158 -5.509 1.00 . A A . 20 HIS HA 1 1
5 1731 1 1 12 HIS HB2 H -3.922 0.219 -6.955 1.00 . A A . 20 HIS HB2 1 1
5 1732 1 1 12 HIS HB3 H -4.284 -1.430 -7.458 1.00 . A A . 20 HIS HB3 1 1
5 1733 1 1 12 HIS HD2 H -5.728 2.175 -8.404 1.00 . A A . 20 HIS HD2 1 1
5 1734 1 1 12 HIS HE1 H -5.935 -0.355 -11.776 1.00 . A A . 20 HIS HE1 1 1
5 1735 1 1 12 HIS N N -7.047 -1.016 -6.960 1.00 . A A . 20 HIS N 1 1
5 1736 1 1 12 HIS ND1 N -5.281 -0.737 -9.768 1.00 . A A . 20 HIS ND1 1 1
5 1737 1 1 12 HIS NE2 N -6.010 1.266 -10.384 1.00 . A A . 20 HIS NE2 1 1
5 1738 1 1 12 HIS O O -6.802 1.706 -6.364 1.00 . A A . 20 HIS O 1 1
5 1739 1 1 13 TRP C C -5.329 3.581 -4.886 1.00 . A A . 21 TRP C 1 1
5 1740 1 1 13 TRP CA C -5.727 2.457 -3.936 1.00 . A A . 21 TRP CA 1 1
5 1741 1 1 13 TRP CB C -4.873 2.533 -2.667 1.00 . A A . 21 TRP CB 1 1
5 1742 1 1 13 TRP CD1 C -5.598 0.316 -1.690 1.00 . A A . 21 TRP CD1 1 1
5 1743 1 1 13 TRP CD2 C -6.008 2.044 -0.310 1.00 . A A . 21 TRP CD2 1 1
5 1744 1 1 13 TRP CE2 C -6.458 0.879 0.355 1.00 . A A . 21 TRP CE2 1 1
5 1745 1 1 13 TRP CE3 C -6.151 3.280 0.347 1.00 . A A . 21 TRP CE3 1 1
5 1746 1 1 13 TRP CG C -5.466 1.660 -1.606 1.00 . A A . 21 TRP CG 1 1
5 1747 1 1 13 TRP CH2 C -7.164 2.172 2.266 1.00 . A A . 21 TRP CH2 1 1
5 1748 1 1 13 TRP CZ2 C -7.029 0.936 1.627 1.00 . A A . 21 TRP CZ2 1 1
5 1749 1 1 13 TRP CZ3 C -6.726 3.341 1.628 1.00 . A A . 21 TRP CZ3 1 1
5 1750 1 1 13 TRP H H -5.011 0.472 -4.141 1.00 . A A . 21 TRP H 1 1
5 1751 1 1 13 TRP HA H -6.766 2.576 -3.666 1.00 . A A . 21 TRP HA 1 1
5 1752 1 1 13 TRP HB2 H -3.870 2.197 -2.888 1.00 . A A . 21 TRP HB2 1 1
5 1753 1 1 13 TRP HB3 H -4.841 3.553 -2.315 1.00 . A A . 21 TRP HB3 1 1
5 1754 1 1 13 TRP HD1 H -5.294 -0.295 -2.527 1.00 . A A . 21 TRP HD1 1 1
5 1755 1 1 13 TRP HE1 H -6.393 -1.087 -0.333 1.00 . A A . 21 TRP HE1 1 1
5 1756 1 1 13 TRP HE3 H -5.817 4.186 -0.134 1.00 . A A . 21 TRP HE3 1 1
5 1757 1 1 13 TRP HH2 H -7.605 2.227 3.250 1.00 . A A . 21 TRP HH2 1 1
5 1758 1 1 13 TRP HZ2 H -7.365 0.032 2.114 1.00 . A A . 21 TRP HZ2 1 1
5 1759 1 1 13 TRP HZ3 H -6.831 4.294 2.124 1.00 . A A . 21 TRP HZ3 1 1
5 1760 1 1 13 TRP N N -5.550 1.160 -4.580 1.00 . A A . 21 TRP N 1 1
5 1761 1 1 13 TRP NE1 N -6.186 -0.149 -0.527 1.00 . A A . 21 TRP NE1 1 1
5 1762 1 1 13 TRP O O -5.123 3.354 -6.078 1.00 . A A . 21 TRP O 1 1
5 1763 1 1 14 THR C C -3.339 6.059 -5.296 1.00 . A A . 22 THR C 1 1
5 1764 1 1 14 THR CA C -4.856 5.953 -5.163 1.00 . A A . 22 THR CA 1 1
5 1765 1 1 14 THR CB C -5.400 7.232 -4.522 1.00 . A A . 22 THR CB 1 1
5 1766 1 1 14 THR CG2 C -6.910 7.101 -4.323 1.00 . A A . 22 THR CG2 1 1
5 1767 1 1 14 THR H H -5.405 4.916 -3.396 1.00 . A A . 22 THR H 1 1
5 1768 1 1 14 THR HA H -5.287 5.848 -6.148 1.00 . A A . 22 THR HA 1 1
5 1769 1 1 14 THR HB H -5.197 8.072 -5.167 1.00 . A A . 22 THR HB 1 1
5 1770 1 1 14 THR HG1 H -5.435 7.739 -2.645 1.00 . A A . 22 THR HG1 1 1
5 1771 1 1 14 THR HG21 H -7.124 6.191 -3.783 1.00 . A A . 22 THR HG21 1 1
5 1772 1 1 14 THR HG22 H -7.399 7.075 -5.285 1.00 . A A . 22 THR HG22 1 1
5 1773 1 1 14 THR HG23 H -7.273 7.948 -3.758 1.00 . A A . 22 THR HG23 1 1
5 1774 1 1 14 THR N N -5.227 4.796 -4.353 1.00 . A A . 22 THR N 1 1
5 1775 1 1 14 THR O O -2.830 6.641 -6.253 1.00 . A A . 22 THR O 1 1
5 1776 1 1 14 THR OG1 O -4.768 7.434 -3.266 1.00 . A A . 22 THR OG1 1 1
5 1777 1 1 15 THR C C -0.605 4.541 -5.357 1.00 . A A . 23 THR C 1 1
5 1778 1 1 15 THR CA C -1.165 5.538 -4.346 1.00 . A A . 23 THR CA 1 1
5 1779 1 1 15 THR CB C -0.617 5.217 -2.955 1.00 . A A . 23 THR CB 1 1
5 1780 1 1 15 THR CG2 C -1.097 6.273 -1.958 1.00 . A A . 23 THR CG2 1 1
5 1781 1 1 15 THR H H -3.082 5.047 -3.588 1.00 . A A . 23 THR H 1 1
5 1782 1 1 15 THR HA H -0.848 6.532 -4.623 1.00 . A A . 23 THR HA 1 1
5 1783 1 1 15 THR HB H 0.462 5.218 -2.982 1.00 . A A . 23 THR HB 1 1
5 1784 1 1 15 THR HG1 H -1.300 3.437 -3.340 1.00 . A A . 23 THR HG1 1 1
5 1785 1 1 15 THR HG21 H -2.161 6.416 -2.070 1.00 . A A . 23 THR HG21 1 1
5 1786 1 1 15 THR HG22 H -0.586 7.205 -2.148 1.00 . A A . 23 THR HG22 1 1
5 1787 1 1 15 THR HG23 H -0.881 5.944 -0.953 1.00 . A A . 23 THR HG23 1 1
5 1788 1 1 15 THR N N -2.623 5.495 -4.328 1.00 . A A . 23 THR N 1 1
5 1789 1 1 15 THR O O 0.274 4.876 -6.151 1.00 . A A . 23 THR O 1 1
5 1790 1 1 15 THR OG1 O -1.079 3.936 -2.550 1.00 . A A . 23 THR OG1 1 1
5 1791 1 1 16 ARG C C -1.486 2.273 -7.515 1.00 . A A . 24 ARG C 1 1
5 1792 1 1 16 ARG CA C -0.657 2.266 -6.230 1.00 . A A . 24 ARG CA 1 1
5 1793 1 1 16 ARG CB C -0.768 0.898 -5.540 1.00 . A A . 24 ARG CB 1 1
5 1794 1 1 16 ARG CD C -2.365 -0.575 -4.296 1.00 . A A . 24 ARG CD 1 1
5 1795 1 1 16 ARG CG C -2.020 0.871 -4.656 1.00 . A A . 24 ARG CG 1 1
5 1796 1 1 16 ARG CZ C -1.304 -2.474 -3.215 1.00 . A A . 24 ARG CZ 1 1
5 1797 1 1 16 ARG H H -1.812 3.104 -4.660 1.00 . A A . 24 ARG H 1 1
5 1798 1 1 16 ARG HA H 0.379 2.444 -6.483 1.00 . A A . 24 ARG HA 1 1
5 1799 1 1 16 ARG HB2 H -0.834 0.114 -6.286 1.00 . A A . 24 ARG HB2 1 1
5 1800 1 1 16 ARG HB3 H 0.105 0.734 -4.923 1.00 . A A . 24 ARG HB3 1 1
5 1801 1 1 16 ARG HD2 H -3.217 -0.585 -3.634 1.00 . A A . 24 ARG HD2 1 1
5 1802 1 1 16 ARG HD3 H -2.608 -1.119 -5.198 1.00 . A A . 24 ARG HD3 1 1
5 1803 1 1 16 ARG HE H -0.408 -0.706 -3.494 1.00 . A A . 24 ARG HE 1 1
5 1804 1 1 16 ARG HG2 H -1.830 1.432 -3.752 1.00 . A A . 24 ARG HG2 1 1
5 1805 1 1 16 ARG HG3 H -2.848 1.316 -5.188 1.00 . A A . 24 ARG HG3 1 1
5 1806 1 1 16 ARG HH11 H -3.185 -2.740 -3.848 1.00 . A A . 24 ARG HH11 1 1
5 1807 1 1 16 ARG HH12 H -2.452 -4.108 -3.080 1.00 . A A . 24 ARG HH12 1 1
5 1808 1 1 16 ARG HH21 H 0.560 -2.497 -2.485 1.00 . A A . 24 ARG HH21 1 1
5 1809 1 1 16 ARG HH22 H -0.333 -3.971 -2.308 1.00 . A A . 24 ARG HH22 1 1
5 1810 1 1 16 ARG N N -1.116 3.313 -5.318 1.00 . A A . 24 ARG N 1 1
5 1811 1 1 16 ARG NE N -1.234 -1.214 -3.633 1.00 . A A . 24 ARG NE 1 1
5 1812 1 1 16 ARG NH1 N -2.399 -3.161 -3.395 1.00 . A A . 24 ARG NH1 1 1
5 1813 1 1 16 ARG NH2 N -0.279 -3.023 -2.623 1.00 . A A . 24 ARG NH2 1 1
5 1814 1 1 16 ARG O O -1.590 1.255 -8.200 1.00 . A A . 24 ARG O 1 1
5 1815 1 1 17 CYS C C -1.987 3.882 -10.255 1.00 . A A . 25 CYS C 1 1
5 1816 1 1 17 CYS CA C -2.879 3.549 -9.050 1.00 . A A . 25 CYS CA 1 1
5 1817 1 1 17 CYS CB C -3.916 4.661 -8.864 1.00 . A A . 25 CYS CB 1 1
5 1818 1 1 17 CYS H H -1.947 4.205 -7.259 1.00 . A A . 25 CYS H 1 1
5 1819 1 1 17 CYS HA H -3.395 2.619 -9.217 1.00 . A A . 25 CYS HA 1 1
5 1820 1 1 17 CYS HB2 H -4.676 4.331 -8.174 1.00 . A A . 25 CYS HB2 1 1
5 1821 1 1 17 CYS HB3 H -3.433 5.543 -8.471 1.00 . A A . 25 CYS HB3 1 1
5 1822 1 1 17 CYS N N -2.067 3.425 -7.840 1.00 . A A . 25 CYS N 1 1
5 1823 1 1 17 CYS O O -1.096 4.724 -10.145 1.00 . A A . 25 CYS O 1 1
5 1824 1 1 17 CYS SG S -4.682 5.055 -10.459 1.00 . A A . 25 CYS SG 1 1
5 1825 1 1 18 PRO C C -1.728 4.890 -13.237 1.00 . A A . 26 PRO C 1 1
5 1826 1 1 18 PRO CA C -1.371 3.540 -12.612 1.00 . A A . 26 PRO CA 1 1
5 1827 1 1 18 PRO CB C -1.715 2.379 -13.554 1.00 . A A . 26 PRO CB 1 1
5 1828 1 1 18 PRO CD C -3.221 2.231 -11.671 1.00 . A A . 26 PRO CD 1 1
5 1829 1 1 18 PRO CG C -3.108 1.991 -13.181 1.00 . A A . 26 PRO CG 1 1
5 1830 1 1 18 PRO HA H -0.322 3.510 -12.366 1.00 . A A . 26 PRO HA 1 1
5 1831 1 1 18 PRO HB2 H -1.669 2.698 -14.589 1.00 . A A . 26 PRO HB2 1 1
5 1832 1 1 18 PRO HB3 H -1.044 1.549 -13.388 1.00 . A A . 26 PRO HB3 1 1
5 1833 1 1 18 PRO HD2 H -4.208 2.595 -11.418 1.00 . A A . 26 PRO HD2 1 1
5 1834 1 1 18 PRO HD3 H -2.997 1.328 -11.125 1.00 . A A . 26 PRO HD3 1 1
5 1835 1 1 18 PRO HG2 H -3.821 2.609 -13.715 1.00 . A A . 26 PRO HG2 1 1
5 1836 1 1 18 PRO HG3 H -3.282 0.948 -13.401 1.00 . A A . 26 PRO HG3 1 1
5 1837 1 1 18 PRO N N -2.195 3.259 -11.398 1.00 . A A . 26 PRO N 1 1
5 1838 1 1 18 PRO O O -1.476 5.124 -14.418 1.00 . A A . 26 PRO O 1 1
5 1839 1 1 19 TYR C C -2.658 8.108 -11.766 1.00 . A A . 27 TYR C 1 1
5 1840 1 1 19 TYR CA C -2.711 7.095 -12.906 1.00 . A A . 27 TYR CA 1 1
5 1841 1 1 19 TYR CB C -4.128 7.046 -13.481 1.00 . A A . 27 TYR CB 1 1
5 1842 1 1 19 TYR CD1 C -3.435 6.319 -15.795 1.00 . A A . 27 TYR CD1 1 1
5 1843 1 1 19 TYR CD2 C -4.956 4.905 -14.541 1.00 . A A . 27 TYR CD2 1 1
5 1844 1 1 19 TYR CE1 C -3.475 5.413 -16.863 1.00 . A A . 27 TYR CE1 1 1
5 1845 1 1 19 TYR CE2 C -4.996 4.001 -15.609 1.00 . A A . 27 TYR CE2 1 1
5 1846 1 1 19 TYR CG C -4.174 6.065 -14.633 1.00 . A A . 27 TYR CG 1 1
5 1847 1 1 19 TYR CZ C -4.255 4.255 -16.770 1.00 . A A . 27 TYR CZ 1 1
5 1848 1 1 19 TYR H H -2.494 5.524 -11.498 1.00 . A A . 27 TYR H 1 1
5 1849 1 1 19 TYR HA H -2.030 7.413 -13.681 1.00 . A A . 27 TYR HA 1 1
5 1850 1 1 19 TYR HB2 H -4.818 6.735 -12.710 1.00 . A A . 27 TYR HB2 1 1
5 1851 1 1 19 TYR HB3 H -4.405 8.028 -13.835 1.00 . A A . 27 TYR HB3 1 1
5 1852 1 1 19 TYR HD1 H -2.833 7.212 -15.868 1.00 . A A . 27 TYR HD1 1 1
5 1853 1 1 19 TYR HD2 H -5.528 4.707 -13.646 1.00 . A A . 27 TYR HD2 1 1
5 1854 1 1 19 TYR HE1 H -2.905 5.610 -17.758 1.00 . A A . 27 TYR HE1 1 1
5 1855 1 1 19 TYR HE2 H -5.597 3.107 -15.539 1.00 . A A . 27 TYR HE2 1 1
5 1856 1 1 19 TYR HH H -4.293 3.868 -18.639 1.00 . A A . 27 TYR HH 1 1
5 1857 1 1 19 TYR N N -2.318 5.770 -12.431 1.00 . A A . 27 TYR N 1 1
5 1858 1 1 19 TYR O O -3.538 8.960 -11.639 1.00 . A A . 27 TYR O 1 1
5 1859 1 1 19 TYR OH O -4.294 3.363 -17.823 1.00 . A A . 27 TYR OH 1 1
5 1860 1 1 20 LYS C C -0.932 10.275 -10.303 1.00 . A A . 28 LYS C 1 1
5 1861 1 1 20 LYS CA C -1.462 8.929 -9.817 1.00 . A A . 28 LYS CA 1 1
5 1862 1 1 20 LYS CB C -0.510 8.330 -8.763 1.00 . A A . 28 LYS CB 1 1
5 1863 1 1 20 LYS CD C 1.322 8.439 -10.481 1.00 . A A . 28 LYS CD 1 1
5 1864 1 1 20 LYS CE C 2.653 7.802 -10.886 1.00 . A A . 28 LYS CE 1 1
5 1865 1 1 20 LYS CG C 0.625 7.553 -9.444 1.00 . A A . 28 LYS CG 1 1
5 1866 1 1 20 LYS H H -0.950 7.314 -11.094 1.00 . A A . 28 LYS H 1 1
5 1867 1 1 20 LYS HA H -2.427 9.085 -9.363 1.00 . A A . 28 LYS HA 1 1
5 1868 1 1 20 LYS HB2 H -0.090 9.123 -8.160 1.00 . A A . 28 LYS HB2 1 1
5 1869 1 1 20 LYS HB3 H -1.064 7.657 -8.125 1.00 . A A . 28 LYS HB3 1 1
5 1870 1 1 20 LYS HD2 H 0.692 8.538 -11.353 1.00 . A A . 28 LYS HD2 1 1
5 1871 1 1 20 LYS HD3 H 1.508 9.415 -10.057 1.00 . A A . 28 LYS HD3 1 1
5 1872 1 1 20 LYS HE2 H 3.308 7.763 -10.028 1.00 . A A . 28 LYS HE2 1 1
5 1873 1 1 20 LYS HE3 H 2.476 6.800 -11.250 1.00 . A A . 28 LYS HE3 1 1
5 1874 1 1 20 LYS HG2 H 1.343 7.248 -8.696 1.00 . A A . 28 LYS HG2 1 1
5 1875 1 1 20 LYS HG3 H 0.225 6.678 -9.930 1.00 . A A . 28 LYS HG3 1 1
5 1876 1 1 20 LYS HZ1 H 2.566 9.205 -12.422 1.00 . A A . 28 LYS HZ1 1 1
5 1877 1 1 20 LYS HZ2 H 3.723 7.985 -12.663 1.00 . A A . 28 LYS HZ2 1 1
5 1878 1 1 20 LYS HZ3 H 4.018 9.230 -11.544 1.00 . A A . 28 LYS HZ3 1 1
5 1879 1 1 20 LYS N N -1.620 8.011 -10.942 1.00 . A A . 28 LYS N 1 1
5 1880 1 1 20 LYS NZ N 3.288 8.617 -11.959 1.00 . A A . 28 LYS NZ 1 1
5 1881 1 1 20 LYS O O -0.451 11.088 -9.516 1.00 . A A . 28 LYS O 1 1
5 1882 1 1 21 ASP C C -1.412 12.908 -11.785 1.00 . A A . 29 ASP C 1 1
5 1883 1 1 21 ASP CA C -0.551 11.722 -12.214 1.00 . A A . 29 ASP CA 1 1
5 1884 1 1 21 ASP CB C -0.576 11.538 -13.736 1.00 . A A . 29 ASP CB 1 1
5 1885 1 1 21 ASP CG C -1.935 11.919 -14.328 1.00 . A A . 29 ASP CG 1 1
5 1886 1 1 21 ASP H H -1.404 9.809 -12.187 1.00 . A A . 29 ASP H 1 1
5 1887 1 1 21 ASP HA H 0.462 11.898 -11.898 1.00 . A A . 29 ASP HA 1 1
5 1888 1 1 21 ASP HB2 H 0.187 12.140 -14.179 1.00 . A A . 29 ASP HB2 1 1
5 1889 1 1 21 ASP HB3 H -0.380 10.501 -13.956 1.00 . A A . 29 ASP HB3 1 1
5 1890 1 1 21 ASP N N -1.020 10.494 -11.610 1.00 . A A . 29 ASP N 1 1
5 1891 1 1 21 ASP O O -1.264 14.020 -12.292 1.00 . A A . 29 ASP O 1 1
5 1892 1 1 21 ASP OD1 O -2.791 11.054 -14.404 1.00 . A A . 29 ASP OD1 1 1
5 1893 1 1 21 ASP OD2 O -2.096 13.071 -14.697 1.00 . A A . 29 ASP OD2 1 1
5 1894 1 1 22 THR C C -2.513 14.564 -9.324 1.00 . A A . 30 THR C 1 1
5 1895 1 1 22 THR CA C -3.215 13.681 -10.353 1.00 . A A . 30 THR CA 1 1
5 1896 1 1 22 THR CB C -4.448 13.035 -9.719 1.00 . A A . 30 THR CB 1 1
5 1897 1 1 22 THR CG2 C -4.011 11.913 -8.777 1.00 . A A . 30 THR CG2 1 1
5 1898 1 1 22 THR H H -2.376 11.738 -10.505 1.00 . A A . 30 THR H 1 1
5 1899 1 1 22 THR HA H -3.534 14.298 -11.181 1.00 . A A . 30 THR HA 1 1
5 1900 1 1 22 THR HB H -5.077 12.623 -10.494 1.00 . A A . 30 THR HB 1 1
5 1901 1 1 22 THR HG1 H -5.426 13.629 -8.147 1.00 . A A . 30 THR HG1 1 1
5 1902 1 1 22 THR HG21 H -3.233 12.276 -8.121 1.00 . A A . 30 THR HG21 1 1
5 1903 1 1 22 THR HG22 H -3.634 11.084 -9.357 1.00 . A A . 30 THR HG22 1 1
5 1904 1 1 22 THR HG23 H -4.856 11.586 -8.189 1.00 . A A . 30 THR HG23 1 1
5 1905 1 1 22 THR N N -2.314 12.648 -10.856 1.00 . A A . 30 THR N 1 1
5 1906 1 1 22 THR O O -3.147 15.087 -8.408 1.00 . A A . 30 THR O 1 1
5 1907 1 1 22 THR OG1 O -5.174 14.014 -8.990 1.00 . A A . 30 THR OG1 1 1
5 1908 1 1 23 LEU C C -1.057 16.954 -8.467 1.00 . A A . 31 LEU C 1 1
5 1909 1 1 23 LEU CA C -0.437 15.561 -8.559 1.00 . A A . 31 LEU CA 1 1
5 1910 1 1 23 LEU CB C 1.024 15.669 -9.035 1.00 . A A . 31 LEU CB 1 1
5 1911 1 1 23 LEU CD1 C 2.073 14.431 -7.080 1.00 . A A . 31 LEU CD1 1 1
5 1912 1 1 23 LEU CD2 C 1.073 13.160 -9.007 1.00 . A A . 31 LEU CD2 1 1
5 1913 1 1 23 LEU CG C 1.831 14.430 -8.604 1.00 . A A . 31 LEU CG 1 1
5 1914 1 1 23 LEU H H -0.751 14.294 -10.234 1.00 . A A . 31 LEU H 1 1
5 1915 1 1 23 LEU HA H -0.459 15.109 -7.582 1.00 . A A . 31 LEU HA 1 1
5 1916 1 1 23 LEU HB2 H 1.038 15.741 -10.114 1.00 . A A . 31 LEU HB2 1 1
5 1917 1 1 23 LEU HB3 H 1.479 16.556 -8.617 1.00 . A A . 31 LEU HB3 1 1
5 1918 1 1 23 LEU HD11 H 1.252 13.945 -6.572 1.00 . A A . 31 LEU HD11 1 1
5 1919 1 1 23 LEU HD12 H 2.164 15.446 -6.721 1.00 . A A . 31 LEU HD12 1 1
5 1920 1 1 23 LEU HD13 H 2.987 13.898 -6.867 1.00 . A A . 31 LEU HD13 1 1
5 1921 1 1 23 LEU HD21 H 0.706 13.266 -10.016 1.00 . A A . 31 LEU HD21 1 1
5 1922 1 1 23 LEU HD22 H 0.241 13.007 -8.335 1.00 . A A . 31 LEU HD22 1 1
5 1923 1 1 23 LEU HD23 H 1.739 12.311 -8.954 1.00 . A A . 31 LEU HD23 1 1
5 1924 1 1 23 LEU HG H 2.787 14.445 -9.108 1.00 . A A . 31 LEU HG 1 1
5 1925 1 1 23 LEU N N -1.205 14.731 -9.483 1.00 . A A . 31 LEU N 1 1
5 1926 1 1 23 LEU O O -0.721 17.736 -7.578 1.00 . A A . 31 LEU O 1 1
5 1927 1 1 24 GLY C C -1.623 19.672 -9.685 1.00 . A A . 32 GLY C 1 1
5 1928 1 1 24 GLY CA C -2.623 18.556 -9.405 1.00 . A A . 32 GLY CA 1 1
5 1929 1 1 24 GLY H H -2.191 16.592 -10.076 1.00 . A A . 32 GLY H 1 1
5 1930 1 1 24 GLY HA2 H -3.384 18.559 -10.171 1.00 . A A . 32 GLY HA2 1 1
5 1931 1 1 24 GLY HA3 H -3.084 18.730 -8.444 1.00 . A A . 32 GLY HA3 1 1
5 1932 1 1 24 GLY N N -1.963 17.256 -9.392 1.00 . A A . 32 GLY N 1 1
5 1933 1 1 24 GLY O O -0.580 19.678 -9.053 1.00 . A A . 32 GLY O 1 1
5 1934 1 1 24 GLY OXT O -1.914 20.504 -10.528 1.00 . A A . 32 GLY OXT 1 1
5 1935 2 2 1 ZN ZN ZN -6.624 3.551 -10.373 1.00 . B A . 300 ZN ZN 1 1
6 1936 1 1 1 LYS C C -11.869 -4.807 0.731 1.00 . A A . 9 LYS C 1 1
6 1937 1 1 1 LYS CA C -11.352 -5.402 2.037 1.00 . A A . 9 LYS CA 1 1
6 1938 1 1 1 LYS CB C -9.824 -5.496 2.000 1.00 . A A . 9 LYS CB 1 1
6 1939 1 1 1 LYS CD C -7.739 -4.117 2.098 1.00 . A A . 9 LYS CD 1 1
6 1940 1 1 1 LYS CE C -7.036 -5.222 1.307 1.00 . A A . 9 LYS CE 1 1
6 1941 1 1 1 LYS CG C -9.232 -4.106 1.756 1.00 . A A . 9 LYS CG 1 1
6 1942 1 1 1 LYS H1 H -12.957 -6.727 2.088 1.00 . A A . 9 LYS H1 1 1
6 1943 1 1 1 LYS H2 H -11.712 -7.103 3.183 1.00 . A A . 9 LYS H2 1 1
6 1944 1 1 1 LYS H3 H -11.511 -7.414 1.525 1.00 . A A . 9 LYS H3 1 1
6 1945 1 1 1 LYS HA H -11.652 -4.771 2.861 1.00 . A A . 9 LYS HA 1 1
6 1946 1 1 1 LYS HB2 H -9.465 -5.883 2.943 1.00 . A A . 9 LYS HB2 1 1
6 1947 1 1 1 LYS HB3 H -9.525 -6.159 1.202 1.00 . A A . 9 LYS HB3 1 1
6 1948 1 1 1 LYS HD2 H -7.305 -3.160 1.843 1.00 . A A . 9 LYS HD2 1 1
6 1949 1 1 1 LYS HD3 H -7.614 -4.298 3.155 1.00 . A A . 9 LYS HD3 1 1
6 1950 1 1 1 LYS HE2 H -7.249 -6.180 1.759 1.00 . A A . 9 LYS HE2 1 1
6 1951 1 1 1 LYS HE3 H -7.390 -5.219 0.286 1.00 . A A . 9 LYS HE3 1 1
6 1952 1 1 1 LYS HG2 H -9.362 -3.838 0.717 1.00 . A A . 9 LYS HG2 1 1
6 1953 1 1 1 LYS HG3 H -9.736 -3.384 2.381 1.00 . A A . 9 LYS HG3 1 1
6 1954 1 1 1 LYS HZ1 H -5.306 -4.467 2.186 1.00 . A A . 9 LYS HZ1 1 1
6 1955 1 1 1 LYS HZ2 H -5.297 -4.422 0.487 1.00 . A A . 9 LYS HZ2 1 1
6 1956 1 1 1 LYS HZ3 H -5.065 -5.895 1.302 1.00 . A A . 9 LYS HZ3 1 1
6 1957 1 1 1 LYS N N -11.926 -6.765 2.222 1.00 . A A . 9 LYS N 1 1
6 1958 1 1 1 LYS NZ N -5.565 -4.984 1.321 1.00 . A A . 9 LYS NZ 1 1
6 1959 1 1 1 LYS O O -11.381 -5.139 -0.349 1.00 . A A . 9 LYS O 1 1
6 1960 1 1 2 ILE C C -12.523 -2.174 -0.843 1.00 . A A . 10 ILE C 1 1
6 1961 1 1 2 ILE CA C -13.433 -3.291 -0.340 1.00 . A A . 10 ILE CA 1 1
6 1962 1 1 2 ILE CB C -14.811 -2.717 -0.004 1.00 . A A . 10 ILE CB 1 1
6 1963 1 1 2 ILE CD1 C -17.012 -3.255 1.051 1.00 . A A . 10 ILE CD1 1 1
6 1964 1 1 2 ILE CG1 C -15.732 -3.849 0.461 1.00 . A A . 10 ILE CG1 1 1
6 1965 1 1 2 ILE CG2 C -15.408 -2.057 -1.249 1.00 . A A . 10 ILE CG2 1 1
6 1966 1 1 2 ILE H H -13.207 -3.700 1.726 1.00 . A A . 10 ILE H 1 1
6 1967 1 1 2 ILE HA H -13.544 -4.030 -1.119 1.00 . A A . 10 ILE HA 1 1
6 1968 1 1 2 ILE HB H -14.713 -1.984 0.782 1.00 . A A . 10 ILE HB 1 1
6 1969 1 1 2 ILE HD11 H -17.728 -4.045 1.224 1.00 . A A . 10 ILE HD11 1 1
6 1970 1 1 2 ILE HD12 H -17.428 -2.536 0.360 1.00 . A A . 10 ILE HD12 1 1
6 1971 1 1 2 ILE HD13 H -16.784 -2.765 1.986 1.00 . A A . 10 ILE HD13 1 1
6 1972 1 1 2 ILE HG12 H -15.981 -4.479 -0.381 1.00 . A A . 10 ILE HG12 1 1
6 1973 1 1 2 ILE HG13 H -15.228 -4.435 1.214 1.00 . A A . 10 ILE HG13 1 1
6 1974 1 1 2 ILE HG21 H -15.308 -2.723 -2.093 1.00 . A A . 10 ILE HG21 1 1
6 1975 1 1 2 ILE HG22 H -14.883 -1.135 -1.453 1.00 . A A . 10 ILE HG22 1 1
6 1976 1 1 2 ILE HG23 H -16.453 -1.846 -1.077 1.00 . A A . 10 ILE HG23 1 1
6 1977 1 1 2 ILE N N -12.858 -3.927 0.839 1.00 . A A . 10 ILE N 1 1
6 1978 1 1 2 ILE O O -12.721 -1.004 -0.517 1.00 . A A . 10 ILE O 1 1
6 1979 1 1 3 VAL C C -11.185 -0.854 -3.377 1.00 . A A . 11 VAL C 1 1
6 1980 1 1 3 VAL CA C -10.588 -1.570 -2.183 1.00 . A A . 11 VAL CA 1 1
6 1981 1 1 3 VAL CB C -9.287 -2.255 -2.594 1.00 . A A . 11 VAL CB 1 1
6 1982 1 1 3 VAL CG1 C -9.582 -3.347 -3.625 1.00 . A A . 11 VAL CG1 1 1
6 1983 1 1 3 VAL CG2 C -8.337 -1.222 -3.206 1.00 . A A . 11 VAL CG2 1 1
6 1984 1 1 3 VAL H H -11.417 -3.494 -1.862 1.00 . A A . 11 VAL H 1 1
6 1985 1 1 3 VAL HA H -10.365 -0.832 -1.429 1.00 . A A . 11 VAL HA 1 1
6 1986 1 1 3 VAL HB H -8.826 -2.696 -1.724 1.00 . A A . 11 VAL HB 1 1
6 1987 1 1 3 VAL HG11 H -9.870 -2.889 -4.561 1.00 . A A . 11 VAL HG11 1 1
6 1988 1 1 3 VAL HG12 H -10.386 -3.972 -3.269 1.00 . A A . 11 VAL HG12 1 1
6 1989 1 1 3 VAL HG13 H -8.698 -3.948 -3.777 1.00 . A A . 11 VAL HG13 1 1
6 1990 1 1 3 VAL HG21 H -7.348 -1.645 -3.286 1.00 . A A . 11 VAL HG21 1 1
6 1991 1 1 3 VAL HG22 H -8.304 -0.347 -2.574 1.00 . A A . 11 VAL HG22 1 1
6 1992 1 1 3 VAL HG23 H -8.691 -0.944 -4.187 1.00 . A A . 11 VAL HG23 1 1
6 1993 1 1 3 VAL N N -11.526 -2.546 -1.639 1.00 . A A . 11 VAL N 1 1
6 1994 1 1 3 VAL O O -11.738 -1.475 -4.285 1.00 . A A . 11 VAL O 1 1
6 1995 1 1 4 SER C C -10.692 2.518 -4.631 1.00 . A A . 12 SER C 1 1
6 1996 1 1 4 SER CA C -11.569 1.292 -4.448 1.00 . A A . 12 SER CA 1 1
6 1997 1 1 4 SER CB C -12.998 1.733 -4.160 1.00 . A A . 12 SER CB 1 1
6 1998 1 1 4 SER H H -10.597 0.891 -2.613 1.00 . A A . 12 SER H 1 1
6 1999 1 1 4 SER HA H -11.560 0.723 -5.367 1.00 . A A . 12 SER HA 1 1
6 2000 1 1 4 SER HB2 H -13.000 2.460 -3.366 1.00 . A A . 12 SER HB2 1 1
6 2001 1 1 4 SER HB3 H -13.413 2.177 -5.055 1.00 . A A . 12 SER HB3 1 1
6 2002 1 1 4 SER HG H -14.670 0.742 -4.076 1.00 . A A . 12 SER HG 1 1
6 2003 1 1 4 SER N N -11.057 0.465 -3.366 1.00 . A A . 12 SER N 1 1
6 2004 1 1 4 SER O O -10.514 3.321 -3.715 1.00 . A A . 12 SER O 1 1
6 2005 1 1 4 SER OG O -13.771 0.606 -3.769 1.00 . A A . 12 SER OG 1 1
6 2006 1 1 5 CYS C C -10.061 5.079 -6.053 1.00 . A A . 13 CYS C 1 1
6 2007 1 1 5 CYS CA C -9.288 3.766 -6.160 1.00 . A A . 13 CYS CA 1 1
6 2008 1 1 5 CYS CB C -8.745 3.587 -7.580 1.00 . A A . 13 CYS CB 1 1
6 2009 1 1 5 CYS H H -10.345 1.963 -6.498 1.00 . A A . 13 CYS H 1 1
6 2010 1 1 5 CYS HA H -8.459 3.790 -5.469 1.00 . A A . 13 CYS HA 1 1
6 2011 1 1 5 CYS HB2 H -8.519 2.543 -7.748 1.00 . A A . 13 CYS HB2 1 1
6 2012 1 1 5 CYS HB3 H -9.485 3.910 -8.293 1.00 . A A . 13 CYS HB3 1 1
6 2013 1 1 5 CYS N N -10.153 2.644 -5.825 1.00 . A A . 13 CYS N 1 1
6 2014 1 1 5 CYS O O -11.110 5.139 -5.411 1.00 . A A . 13 CYS O 1 1
6 2015 1 1 5 CYS SG S -7.238 4.565 -7.792 1.00 . A A . 13 CYS SG 1 1
6 2016 1 1 6 ARG C C -9.907 8.216 -7.926 1.00 . A A . 14 ARG C 1 1
6 2017 1 1 6 ARG CA C -10.195 7.438 -6.648 1.00 . A A . 14 ARG CA 1 1
6 2018 1 1 6 ARG CB C -9.699 8.237 -5.442 1.00 . A A . 14 ARG CB 1 1
6 2019 1 1 6 ARG CD C -9.836 8.411 -2.953 1.00 . A A . 14 ARG CD 1 1
6 2020 1 1 6 ARG CG C -10.040 7.486 -4.153 1.00 . A A . 14 ARG CG 1 1
6 2021 1 1 6 ARG CZ C -11.966 9.573 -2.881 1.00 . A A . 14 ARG CZ 1 1
6 2022 1 1 6 ARG H H -8.699 6.026 -7.179 1.00 . A A . 14 ARG H 1 1
6 2023 1 1 6 ARG HA H -11.264 7.299 -6.558 1.00 . A A . 14 ARG HA 1 1
6 2024 1 1 6 ARG HB2 H -8.629 8.366 -5.512 1.00 . A A . 14 ARG HB2 1 1
6 2025 1 1 6 ARG HB3 H -10.179 9.204 -5.429 1.00 . A A . 14 ARG HB3 1 1
6 2026 1 1 6 ARG HD2 H -10.117 7.892 -2.050 1.00 . A A . 14 ARG HD2 1 1
6 2027 1 1 6 ARG HD3 H -8.794 8.692 -2.893 1.00 . A A . 14 ARG HD3 1 1
6 2028 1 1 6 ARG HE H -10.232 10.455 -3.348 1.00 . A A . 14 ARG HE 1 1
6 2029 1 1 6 ARG HG2 H -11.070 7.161 -4.188 1.00 . A A . 14 ARG HG2 1 1
6 2030 1 1 6 ARG HG3 H -9.394 6.626 -4.056 1.00 . A A . 14 ARG HG3 1 1
6 2031 1 1 6 ARG HH11 H -11.996 7.621 -2.439 1.00 . A A . 14 ARG HH11 1 1
6 2032 1 1 6 ARG HH12 H -13.529 8.425 -2.380 1.00 . A A . 14 ARG HH12 1 1
6 2033 1 1 6 ARG HH21 H -12.238 11.518 -3.272 1.00 . A A . 14 ARG HH21 1 1
6 2034 1 1 6 ARG HH22 H -13.666 10.632 -2.852 1.00 . A A . 14 ARG HH22 1 1
6 2035 1 1 6 ARG N N -9.539 6.130 -6.684 1.00 . A A . 14 ARG N 1 1
6 2036 1 1 6 ARG NE N -10.656 9.609 -3.093 1.00 . A A . 14 ARG NE 1 1
6 2037 1 1 6 ARG NH1 N -12.542 8.453 -2.540 1.00 . A A . 14 ARG NH1 1 1
6 2038 1 1 6 ARG NH2 N -12.679 10.659 -3.012 1.00 . A A . 14 ARG NH2 1 1
6 2039 1 1 6 ARG O O -10.151 9.421 -8.000 1.00 . A A . 14 ARG O 1 1
6 2040 1 1 7 ILE C C -9.611 7.309 -11.366 1.00 . A A . 15 ILE C 1 1
6 2041 1 1 7 ILE CA C -9.054 8.144 -10.218 1.00 . A A . 15 ILE CA 1 1
6 2042 1 1 7 ILE CB C -7.534 8.253 -10.374 1.00 . A A . 15 ILE CB 1 1
6 2043 1 1 7 ILE CD1 C -5.423 8.765 -9.142 1.00 . A A . 15 ILE CD1 1 1
6 2044 1 1 7 ILE CG1 C -6.934 8.992 -9.172 1.00 . A A . 15 ILE CG1 1 1
6 2045 1 1 7 ILE CG2 C -7.209 9.022 -11.656 1.00 . A A . 15 ILE CG2 1 1
6 2046 1 1 7 ILE H H -9.210 6.562 -8.812 1.00 . A A . 15 ILE H 1 1
6 2047 1 1 7 ILE HA H -9.484 9.135 -10.264 1.00 . A A . 15 ILE HA 1 1
6 2048 1 1 7 ILE HB H -7.111 7.259 -10.436 1.00 . A A . 15 ILE HB 1 1
6 2049 1 1 7 ILE HD11 H -5.223 7.704 -9.101 1.00 . A A . 15 ILE HD11 1 1
6 2050 1 1 7 ILE HD12 H -5.004 9.245 -8.270 1.00 . A A . 15 ILE HD12 1 1
6 2051 1 1 7 ILE HD13 H -4.978 9.181 -10.033 1.00 . A A . 15 ILE HD13 1 1
6 2052 1 1 7 ILE HG12 H -7.139 10.050 -9.260 1.00 . A A . 15 ILE HG12 1 1
6 2053 1 1 7 ILE HG13 H -7.368 8.617 -8.259 1.00 . A A . 15 ILE HG13 1 1
6 2054 1 1 7 ILE HG21 H -7.785 9.934 -11.684 1.00 . A A . 15 ILE HG21 1 1
6 2055 1 1 7 ILE HG22 H -7.455 8.412 -12.513 1.00 . A A . 15 ILE HG22 1 1
6 2056 1 1 7 ILE HG23 H -6.155 9.261 -11.675 1.00 . A A . 15 ILE HG23 1 1
6 2057 1 1 7 ILE N N -9.382 7.519 -8.933 1.00 . A A . 15 ILE N 1 1
6 2058 1 1 7 ILE O O -10.028 7.845 -12.393 1.00 . A A . 15 ILE O 1 1
6 2059 1 1 8 CYS C C -11.035 4.032 -11.583 1.00 . A A . 16 CYS C 1 1
6 2060 1 1 8 CYS CA C -10.098 5.065 -12.203 1.00 . A A . 16 CYS CA 1 1
6 2061 1 1 8 CYS CB C -8.916 4.351 -12.855 1.00 . A A . 16 CYS CB 1 1
6 2062 1 1 8 CYS H H -9.252 5.629 -10.346 1.00 . A A . 16 CYS H 1 1
6 2063 1 1 8 CYS HA H -10.638 5.612 -12.963 1.00 . A A . 16 CYS HA 1 1
6 2064 1 1 8 CYS HB2 H -9.258 3.799 -13.717 1.00 . A A . 16 CYS HB2 1 1
6 2065 1 1 8 CYS HB3 H -8.182 5.080 -13.160 1.00 . A A . 16 CYS HB3 1 1
6 2066 1 1 8 CYS N N -9.604 5.990 -11.183 1.00 . A A . 16 CYS N 1 1
6 2067 1 1 8 CYS O O -11.795 3.370 -12.290 1.00 . A A . 16 CYS O 1 1
6 2068 1 1 8 CYS SG S -8.171 3.210 -11.663 1.00 . A A . 16 CYS SG 1 1
6 2069 1 1 9 LYS C C -11.547 1.525 -10.055 1.00 . A A . 17 LYS C 1 1
6 2070 1 1 9 LYS CA C -11.828 2.942 -9.565 1.00 . A A . 17 LYS CA 1 1
6 2071 1 1 9 LYS CB C -13.298 3.289 -9.797 1.00 . A A . 17 LYS CB 1 1
6 2072 1 1 9 LYS CD C -14.979 5.137 -9.856 1.00 . A A . 17 LYS CD 1 1
6 2073 1 1 9 LYS CE C -15.277 6.538 -9.319 1.00 . A A . 17 LYS CE 1 1
6 2074 1 1 9 LYS CG C -13.511 4.793 -9.606 1.00 . A A . 17 LYS CG 1 1
6 2075 1 1 9 LYS H H -10.356 4.448 -9.744 1.00 . A A . 17 LYS H 1 1
6 2076 1 1 9 LYS HA H -11.621 2.993 -8.507 1.00 . A A . 17 LYS HA 1 1
6 2077 1 1 9 LYS HB2 H -13.581 3.007 -10.800 1.00 . A A . 17 LYS HB2 1 1
6 2078 1 1 9 LYS HB3 H -13.905 2.751 -9.087 1.00 . A A . 17 LYS HB3 1 1
6 2079 1 1 9 LYS HD2 H -15.179 5.107 -10.918 1.00 . A A . 17 LYS HD2 1 1
6 2080 1 1 9 LYS HD3 H -15.609 4.420 -9.351 1.00 . A A . 17 LYS HD3 1 1
6 2081 1 1 9 LYS HE2 H -14.495 7.216 -9.629 1.00 . A A . 17 LYS HE2 1 1
6 2082 1 1 9 LYS HE3 H -16.224 6.880 -9.710 1.00 . A A . 17 LYS HE3 1 1
6 2083 1 1 9 LYS HG2 H -13.241 5.069 -8.596 1.00 . A A . 17 LYS HG2 1 1
6 2084 1 1 9 LYS HG3 H -12.893 5.338 -10.304 1.00 . A A . 17 LYS HG3 1 1
6 2085 1 1 9 LYS HZ1 H -14.387 6.335 -7.447 1.00 . A A . 17 LYS HZ1 1 1
6 2086 1 1 9 LYS HZ2 H -15.971 5.725 -7.532 1.00 . A A . 17 LYS HZ2 1 1
6 2087 1 1 9 LYS HZ3 H -15.704 7.403 -7.474 1.00 . A A . 17 LYS HZ3 1 1
6 2088 1 1 9 LYS N N -10.978 3.897 -10.260 1.00 . A A . 17 LYS N 1 1
6 2089 1 1 9 LYS NZ N -15.339 6.497 -7.831 1.00 . A A . 17 LYS NZ 1 1
6 2090 1 1 9 LYS O O -12.470 0.762 -10.343 1.00 . A A . 17 LYS O 1 1
6 2091 1 1 10 GLY C C -9.923 -1.157 -9.466 1.00 . A A . 18 GLY C 1 1
6 2092 1 1 10 GLY CA C -9.867 -0.146 -10.606 1.00 . A A . 18 GLY CA 1 1
6 2093 1 1 10 GLY H H -9.574 1.832 -9.906 1.00 . A A . 18 GLY H 1 1
6 2094 1 1 10 GLY HA2 H -10.533 -0.464 -11.397 1.00 . A A . 18 GLY HA2 1 1
6 2095 1 1 10 GLY HA3 H -8.859 -0.102 -10.988 1.00 . A A . 18 GLY HA3 1 1
6 2096 1 1 10 GLY N N -10.265 1.181 -10.149 1.00 . A A . 18 GLY N 1 1
6 2097 1 1 10 GLY O O -10.965 -1.342 -8.837 1.00 . A A . 18 GLY O 1 1
6 2098 1 1 11 ASP C C -7.515 -2.543 -7.231 1.00 . A A . 19 ASP C 1 1
6 2099 1 1 11 ASP CA C -8.710 -2.818 -8.142 1.00 . A A . 19 ASP CA 1 1
6 2100 1 1 11 ASP CB C -8.575 -4.212 -8.759 1.00 . A A . 19 ASP CB 1 1
6 2101 1 1 11 ASP CG C -7.212 -4.359 -9.431 1.00 . A A . 19 ASP CG 1 1
6 2102 1 1 11 ASP H H -7.997 -1.628 -9.746 1.00 . A A . 19 ASP H 1 1
6 2103 1 1 11 ASP HA H -9.613 -2.790 -7.546 1.00 . A A . 19 ASP HA 1 1
6 2104 1 1 11 ASP HB2 H -8.675 -4.958 -7.985 1.00 . A A . 19 ASP HB2 1 1
6 2105 1 1 11 ASP HB3 H -9.351 -4.351 -9.495 1.00 . A A . 19 ASP HB3 1 1
6 2106 1 1 11 ASP N N -8.792 -1.816 -9.207 1.00 . A A . 19 ASP N 1 1
6 2107 1 1 11 ASP O O -6.781 -3.459 -6.863 1.00 . A A . 19 ASP O 1 1
6 2108 1 1 11 ASP OD1 O -7.117 -4.046 -10.606 1.00 . A A . 19 ASP OD1 1 1
6 2109 1 1 11 ASP OD2 O -6.286 -4.785 -8.761 1.00 . A A . 19 ASP OD2 1 1
6 2110 1 1 12 HIS C C -6.563 0.423 -5.297 1.00 . A A . 20 HIS C 1 1
6 2111 1 1 12 HIS CA C -6.229 -0.890 -6.003 1.00 . A A . 20 HIS CA 1 1
6 2112 1 1 12 HIS CB C -4.944 -0.728 -6.828 1.00 . A A . 20 HIS CB 1 1
6 2113 1 1 12 HIS CD2 C -5.779 1.173 -8.438 1.00 . A A . 20 HIS CD2 1 1
6 2114 1 1 12 HIS CE1 C -5.438 0.163 -10.324 1.00 . A A . 20 HIS CE1 1 1
6 2115 1 1 12 HIS CG C -5.267 -0.065 -8.138 1.00 . A A . 20 HIS CG 1 1
6 2116 1 1 12 HIS H H -7.943 -0.588 -7.187 1.00 . A A . 20 HIS H 1 1
6 2117 1 1 12 HIS HA H -6.075 -1.659 -5.260 1.00 . A A . 20 HIS HA 1 1
6 2118 1 1 12 HIS HB2 H -4.240 -0.121 -6.286 1.00 . A A . 20 HIS HB2 1 1
6 2119 1 1 12 HIS HB3 H -4.506 -1.696 -7.012 1.00 . A A . 20 HIS HB3 1 1
6 2120 1 1 12 HIS HD2 H -6.058 1.923 -7.711 1.00 . A A . 20 HIS HD2 1 1
6 2121 1 1 12 HIS HE1 H -5.389 -0.056 -11.380 1.00 . A A . 20 HIS HE1 1 1
6 2122 1 1 12 HIS N N -7.329 -1.276 -6.870 1.00 . A A . 20 HIS N 1 1
6 2123 1 1 12 HIS ND1 N -5.058 -0.692 -9.357 1.00 . A A . 20 HIS ND1 1 1
6 2124 1 1 12 HIS NE2 N -5.886 1.315 -9.818 1.00 . A A . 20 HIS NE2 1 1
6 2125 1 1 12 HIS O O -7.702 0.889 -5.328 1.00 . A A . 20 HIS O 1 1
6 2126 1 1 13 TRP C C -5.300 3.439 -4.838 1.00 . A A . 21 TRP C 1 1
6 2127 1 1 13 TRP CA C -5.717 2.270 -3.949 1.00 . A A . 21 TRP CA 1 1
6 2128 1 1 13 TRP CB C -4.849 2.259 -2.685 1.00 . A A . 21 TRP CB 1 1
6 2129 1 1 13 TRP CD1 C -5.513 0.033 -1.687 1.00 . A A . 21 TRP CD1 1 1
6 2130 1 1 13 TRP CD2 C -6.168 1.776 -0.425 1.00 . A A . 21 TRP CD2 1 1
6 2131 1 1 13 TRP CE2 C -6.599 0.606 0.244 1.00 . A A . 21 TRP CE2 1 1
6 2132 1 1 13 TRP CE3 C -6.456 3.021 0.165 1.00 . A A . 21 TRP CE3 1 1
6 2133 1 1 13 TRP CG C -5.480 1.385 -1.648 1.00 . A A . 21 TRP CG 1 1
6 2134 1 1 13 TRP CH2 C -7.569 1.913 2.025 1.00 . A A . 21 TRP CH2 1 1
6 2135 1 1 13 TRP CZ2 C -7.292 0.668 1.454 1.00 . A A . 21 TRP CZ2 1 1
6 2136 1 1 13 TRP CZ3 C -7.153 3.087 1.382 1.00 . A A . 21 TRP CZ3 1 1
6 2137 1 1 13 TRP H H -4.679 0.580 -4.690 1.00 . A A . 21 TRP H 1 1
6 2138 1 1 13 TRP HA H -6.753 2.397 -3.664 1.00 . A A . 21 TRP HA 1 1
6 2139 1 1 13 TRP HB2 H -3.869 1.876 -2.928 1.00 . A A . 21 TRP HB2 1 1
6 2140 1 1 13 TRP HB3 H -4.755 3.264 -2.301 1.00 . A A . 21 TRP HB3 1 1
6 2141 1 1 13 TRP HD1 H -5.090 -0.585 -2.466 1.00 . A A . 21 TRP HD1 1 1
6 2142 1 1 13 TRP HE1 H -6.337 -1.374 -0.352 1.00 . A A . 21 TRP HE1 1 1
6 2143 1 1 13 TRP HE3 H -6.139 3.931 -0.323 1.00 . A A . 21 TRP HE3 1 1
6 2144 1 1 13 TRP HH2 H -8.105 1.970 2.961 1.00 . A A . 21 TRP HH2 1 1
6 2145 1 1 13 TRP HZ2 H -7.611 -0.240 1.945 1.00 . A A . 21 TRP HZ2 1 1
6 2146 1 1 13 TRP HZ3 H -7.369 4.048 1.826 1.00 . A A . 21 TRP HZ3 1 1
6 2147 1 1 13 TRP N N -5.555 1.007 -4.667 1.00 . A A . 21 TRP N 1 1
6 2148 1 1 13 TRP NE1 N -6.177 -0.431 -0.565 1.00 . A A . 21 TRP NE1 1 1
6 2149 1 1 13 TRP O O -4.924 3.249 -5.995 1.00 . A A . 21 TRP O 1 1
6 2150 1 1 14 THR C C -3.472 6.017 -5.019 1.00 . A A . 22 THR C 1 1
6 2151 1 1 14 THR CA C -4.989 5.841 -5.036 1.00 . A A . 22 THR CA 1 1
6 2152 1 1 14 THR CB C -5.661 7.074 -4.420 1.00 . A A . 22 THR CB 1 1
6 2153 1 1 14 THR CG2 C -5.640 8.234 -5.420 1.00 . A A . 22 THR CG2 1 1
6 2154 1 1 14 THR H H -5.671 4.737 -3.360 1.00 . A A . 22 THR H 1 1
6 2155 1 1 14 THR HA H -5.319 5.735 -6.059 1.00 . A A . 22 THR HA 1 1
6 2156 1 1 14 THR HB H -5.130 7.366 -3.527 1.00 . A A . 22 THR HB 1 1
6 2157 1 1 14 THR HG1 H -7.081 5.803 -4.035 1.00 . A A . 22 THR HG1 1 1
6 2158 1 1 14 THR HG21 H -6.108 7.923 -6.342 1.00 . A A . 22 THR HG21 1 1
6 2159 1 1 14 THR HG22 H -4.619 8.524 -5.615 1.00 . A A . 22 THR HG22 1 1
6 2160 1 1 14 THR HG23 H -6.180 9.073 -5.008 1.00 . A A . 22 THR HG23 1 1
6 2161 1 1 14 THR N N -5.366 4.647 -4.288 1.00 . A A . 22 THR N 1 1
6 2162 1 1 14 THR O O -2.930 6.892 -5.695 1.00 . A A . 22 THR O 1 1
6 2163 1 1 14 THR OG1 O -7.006 6.758 -4.089 1.00 . A A . 22 THR OG1 1 1
6 2164 1 1 15 THR C C -0.676 4.529 -5.300 1.00 . A A . 23 THR C 1 1
6 2165 1 1 15 THR CA C -1.341 5.250 -4.131 1.00 . A A . 23 THR CA 1 1
6 2166 1 1 15 THR CB C -0.885 4.617 -2.815 1.00 . A A . 23 THR CB 1 1
6 2167 1 1 15 THR CG2 C 0.574 4.986 -2.545 1.00 . A A . 23 THR CG2 1 1
6 2168 1 1 15 THR H H -3.283 4.506 -3.720 1.00 . A A . 23 THR H 1 1
6 2169 1 1 15 THR HA H -1.037 6.285 -4.140 1.00 . A A . 23 THR HA 1 1
6 2170 1 1 15 THR HB H -0.975 3.544 -2.882 1.00 . A A . 23 THR HB 1 1
6 2171 1 1 15 THR HG1 H -1.562 6.042 -1.677 1.00 . A A . 23 THR HG1 1 1
6 2172 1 1 15 THR HG21 H 0.963 4.360 -1.755 1.00 . A A . 23 THR HG21 1 1
6 2173 1 1 15 THR HG22 H 0.634 6.022 -2.247 1.00 . A A . 23 THR HG22 1 1
6 2174 1 1 15 THR HG23 H 1.155 4.834 -3.443 1.00 . A A . 23 THR HG23 1 1
6 2175 1 1 15 THR N N -2.796 5.181 -4.237 1.00 . A A . 23 THR N 1 1
6 2176 1 1 15 THR O O 0.118 5.118 -6.032 1.00 . A A . 23 THR O 1 1
6 2177 1 1 15 THR OG1 O -1.701 5.095 -1.754 1.00 . A A . 23 THR OG1 1 1
6 2178 1 1 16 ARG C C -1.278 2.553 -7.813 1.00 . A A . 24 ARG C 1 1
6 2179 1 1 16 ARG CA C -0.421 2.453 -6.553 1.00 . A A . 24 ARG CA 1 1
6 2180 1 1 16 ARG CB C -0.304 0.984 -6.123 1.00 . A A . 24 ARG CB 1 1
6 2181 1 1 16 ARG CD C -1.610 -0.984 -5.309 1.00 . A A . 24 ARG CD 1 1
6 2182 1 1 16 ARG CG C -1.693 0.351 -6.050 1.00 . A A . 24 ARG CG 1 1
6 2183 1 1 16 ARG CZ C -0.046 -2.841 -5.210 1.00 . A A . 24 ARG CZ 1 1
6 2184 1 1 16 ARG H H -1.639 2.828 -4.851 1.00 . A A . 24 ARG H 1 1
6 2185 1 1 16 ARG HA H 0.569 2.826 -6.776 1.00 . A A . 24 ARG HA 1 1
6 2186 1 1 16 ARG HB2 H 0.298 0.446 -6.843 1.00 . A A . 24 ARG HB2 1 1
6 2187 1 1 16 ARG HB3 H 0.160 0.929 -5.151 1.00 . A A . 24 ARG HB3 1 1
6 2188 1 1 16 ARG HD2 H -1.391 -0.803 -4.268 1.00 . A A . 24 ARG HD2 1 1
6 2189 1 1 16 ARG HD3 H -2.556 -1.499 -5.390 1.00 . A A . 24 ARG HD3 1 1
6 2190 1 1 16 ARG HE H -0.217 -1.610 -6.779 1.00 . A A . 24 ARG HE 1 1
6 2191 1 1 16 ARG HG2 H -2.361 1.017 -5.522 1.00 . A A . 24 ARG HG2 1 1
6 2192 1 1 16 ARG HG3 H -2.064 0.183 -7.050 1.00 . A A . 24 ARG HG3 1 1
6 2193 1 1 16 ARG HH11 H -1.211 -2.564 -3.606 1.00 . A A . 24 ARG HH11 1 1
6 2194 1 1 16 ARG HH12 H -0.106 -3.894 -3.509 1.00 . A A . 24 ARG HH12 1 1
6 2195 1 1 16 ARG HH21 H 1.236 -3.351 -6.661 1.00 . A A . 24 ARG HH21 1 1
6 2196 1 1 16 ARG HH22 H 1.280 -4.339 -5.238 1.00 . A A . 24 ARG HH22 1 1
6 2197 1 1 16 ARG N N -1.001 3.247 -5.469 1.00 . A A . 24 ARG N 1 1
6 2198 1 1 16 ARG NE N -0.555 -1.813 -5.883 1.00 . A A . 24 ARG NE 1 1
6 2199 1 1 16 ARG NH1 N -0.488 -3.121 -4.015 1.00 . A A . 24 ARG NH1 1 1
6 2200 1 1 16 ARG NH2 N 0.897 -3.567 -5.745 1.00 . A A . 24 ARG NH2 1 1
6 2201 1 1 16 ARG O O -1.239 1.672 -8.672 1.00 . A A . 24 ARG O 1 1
6 2202 1 1 17 CYS C C -2.074 4.120 -10.325 1.00 . A A . 25 CYS C 1 1
6 2203 1 1 17 CYS CA C -2.915 3.819 -9.077 1.00 . A A . 25 CYS CA 1 1
6 2204 1 1 17 CYS CB C -3.878 4.980 -8.817 1.00 . A A . 25 CYS CB 1 1
6 2205 1 1 17 CYS H H -2.048 4.297 -7.202 1.00 . A A . 25 CYS H 1 1
6 2206 1 1 17 CYS HA H -3.489 2.921 -9.223 1.00 . A A . 25 CYS HA 1 1
6 2207 1 1 17 CYS HB2 H -4.564 4.708 -8.030 1.00 . A A . 25 CYS HB2 1 1
6 2208 1 1 17 CYS HB3 H -3.318 5.853 -8.521 1.00 . A A . 25 CYS HB3 1 1
6 2209 1 1 17 CYS N N -2.053 3.626 -7.916 1.00 . A A . 25 CYS N 1 1
6 2210 1 1 17 CYS O O -1.148 4.929 -10.260 1.00 . A A . 25 CYS O 1 1
6 2211 1 1 17 CYS SG S -4.807 5.344 -10.328 1.00 . A A . 25 CYS SG 1 1
6 2212 1 1 18 PRO C C -1.926 5.107 -13.329 1.00 . A A . 26 PRO C 1 1
6 2213 1 1 18 PRO CA C -1.586 3.751 -12.708 1.00 . A A . 26 PRO CA 1 1
6 2214 1 1 18 PRO CB C -2.009 2.596 -13.624 1.00 . A A . 26 PRO CB 1 1
6 2215 1 1 18 PRO CD C -3.436 2.512 -11.676 1.00 . A A . 26 PRO CD 1 1
6 2216 1 1 18 PRO CG C -3.397 2.260 -13.187 1.00 . A A . 26 PRO CG 1 1
6 2217 1 1 18 PRO HA H -0.528 3.688 -12.511 1.00 . A A . 26 PRO HA 1 1
6 2218 1 1 18 PRO HB2 H -1.998 2.906 -14.663 1.00 . A A . 26 PRO HB2 1 1
6 2219 1 1 18 PRO HB3 H -1.360 1.744 -13.479 1.00 . A A . 26 PRO HB3 1 1
6 2220 1 1 18 PRO HD2 H -4.396 2.914 -11.384 1.00 . A A . 26 PRO HD2 1 1
6 2221 1 1 18 PRO HD3 H -3.221 1.604 -11.133 1.00 . A A . 26 PRO HD3 1 1
6 2222 1 1 18 PRO HG2 H -4.111 2.899 -13.695 1.00 . A A . 26 PRO HG2 1 1
6 2223 1 1 18 PRO HG3 H -3.617 1.222 -13.391 1.00 . A A . 26 PRO HG3 1 1
6 2224 1 1 18 PRO N N -2.360 3.503 -11.455 1.00 . A A . 26 PRO N 1 1
6 2225 1 1 18 PRO O O -1.771 5.305 -14.534 1.00 . A A . 26 PRO O 1 1
6 2226 1 1 19 TYR C C -2.539 8.401 -11.862 1.00 . A A . 27 TYR C 1 1
6 2227 1 1 19 TYR CA C -2.751 7.370 -12.966 1.00 . A A . 27 TYR CA 1 1
6 2228 1 1 19 TYR CB C -4.216 7.389 -13.406 1.00 . A A . 27 TYR CB 1 1
6 2229 1 1 19 TYR CD1 C -3.926 6.856 -15.853 1.00 . A A . 27 TYR CD1 1 1
6 2230 1 1 19 TYR CD2 C -5.044 5.237 -14.435 1.00 . A A . 27 TYR CD2 1 1
6 2231 1 1 19 TYR CE1 C -4.095 6.008 -16.954 1.00 . A A . 27 TYR CE1 1 1
6 2232 1 1 19 TYR CE2 C -5.214 4.390 -15.537 1.00 . A A . 27 TYR CE2 1 1
6 2233 1 1 19 TYR CG C -4.400 6.472 -14.593 1.00 . A A . 27 TYR CG 1 1
6 2234 1 1 19 TYR CZ C -4.740 4.775 -16.796 1.00 . A A . 27 TYR CZ 1 1
6 2235 1 1 19 TYR H H -2.491 5.817 -11.545 1.00 . A A . 27 TYR H 1 1
6 2236 1 1 19 TYR HA H -2.130 7.632 -13.811 1.00 . A A . 27 TYR HA 1 1
6 2237 1 1 19 TYR HB2 H -4.841 7.057 -12.590 1.00 . A A . 27 TYR HB2 1 1
6 2238 1 1 19 TYR HB3 H -4.495 8.395 -13.685 1.00 . A A . 27 TYR HB3 1 1
6 2239 1 1 19 TYR HD1 H -3.428 7.807 -15.976 1.00 . A A . 27 TYR HD1 1 1
6 2240 1 1 19 TYR HD2 H -5.410 4.940 -13.464 1.00 . A A . 27 TYR HD2 1 1
6 2241 1 1 19 TYR HE1 H -3.729 6.305 -17.926 1.00 . A A . 27 TYR HE1 1 1
6 2242 1 1 19 TYR HE2 H -5.710 3.439 -15.415 1.00 . A A . 27 TYR HE2 1 1
6 2243 1 1 19 TYR HH H -4.507 4.362 -18.646 1.00 . A A . 27 TYR HH 1 1
6 2244 1 1 19 TYR N N -2.390 6.035 -12.495 1.00 . A A . 27 TYR N 1 1
6 2245 1 1 19 TYR O O -3.327 9.333 -11.710 1.00 . A A . 27 TYR O 1 1
6 2246 1 1 19 TYR OH O -4.907 3.939 -17.882 1.00 . A A . 27 TYR OH 1 1
6 2247 1 1 20 LYS C C -0.603 10.458 -10.564 1.00 . A A . 28 LYS C 1 1
6 2248 1 1 20 LYS CA C -1.157 9.149 -10.013 1.00 . A A . 28 LYS CA 1 1
6 2249 1 1 20 LYS CB C -0.154 8.504 -9.041 1.00 . A A . 28 LYS CB 1 1
6 2250 1 1 20 LYS CD C 1.230 7.580 -10.941 1.00 . A A . 28 LYS CD 1 1
6 2251 1 1 20 LYS CE C 2.659 7.177 -11.315 1.00 . A A . 28 LYS CE 1 1
6 2252 1 1 20 LYS CG C 1.254 8.421 -9.660 1.00 . A A . 28 LYS CG 1 1
6 2253 1 1 20 LYS H H -0.871 7.470 -11.264 1.00 . A A . 28 LYS H 1 1
6 2254 1 1 20 LYS HA H -2.068 9.362 -9.475 1.00 . A A . 28 LYS HA 1 1
6 2255 1 1 20 LYS HB2 H -0.109 9.093 -8.138 1.00 . A A . 28 LYS HB2 1 1
6 2256 1 1 20 LYS HB3 H -0.491 7.507 -8.797 1.00 . A A . 28 LYS HB3 1 1
6 2257 1 1 20 LYS HD2 H 0.638 6.692 -10.779 1.00 . A A . 28 LYS HD2 1 1
6 2258 1 1 20 LYS HD3 H 0.806 8.160 -11.747 1.00 . A A . 28 LYS HD3 1 1
6 2259 1 1 20 LYS HE2 H 2.676 6.815 -12.332 1.00 . A A . 28 LYS HE2 1 1
6 2260 1 1 20 LYS HE3 H 3.310 8.035 -11.228 1.00 . A A . 28 LYS HE3 1 1
6 2261 1 1 20 LYS HG2 H 1.613 9.411 -9.888 1.00 . A A . 28 LYS HG2 1 1
6 2262 1 1 20 LYS HG3 H 1.921 7.959 -8.949 1.00 . A A . 28 LYS HG3 1 1
6 2263 1 1 20 LYS HZ1 H 2.309 5.607 -9.992 1.00 . A A . 28 LYS HZ1 1 1
6 2264 1 1 20 LYS HZ2 H 3.693 6.523 -9.630 1.00 . A A . 28 LYS HZ2 1 1
6 2265 1 1 20 LYS HZ3 H 3.713 5.424 -10.925 1.00 . A A . 28 LYS HZ3 1 1
6 2266 1 1 20 LYS N N -1.466 8.228 -11.096 1.00 . A A . 28 LYS N 1 1
6 2267 1 1 20 LYS NZ N 3.128 6.102 -10.396 1.00 . A A . 28 LYS NZ 1 1
6 2268 1 1 20 LYS O O 0.051 11.218 -9.849 1.00 . A A . 28 LYS O 1 1
6 2269 1 1 21 ASP C C -1.027 13.152 -11.867 1.00 . A A . 29 ASP C 1 1
6 2270 1 1 21 ASP CA C -0.399 11.911 -12.494 1.00 . A A . 29 ASP CA 1 1
6 2271 1 1 21 ASP CB C -0.747 11.809 -13.980 1.00 . A A . 29 ASP CB 1 1
6 2272 1 1 21 ASP CG C -2.189 12.245 -14.247 1.00 . A A . 29 ASP CG 1 1
6 2273 1 1 21 ASP H H -1.386 10.069 -12.363 1.00 . A A . 29 ASP H 1 1
6 2274 1 1 21 ASP HA H 0.667 11.971 -12.385 1.00 . A A . 29 ASP HA 1 1
6 2275 1 1 21 ASP HB2 H -0.079 12.424 -14.542 1.00 . A A . 29 ASP HB2 1 1
6 2276 1 1 21 ASP HB3 H -0.630 10.784 -14.292 1.00 . A A . 29 ASP HB3 1 1
6 2277 1 1 21 ASP N N -0.867 10.710 -11.841 1.00 . A A . 29 ASP N 1 1
6 2278 1 1 21 ASP O O -0.784 14.277 -12.300 1.00 . A A . 29 ASP O 1 1
6 2279 1 1 21 ASP OD1 O -3.089 11.539 -13.821 1.00 . A A . 29 ASP OD1 1 1
6 2280 1 1 21 ASP OD2 O -2.369 13.277 -14.871 1.00 . A A . 29 ASP OD2 1 1
6 2281 1 1 22 THR C C -2.862 13.594 -8.721 1.00 . A A . 30 THR C 1 1
6 2282 1 1 22 THR CA C -2.509 14.011 -10.144 1.00 . A A . 30 THR CA 1 1
6 2283 1 1 22 THR CB C -3.784 14.401 -10.896 1.00 . A A . 30 THR CB 1 1
6 2284 1 1 22 THR CG2 C -4.618 13.150 -11.173 1.00 . A A . 30 THR CG2 1 1
6 2285 1 1 22 THR H H -1.977 11.999 -10.560 1.00 . A A . 30 THR H 1 1
6 2286 1 1 22 THR HA H -1.851 14.867 -10.105 1.00 . A A . 30 THR HA 1 1
6 2287 1 1 22 THR HB H -3.521 14.868 -11.832 1.00 . A A . 30 THR HB 1 1
6 2288 1 1 22 THR HG1 H -4.437 16.187 -10.486 1.00 . A A . 30 THR HG1 1 1
6 2289 1 1 22 THR HG21 H -4.924 12.707 -10.237 1.00 . A A . 30 THR HG21 1 1
6 2290 1 1 22 THR HG22 H -4.027 12.439 -11.731 1.00 . A A . 30 THR HG22 1 1
6 2291 1 1 22 THR HG23 H -5.492 13.420 -11.747 1.00 . A A . 30 THR HG23 1 1
6 2292 1 1 22 THR N N -1.833 12.922 -10.846 1.00 . A A . 30 THR N 1 1
6 2293 1 1 22 THR O O -4.012 13.709 -8.298 1.00 . A A . 30 THR O 1 1
6 2294 1 1 22 THR OG1 O -4.536 15.312 -10.106 1.00 . A A . 30 THR OG1 1 1
6 2295 1 1 23 LEU C C -2.403 13.879 -5.722 1.00 . A A . 31 LEU C 1 1
6 2296 1 1 23 LEU CA C -2.084 12.681 -6.610 1.00 . A A . 31 LEU CA 1 1
6 2297 1 1 23 LEU CB C -0.833 11.970 -6.081 1.00 . A A . 31 LEU CB 1 1
6 2298 1 1 23 LEU CD1 C -1.754 9.871 -5.015 1.00 . A A . 31 LEU CD1 1 1
6 2299 1 1 23 LEU CD2 C 0.143 11.082 -3.940 1.00 . A A . 31 LEU CD2 1 1
6 2300 1 1 23 LEU CG C -1.148 11.255 -4.748 1.00 . A A . 31 LEU CG 1 1
6 2301 1 1 23 LEU H H -0.969 13.043 -8.376 1.00 . A A . 31 LEU H 1 1
6 2302 1 1 23 LEU HA H -2.914 11.996 -6.586 1.00 . A A . 31 LEU HA 1 1
6 2303 1 1 23 LEU HB2 H -0.495 11.249 -6.812 1.00 . A A . 31 LEU HB2 1 1
6 2304 1 1 23 LEU HB3 H -0.054 12.703 -5.921 1.00 . A A . 31 LEU HB3 1 1
6 2305 1 1 23 LEU HD11 H -1.111 9.315 -5.680 1.00 . A A . 31 LEU HD11 1 1
6 2306 1 1 23 LEU HD12 H -2.729 9.981 -5.465 1.00 . A A . 31 LEU HD12 1 1
6 2307 1 1 23 LEU HD13 H -1.851 9.337 -4.081 1.00 . A A . 31 LEU HD13 1 1
6 2308 1 1 23 LEU HD21 H 0.535 12.052 -3.674 1.00 . A A . 31 LEU HD21 1 1
6 2309 1 1 23 LEU HD22 H 0.871 10.549 -4.534 1.00 . A A . 31 LEU HD22 1 1
6 2310 1 1 23 LEU HD23 H -0.068 10.519 -3.042 1.00 . A A . 31 LEU HD23 1 1
6 2311 1 1 23 LEU HG H -1.849 11.848 -4.177 1.00 . A A . 31 LEU HG 1 1
6 2312 1 1 23 LEU N N -1.866 13.111 -7.986 1.00 . A A . 31 LEU N 1 1
6 2313 1 1 23 LEU O O -1.510 14.467 -5.110 1.00 . A A . 31 LEU O 1 1
6 2314 1 1 24 GLY C C -3.464 15.311 -3.455 1.00 . A A . 32 GLY C 1 1
6 2315 1 1 24 GLY CA C -4.105 15.367 -4.838 1.00 . A A . 32 GLY CA 1 1
6 2316 1 1 24 GLY H H -4.350 13.732 -6.163 1.00 . A A . 32 GLY H 1 1
6 2317 1 1 24 GLY HA2 H -3.816 16.286 -5.327 1.00 . A A . 32 GLY HA2 1 1
6 2318 1 1 24 GLY HA3 H -5.179 15.344 -4.729 1.00 . A A . 32 GLY HA3 1 1
6 2319 1 1 24 GLY N N -3.681 14.237 -5.655 1.00 . A A . 32 GLY N 1 1
6 2320 1 1 24 GLY O O -2.537 16.069 -3.222 1.00 . A A . 32 GLY O 1 1
6 2321 1 1 24 GLY OXT O -3.910 14.511 -2.650 1.00 . A A . 32 GLY OXT 1 1
6 2322 2 2 1 ZN ZN ZN -6.581 3.562 -10.056 1.00 . B A . 300 ZN ZN 1 1
7 2323 1 1 1 LYS C C -11.315 -4.104 1.208 1.00 . A A . 9 LYS C 1 1
7 2324 1 1 1 LYS CA C -10.531 -4.806 2.311 1.00 . A A . 9 LYS CA 1 1
7 2325 1 1 1 LYS CB C -10.183 -6.231 1.875 1.00 . A A . 9 LYS CB 1 1
7 2326 1 1 1 LYS CD C -11.118 -8.494 1.375 1.00 . A A . 9 LYS CD 1 1
7 2327 1 1 1 LYS CE C -12.384 -9.354 1.388 1.00 . A A . 9 LYS CE 1 1
7 2328 1 1 1 LYS CG C -11.441 -7.102 1.922 1.00 . A A . 9 LYS CG 1 1
7 2329 1 1 1 LYS H1 H -11.127 -4.041 4.153 1.00 . A A . 9 LYS H1 1 1
7 2330 1 1 1 LYS H2 H -11.156 -5.738 4.065 1.00 . A A . 9 LYS H2 1 1
7 2331 1 1 1 LYS H3 H -12.365 -4.823 3.297 1.00 . A A . 9 LYS H3 1 1
7 2332 1 1 1 LYS HA H -9.621 -4.259 2.507 1.00 . A A . 9 LYS HA 1 1
7 2333 1 1 1 LYS HB2 H -9.792 -6.215 0.868 1.00 . A A . 9 LYS HB2 1 1
7 2334 1 1 1 LYS HB3 H -9.441 -6.641 2.544 1.00 . A A . 9 LYS HB3 1 1
7 2335 1 1 1 LYS HD2 H -10.753 -8.407 0.362 1.00 . A A . 9 LYS HD2 1 1
7 2336 1 1 1 LYS HD3 H -10.364 -8.958 1.992 1.00 . A A . 9 LYS HD3 1 1
7 2337 1 1 1 LYS HE2 H -12.617 -9.636 2.405 1.00 . A A . 9 LYS HE2 1 1
7 2338 1 1 1 LYS HE3 H -13.207 -8.790 0.975 1.00 . A A . 9 LYS HE3 1 1
7 2339 1 1 1 LYS HG2 H -11.783 -7.185 2.943 1.00 . A A . 9 LYS HG2 1 1
7 2340 1 1 1 LYS HG3 H -12.214 -6.650 1.318 1.00 . A A . 9 LYS HG3 1 1
7 2341 1 1 1 LYS HZ1 H -12.414 -10.388 -0.418 1.00 . A A . 9 LYS HZ1 1 1
7 2342 1 1 1 LYS HZ2 H -12.752 -11.353 0.938 1.00 . A A . 9 LYS HZ2 1 1
7 2343 1 1 1 LYS HZ3 H -11.159 -10.854 0.623 1.00 . A A . 9 LYS HZ3 1 1
7 2344 1 1 1 LYS N N -11.357 -4.856 3.550 1.00 . A A . 9 LYS N 1 1
7 2345 1 1 1 LYS NZ N -12.160 -10.580 0.571 1.00 . A A . 9 LYS NZ 1 1
7 2346 1 1 1 LYS O O -11.239 -4.483 0.040 1.00 . A A . 9 LYS O 1 1
7 2347 1 1 2 ILE C C -11.968 -1.439 -0.236 1.00 . A A . 10 ILE C 1 1
7 2348 1 1 2 ILE CA C -12.863 -2.328 0.620 1.00 . A A . 10 ILE CA 1 1
7 2349 1 1 2 ILE CB C -13.896 -1.464 1.350 1.00 . A A . 10 ILE CB 1 1
7 2350 1 1 2 ILE CD1 C -15.082 -3.613 1.888 1.00 . A A . 10 ILE CD1 1 1
7 2351 1 1 2 ILE CG1 C -14.570 -2.285 2.456 1.00 . A A . 10 ILE CG1 1 1
7 2352 1 1 2 ILE CG2 C -14.955 -0.978 0.356 1.00 . A A . 10 ILE CG2 1 1
7 2353 1 1 2 ILE H H -12.091 -2.819 2.532 1.00 . A A . 10 ILE H 1 1
7 2354 1 1 2 ILE HA H -13.382 -3.024 -0.021 1.00 . A A . 10 ILE HA 1 1
7 2355 1 1 2 ILE HB H -13.400 -0.609 1.787 1.00 . A A . 10 ILE HB 1 1
7 2356 1 1 2 ILE HD11 H -14.252 -4.290 1.751 1.00 . A A . 10 ILE HD11 1 1
7 2357 1 1 2 ILE HD12 H -15.563 -3.438 0.937 1.00 . A A . 10 ILE HD12 1 1
7 2358 1 1 2 ILE HD13 H -15.792 -4.049 2.575 1.00 . A A . 10 ILE HD13 1 1
7 2359 1 1 2 ILE HG12 H -13.853 -2.483 3.240 1.00 . A A . 10 ILE HG12 1 1
7 2360 1 1 2 ILE HG13 H -15.400 -1.727 2.862 1.00 . A A . 10 ILE HG13 1 1
7 2361 1 1 2 ILE HG21 H -14.475 -0.432 -0.442 1.00 . A A . 10 ILE HG21 1 1
7 2362 1 1 2 ILE HG22 H -15.655 -0.332 0.864 1.00 . A A . 10 ILE HG22 1 1
7 2363 1 1 2 ILE HG23 H -15.481 -1.828 -0.054 1.00 . A A . 10 ILE HG23 1 1
7 2364 1 1 2 ILE N N -12.070 -3.076 1.586 1.00 . A A . 10 ILE N 1 1
7 2365 1 1 2 ILE O O -11.959 -0.217 -0.081 1.00 . A A . 10 ILE O 1 1
7 2366 1 1 3 VAL C C -11.084 -0.699 -3.175 1.00 . A A . 11 VAL C 1 1
7 2367 1 1 3 VAL CA C -10.320 -1.314 -2.018 1.00 . A A . 11 VAL CA 1 1
7 2368 1 1 3 VAL CB C -9.221 -2.228 -2.559 1.00 . A A . 11 VAL CB 1 1
7 2369 1 1 3 VAL CG1 C -9.848 -3.408 -3.306 1.00 . A A . 11 VAL CG1 1 1
7 2370 1 1 3 VAL CG2 C -8.327 -1.438 -3.518 1.00 . A A . 11 VAL CG2 1 1
7 2371 1 1 3 VAL H H -11.266 -3.035 -1.218 1.00 . A A . 11 VAL H 1 1
7 2372 1 1 3 VAL HA H -9.859 -0.516 -1.460 1.00 . A A . 11 VAL HA 1 1
7 2373 1 1 3 VAL HB H -8.629 -2.595 -1.736 1.00 . A A . 11 VAL HB 1 1
7 2374 1 1 3 VAL HG11 H -9.095 -4.162 -3.481 1.00 . A A . 11 VAL HG11 1 1
7 2375 1 1 3 VAL HG12 H -10.242 -3.066 -4.250 1.00 . A A . 11 VAL HG12 1 1
7 2376 1 1 3 VAL HG13 H -10.646 -3.827 -2.712 1.00 . A A . 11 VAL HG13 1 1
7 2377 1 1 3 VAL HG21 H -7.432 -2.005 -3.725 1.00 . A A . 11 VAL HG21 1 1
7 2378 1 1 3 VAL HG22 H -8.059 -0.494 -3.066 1.00 . A A . 11 VAL HG22 1 1
7 2379 1 1 3 VAL HG23 H -8.860 -1.258 -4.440 1.00 . A A . 11 VAL HG23 1 1
7 2380 1 1 3 VAL N N -11.217 -2.059 -1.141 1.00 . A A . 11 VAL N 1 1
7 2381 1 1 3 VAL O O -11.841 -1.373 -3.872 1.00 . A A . 11 VAL O 1 1
7 2382 1 1 4 SER C C -10.749 2.592 -4.755 1.00 . A A . 12 SER C 1 1
7 2383 1 1 4 SER CA C -11.514 1.317 -4.443 1.00 . A A . 12 SER CA 1 1
7 2384 1 1 4 SER CB C -12.948 1.668 -4.070 1.00 . A A . 12 SER CB 1 1
7 2385 1 1 4 SER H H -10.239 1.060 -2.776 1.00 . A A . 12 SER H 1 1
7 2386 1 1 4 SER HA H -11.528 0.696 -5.327 1.00 . A A . 12 SER HA 1 1
7 2387 1 1 4 SER HB2 H -13.350 2.343 -4.807 1.00 . A A . 12 SER HB2 1 1
7 2388 1 1 4 SER HB3 H -13.544 0.766 -4.048 1.00 . A A . 12 SER HB3 1 1
7 2389 1 1 4 SER HG H -12.619 3.187 -2.899 1.00 . A A . 12 SER HG 1 1
7 2390 1 1 4 SER N N -10.863 0.591 -3.367 1.00 . A A . 12 SER N 1 1
7 2391 1 1 4 SER O O -10.561 3.452 -3.895 1.00 . A A . 12 SER O 1 1
7 2392 1 1 4 SER OG O -12.966 2.298 -2.796 1.00 . A A . 12 SER OG 1 1
7 2393 1 1 5 CYS C C -10.505 5.035 -6.690 1.00 . A A . 13 CYS C 1 1
7 2394 1 1 5 CYS CA C -9.567 3.858 -6.449 1.00 . A A . 13 CYS CA 1 1
7 2395 1 1 5 CYS CB C -8.812 3.517 -7.735 1.00 . A A . 13 CYS CB 1 1
7 2396 1 1 5 CYS H H -10.508 1.966 -6.618 1.00 . A A . 13 CYS H 1 1
7 2397 1 1 5 CYS HA H -8.854 4.132 -5.688 1.00 . A A . 13 CYS HA 1 1
7 2398 1 1 5 CYS HB2 H -8.263 2.598 -7.595 1.00 . A A . 13 CYS HB2 1 1
7 2399 1 1 5 CYS HB3 H -9.513 3.395 -8.543 1.00 . A A . 13 CYS HB3 1 1
7 2400 1 1 5 CYS N N -10.317 2.693 -5.995 1.00 . A A . 13 CYS N 1 1
7 2401 1 1 5 CYS O O -11.717 4.857 -6.809 1.00 . A A . 13 CYS O 1 1
7 2402 1 1 5 CYS SG S -7.658 4.852 -8.138 1.00 . A A . 13 CYS SG 1 1
7 2403 1 1 6 ARG C C -10.377 8.088 -8.316 1.00 . A A . 14 ARG C 1 1
7 2404 1 1 6 ARG CA C -10.735 7.453 -6.979 1.00 . A A . 14 ARG CA 1 1
7 2405 1 1 6 ARG CB C -10.481 8.458 -5.851 1.00 . A A . 14 ARG CB 1 1
7 2406 1 1 6 ARG CD C -8.697 9.733 -4.650 1.00 . A A . 14 ARG CD 1 1
7 2407 1 1 6 ARG CG C -9.042 8.974 -5.933 1.00 . A A . 14 ARG CG 1 1
7 2408 1 1 6 ARG CZ C -8.884 9.377 -2.255 1.00 . A A . 14 ARG CZ 1 1
7 2409 1 1 6 ARG H H -8.963 6.318 -6.653 1.00 . A A . 14 ARG H 1 1
7 2410 1 1 6 ARG HA H -11.787 7.201 -6.986 1.00 . A A . 14 ARG HA 1 1
7 2411 1 1 6 ARG HB2 H -11.167 9.286 -5.946 1.00 . A A . 14 ARG HB2 1 1
7 2412 1 1 6 ARG HB3 H -10.632 7.973 -4.898 1.00 . A A . 14 ARG HB3 1 1
7 2413 1 1 6 ARG HD2 H -7.665 10.047 -4.687 1.00 . A A . 14 ARG HD2 1 1
7 2414 1 1 6 ARG HD3 H -9.331 10.604 -4.570 1.00 . A A . 14 ARG HD3 1 1
7 2415 1 1 6 ARG HE H -9.047 7.918 -3.615 1.00 . A A . 14 ARG HE 1 1
7 2416 1 1 6 ARG HG2 H -8.367 8.140 -6.052 1.00 . A A . 14 ARG HG2 1 1
7 2417 1 1 6 ARG HG3 H -8.946 9.639 -6.779 1.00 . A A . 14 ARG HG3 1 1
7 2418 1 1 6 ARG HH11 H -8.547 11.256 -2.858 1.00 . A A . 14 ARG HH11 1 1
7 2419 1 1 6 ARG HH12 H -8.675 11.031 -1.146 1.00 . A A . 14 ARG HH12 1 1
7 2420 1 1 6 ARG HH21 H -9.216 7.613 -1.369 1.00 . A A . 14 ARG HH21 1 1
7 2421 1 1 6 ARG HH22 H -9.055 8.968 -0.303 1.00 . A A . 14 ARG HH22 1 1
7 2422 1 1 6 ARG N N -9.938 6.240 -6.757 1.00 . A A . 14 ARG N 1 1
7 2423 1 1 6 ARG NE N -8.898 8.877 -3.486 1.00 . A A . 14 ARG NE 1 1
7 2424 1 1 6 ARG NH1 N -8.687 10.654 -2.071 1.00 . A A . 14 ARG NH1 1 1
7 2425 1 1 6 ARG NH2 N -9.065 8.591 -1.229 1.00 . A A . 14 ARG NH2 1 1
7 2426 1 1 6 ARG O O -11.065 8.992 -8.791 1.00 . A A . 14 ARG O 1 1
7 2427 1 1 7 ILE C C -9.477 7.361 -11.349 1.00 . A A . 15 ILE C 1 1
7 2428 1 1 7 ILE CA C -8.838 8.136 -10.202 1.00 . A A . 15 ILE CA 1 1
7 2429 1 1 7 ILE CB C -7.316 8.021 -10.299 1.00 . A A . 15 ILE CB 1 1
7 2430 1 1 7 ILE CD1 C -5.216 8.306 -8.965 1.00 . A A . 15 ILE CD1 1 1
7 2431 1 1 7 ILE CG1 C -6.665 8.768 -9.125 1.00 . A A . 15 ILE CG1 1 1
7 2432 1 1 7 ILE CG2 C -6.842 8.632 -11.619 1.00 . A A . 15 ILE CG2 1 1
7 2433 1 1 7 ILE H H -8.784 6.892 -8.487 1.00 . A A . 15 ILE H 1 1
7 2434 1 1 7 ILE HA H -9.115 9.177 -10.282 1.00 . A A . 15 ILE HA 1 1
7 2435 1 1 7 ILE HB H -7.034 6.979 -10.265 1.00 . A A . 15 ILE HB 1 1
7 2436 1 1 7 ILE HD11 H -4.742 8.263 -9.934 1.00 . A A . 15 ILE HD11 1 1
7 2437 1 1 7 ILE HD12 H -5.200 7.325 -8.514 1.00 . A A . 15 ILE HD12 1 1
7 2438 1 1 7 ILE HD13 H -4.683 9.002 -8.333 1.00 . A A . 15 ILE HD13 1 1
7 2439 1 1 7 ILE HG12 H -6.686 9.831 -9.317 1.00 . A A . 15 ILE HG12 1 1
7 2440 1 1 7 ILE HG13 H -7.207 8.558 -8.215 1.00 . A A . 15 ILE HG13 1 1
7 2441 1 1 7 ILE HG21 H -7.338 9.578 -11.778 1.00 . A A . 15 ILE HG21 1 1
7 2442 1 1 7 ILE HG22 H -7.078 7.961 -12.431 1.00 . A A . 15 ILE HG22 1 1
7 2443 1 1 7 ILE HG23 H -5.774 8.789 -11.581 1.00 . A A . 15 ILE HG23 1 1
7 2444 1 1 7 ILE N N -9.292 7.611 -8.917 1.00 . A A . 15 ILE N 1 1
7 2445 1 1 7 ILE O O -9.782 7.926 -12.399 1.00 . A A . 15 ILE O 1 1
7 2446 1 1 8 CYS C C -11.181 4.148 -11.547 1.00 . A A . 16 CYS C 1 1
7 2447 1 1 8 CYS CA C -10.257 5.198 -12.167 1.00 . A A . 16 CYS CA 1 1
7 2448 1 1 8 CYS CB C -9.143 4.506 -12.948 1.00 . A A . 16 CYS CB 1 1
7 2449 1 1 8 CYS H H -9.391 5.666 -10.293 1.00 . A A . 16 CYS H 1 1
7 2450 1 1 8 CYS HA H -10.835 5.802 -12.853 1.00 . A A . 16 CYS HA 1 1
7 2451 1 1 8 CYS HB2 H -9.548 4.073 -13.851 1.00 . A A . 16 CYS HB2 1 1
7 2452 1 1 8 CYS HB3 H -8.385 5.230 -13.202 1.00 . A A . 16 CYS HB3 1 1
7 2453 1 1 8 CYS N N -9.666 6.058 -11.143 1.00 . A A . 16 CYS N 1 1
7 2454 1 1 8 CYS O O -11.922 3.472 -12.261 1.00 . A A . 16 CYS O 1 1
7 2455 1 1 8 CYS SG S -8.408 3.204 -11.929 1.00 . A A . 16 CYS SG 1 1
7 2456 1 1 9 LYS C C -11.680 1.628 -10.021 1.00 . A A . 17 LYS C 1 1
7 2457 1 1 9 LYS CA C -11.988 3.042 -9.539 1.00 . A A . 17 LYS CA 1 1
7 2458 1 1 9 LYS CB C -13.460 3.366 -9.797 1.00 . A A . 17 LYS CB 1 1
7 2459 1 1 9 LYS CD C -15.165 5.191 -9.896 1.00 . A A . 17 LYS CD 1 1
7 2460 1 1 9 LYS CE C -15.497 6.585 -9.360 1.00 . A A . 17 LYS CE 1 1
7 2461 1 1 9 LYS CG C -13.698 4.867 -9.605 1.00 . A A . 17 LYS CG 1 1
7 2462 1 1 9 LYS H H -10.537 4.573 -9.693 1.00 . A A . 17 LYS H 1 1
7 2463 1 1 9 LYS HA H -11.803 3.095 -8.477 1.00 . A A . 17 LYS HA 1 1
7 2464 1 1 9 LYS HB2 H -13.721 3.084 -10.805 1.00 . A A . 17 LYS HB2 1 1
7 2465 1 1 9 LYS HB3 H -14.071 2.818 -9.100 1.00 . A A . 17 LYS HB3 1 1
7 2466 1 1 9 LYS HD2 H -15.333 5.165 -10.962 1.00 . A A . 17 LYS HD2 1 1
7 2467 1 1 9 LYS HD3 H -15.798 4.462 -9.412 1.00 . A A . 17 LYS HD3 1 1
7 2468 1 1 9 LYS HE2 H -16.437 6.916 -9.776 1.00 . A A . 17 LYS HE2 1 1
7 2469 1 1 9 LYS HE3 H -15.573 6.549 -8.283 1.00 . A A . 17 LYS HE3 1 1
7 2470 1 1 9 LYS HG2 H -13.462 5.142 -8.587 1.00 . A A . 17 LYS HG2 1 1
7 2471 1 1 9 LYS HG3 H -13.071 5.424 -10.284 1.00 . A A . 17 LYS HG3 1 1
7 2472 1 1 9 LYS HZ1 H -13.545 7.300 -9.240 1.00 . A A . 17 LYS HZ1 1 1
7 2473 1 1 9 LYS HZ2 H -14.710 8.507 -9.509 1.00 . A A . 17 LYS HZ2 1 1
7 2474 1 1 9 LYS HZ3 H -14.249 7.469 -10.773 1.00 . A A . 17 LYS HZ3 1 1
7 2475 1 1 9 LYS N N -11.141 4.013 -10.221 1.00 . A A . 17 LYS N 1 1
7 2476 1 1 9 LYS NZ N -14.419 7.537 -9.749 1.00 . A A . 17 LYS NZ 1 1
7 2477 1 1 9 LYS O O -12.585 0.819 -10.223 1.00 . A A . 17 LYS O 1 1
7 2478 1 1 10 GLY C C -9.833 -0.947 -9.483 1.00 . A A . 18 GLY C 1 1
7 2479 1 1 10 GLY CA C -9.970 0.017 -10.658 1.00 . A A . 18 GLY CA 1 1
7 2480 1 1 10 GLY H H -9.718 2.023 -10.023 1.00 . A A . 18 GLY H 1 1
7 2481 1 1 10 GLY HA2 H -10.699 -0.372 -11.354 1.00 . A A . 18 GLY HA2 1 1
7 2482 1 1 10 GLY HA3 H -9.015 0.103 -11.154 1.00 . A A . 18 GLY HA3 1 1
7 2483 1 1 10 GLY N N -10.394 1.337 -10.201 1.00 . A A . 18 GLY N 1 1
7 2484 1 1 10 GLY O O -10.742 -1.075 -8.664 1.00 . A A . 18 GLY O 1 1
7 2485 1 1 11 ASP C C -7.138 -2.228 -7.595 1.00 . A A . 19 ASP C 1 1
7 2486 1 1 11 ASP CA C -8.425 -2.585 -8.333 1.00 . A A . 19 ASP CA 1 1
7 2487 1 1 11 ASP CB C -8.305 -3.992 -8.920 1.00 . A A . 19 ASP CB 1 1
7 2488 1 1 11 ASP CG C -7.093 -4.072 -9.843 1.00 . A A . 19 ASP CG 1 1
7 2489 1 1 11 ASP H H -8.002 -1.481 -10.094 1.00 . A A . 19 ASP H 1 1
7 2490 1 1 11 ASP HA H -9.245 -2.574 -7.626 1.00 . A A . 19 ASP HA 1 1
7 2491 1 1 11 ASP HB2 H -8.194 -4.707 -8.119 1.00 . A A . 19 ASP HB2 1 1
7 2492 1 1 11 ASP HB3 H -9.197 -4.219 -9.483 1.00 . A A . 19 ASP HB3 1 1
7 2493 1 1 11 ASP N N -8.687 -1.626 -9.409 1.00 . A A . 19 ASP N 1 1
7 2494 1 1 11 ASP O O -6.142 -2.947 -7.680 1.00 . A A . 19 ASP O 1 1
7 2495 1 1 11 ASP OD1 O -6.464 -3.047 -10.052 1.00 . A A . 19 ASP OD1 1 1
7 2496 1 1 11 ASP OD2 O -6.813 -5.156 -10.328 1.00 . A A . 19 ASP OD2 1 1
7 2497 1 1 12 HIS C C -6.321 0.626 -5.385 1.00 . A A . 20 HIS C 1 1
7 2498 1 1 12 HIS CA C -6.004 -0.672 -6.117 1.00 . A A . 20 HIS CA 1 1
7 2499 1 1 12 HIS CB C -4.812 -0.456 -7.057 1.00 . A A . 20 HIS CB 1 1
7 2500 1 1 12 HIS CD2 C -5.782 1.535 -8.466 1.00 . A A . 20 HIS CD2 1 1
7 2501 1 1 12 HIS CE1 C -5.702 0.607 -10.422 1.00 . A A . 20 HIS CE1 1 1
7 2502 1 1 12 HIS CG C -5.272 0.273 -8.288 1.00 . A A . 20 HIS CG 1 1
7 2503 1 1 12 HIS H H -7.985 -0.583 -6.831 1.00 . A A . 20 HIS H 1 1
7 2504 1 1 12 HIS HA H -5.744 -1.429 -5.392 1.00 . A A . 20 HIS HA 1 1
7 2505 1 1 12 HIS HB2 H -4.059 0.132 -6.555 1.00 . A A . 20 HIS HB2 1 1
7 2506 1 1 12 HIS HB3 H -4.393 -1.409 -7.337 1.00 . A A . 20 HIS HB3 1 1
7 2507 1 1 12 HIS HD2 H -5.947 2.255 -7.679 1.00 . A A . 20 HIS HD2 1 1
7 2508 1 1 12 HIS HE1 H -5.787 0.435 -11.485 1.00 . A A . 20 HIS HE1 1 1
7 2509 1 1 12 HIS N N -7.165 -1.116 -6.868 1.00 . A A . 20 HIS N 1 1
7 2510 1 1 12 HIS ND1 N -5.230 -0.301 -9.548 1.00 . A A . 20 HIS ND1 1 1
7 2511 1 1 12 HIS NE2 N -6.052 1.743 -9.814 1.00 . A A . 20 HIS NE2 1 1
7 2512 1 1 12 HIS O O -7.212 1.375 -5.785 1.00 . A A . 20 HIS O 1 1
7 2513 1 1 13 TRP C C -5.738 3.329 -4.398 1.00 . A A . 21 TRP C 1 1
7 2514 1 1 13 TRP CA C -5.780 2.081 -3.513 1.00 . A A . 21 TRP CA 1 1
7 2515 1 1 13 TRP CB C -4.684 2.165 -2.439 1.00 . A A . 21 TRP CB 1 1
7 2516 1 1 13 TRP CD1 C -5.074 -0.117 -1.414 1.00 . A A . 21 TRP CD1 1 1
7 2517 1 1 13 TRP CD2 C -5.297 1.552 0.078 1.00 . A A . 21 TRP CD2 1 1
7 2518 1 1 13 TRP CE2 C -5.539 0.347 0.778 1.00 . A A . 21 TRP CE2 1 1
7 2519 1 1 13 TRP CE3 C -5.376 2.760 0.792 1.00 . A A . 21 TRP CE3 1 1
7 2520 1 1 13 TRP CG C -5.003 1.231 -1.313 1.00 . A A . 21 TRP CG 1 1
7 2521 1 1 13 TRP CH2 C -5.922 1.551 2.833 1.00 . A A . 21 TRP CH2 1 1
7 2522 1 1 13 TRP CZ2 C -5.847 0.340 2.138 1.00 . A A . 21 TRP CZ2 1 1
7 2523 1 1 13 TRP CZ3 C -5.687 2.758 2.162 1.00 . A A . 21 TRP CZ3 1 1
7 2524 1 1 13 TRP H H -4.900 0.233 -4.054 1.00 . A A . 21 TRP H 1 1
7 2525 1 1 13 TRP HA H -6.745 2.032 -3.030 1.00 . A A . 21 TRP HA 1 1
7 2526 1 1 13 TRP HB2 H -3.736 1.886 -2.874 1.00 . A A . 21 TRP HB2 1 1
7 2527 1 1 13 TRP HB3 H -4.620 3.174 -2.061 1.00 . A A . 21 TRP HB3 1 1
7 2528 1 1 13 TRP HD1 H -4.910 -0.688 -2.316 1.00 . A A . 21 TRP HD1 1 1
7 2529 1 1 13 TRP HE1 H -5.501 -1.596 0.024 1.00 . A A . 21 TRP HE1 1 1
7 2530 1 1 13 TRP HE3 H -5.198 3.697 0.283 1.00 . A A . 21 TRP HE3 1 1
7 2531 1 1 13 TRP HH2 H -6.160 1.556 3.886 1.00 . A A . 21 TRP HH2 1 1
7 2532 1 1 13 TRP HZ2 H -6.027 -0.593 2.652 1.00 . A A . 21 TRP HZ2 1 1
7 2533 1 1 13 TRP HZ3 H -5.745 3.693 2.700 1.00 . A A . 21 TRP HZ3 1 1
7 2534 1 1 13 TRP N N -5.587 0.875 -4.314 1.00 . A A . 21 TRP N 1 1
7 2535 1 1 13 TRP NE1 N -5.390 -0.642 -0.175 1.00 . A A . 21 TRP NE1 1 1
7 2536 1 1 13 TRP O O -6.642 3.569 -5.194 1.00 . A A . 21 TRP O 1 1
7 2537 1 1 14 THR C C -3.046 5.617 -5.277 1.00 . A A . 22 THR C 1 1
7 2538 1 1 14 THR CA C -4.524 5.341 -5.040 1.00 . A A . 22 THR CA 1 1
7 2539 1 1 14 THR CB C -5.158 6.526 -4.306 1.00 . A A . 22 THR CB 1 1
7 2540 1 1 14 THR CG2 C -6.683 6.428 -4.396 1.00 . A A . 22 THR CG2 1 1
7 2541 1 1 14 THR H H -3.987 3.880 -3.602 1.00 . A A . 22 THR H 1 1
7 2542 1 1 14 THR HA H -5.013 5.217 -5.996 1.00 . A A . 22 THR HA 1 1
7 2543 1 1 14 THR HB H -4.836 7.448 -4.763 1.00 . A A . 22 THR HB 1 1
7 2544 1 1 14 THR HG1 H -4.497 7.396 -2.697 1.00 . A A . 22 THR HG1 1 1
7 2545 1 1 14 THR HG21 H -6.979 6.357 -5.432 1.00 . A A . 22 THR HG21 1 1
7 2546 1 1 14 THR HG22 H -7.127 7.307 -3.955 1.00 . A A . 22 THR HG22 1 1
7 2547 1 1 14 THR HG23 H -7.019 5.549 -3.865 1.00 . A A . 22 THR HG23 1 1
7 2548 1 1 14 THR N N -4.679 4.121 -4.252 1.00 . A A . 22 THR N 1 1
7 2549 1 1 14 THR O O -2.638 5.959 -6.386 1.00 . A A . 22 THR O 1 1
7 2550 1 1 14 THR OG1 O -4.760 6.506 -2.943 1.00 . A A . 22 THR OG1 1 1
7 2551 1 1 15 THR C C -0.220 4.646 -5.311 1.00 . A A . 23 THR C 1 1
7 2552 1 1 15 THR CA C -0.812 5.669 -4.349 1.00 . A A . 23 THR CA 1 1
7 2553 1 1 15 THR CB C -0.135 5.544 -2.977 1.00 . A A . 23 THR CB 1 1
7 2554 1 1 15 THR CG2 C -0.893 4.533 -2.118 1.00 . A A . 23 THR CG2 1 1
7 2555 1 1 15 THR H H -2.624 5.165 -3.374 1.00 . A A . 23 THR H 1 1
7 2556 1 1 15 THR HA H -0.640 6.659 -4.738 1.00 . A A . 23 THR HA 1 1
7 2557 1 1 15 THR HB H -0.140 6.503 -2.482 1.00 . A A . 23 THR HB 1 1
7 2558 1 1 15 THR HG1 H 1.773 5.881 -3.139 1.00 . A A . 23 THR HG1 1 1
7 2559 1 1 15 THR HG21 H -0.266 4.217 -1.297 1.00 . A A . 23 THR HG21 1 1
7 2560 1 1 15 THR HG22 H -1.158 3.676 -2.718 1.00 . A A . 23 THR HG22 1 1
7 2561 1 1 15 THR HG23 H -1.789 4.993 -1.729 1.00 . A A . 23 THR HG23 1 1
7 2562 1 1 15 THR N N -2.246 5.451 -4.231 1.00 . A A . 23 THR N 1 1
7 2563 1 1 15 THR O O 0.862 4.849 -5.861 1.00 . A A . 23 THR O 1 1
7 2564 1 1 15 THR OG1 O 1.205 5.107 -3.152 1.00 . A A . 23 THR OG1 1 1
7 2565 1 1 16 ARG C C -1.293 2.518 -7.723 1.00 . A A . 24 ARG C 1 1
7 2566 1 1 16 ARG CA C -0.499 2.479 -6.415 1.00 . A A . 24 ARG CA 1 1
7 2567 1 1 16 ARG CB C -0.671 1.108 -5.736 1.00 . A A . 24 ARG CB 1 1
7 2568 1 1 16 ARG CD C -2.242 -0.282 -4.381 1.00 . A A . 24 ARG CD 1 1
7 2569 1 1 16 ARG CG C -1.883 1.143 -4.803 1.00 . A A . 24 ARG CG 1 1
7 2570 1 1 16 ARG CZ C -1.055 -0.598 -2.284 1.00 . A A . 24 ARG CZ 1 1
7 2571 1 1 16 ARG H H -1.805 3.444 -5.041 1.00 . A A . 24 ARG H 1 1
7 2572 1 1 16 ARG HA H 0.549 2.622 -6.646 1.00 . A A . 24 ARG HA 1 1
7 2573 1 1 16 ARG HB2 H -0.817 0.339 -6.486 1.00 . A A . 24 ARG HB2 1 1
7 2574 1 1 16 ARG HB3 H 0.211 0.878 -5.157 1.00 . A A . 24 ARG HB3 1 1
7 2575 1 1 16 ARG HD2 H -3.149 -0.265 -3.797 1.00 . A A . 24 ARG HD2 1 1
7 2576 1 1 16 ARG HD3 H -2.398 -0.887 -5.263 1.00 . A A . 24 ARG HD3 1 1
7 2577 1 1 16 ARG HE H -0.508 -1.445 -4.012 1.00 . A A . 24 ARG HE 1 1
7 2578 1 1 16 ARG HG2 H -1.645 1.730 -3.928 1.00 . A A . 24 ARG HG2 1 1
7 2579 1 1 16 ARG HG3 H -2.722 1.589 -5.317 1.00 . A A . 24 ARG HG3 1 1
7 2580 1 1 16 ARG HH11 H -2.673 0.578 -2.225 1.00 . A A . 24 ARG HH11 1 1
7 2581 1 1 16 ARG HH12 H -1.842 0.374 -0.720 1.00 . A A . 24 ARG HH12 1 1
7 2582 1 1 16 ARG HH21 H 0.587 -1.719 -2.042 1.00 . A A . 24 ARG HH21 1 1
7 2583 1 1 16 ARG HH22 H 0.004 -0.927 -0.616 1.00 . A A . 24 ARG HH22 1 1
7 2584 1 1 16 ARG N N -0.946 3.544 -5.510 1.00 . A A . 24 ARG N 1 1
7 2585 1 1 16 ARG NE N -1.164 -0.857 -3.582 1.00 . A A . 24 ARG NE 1 1
7 2586 1 1 16 ARG NH1 N -1.924 0.179 -1.697 1.00 . A A . 24 ARG NH1 1 1
7 2587 1 1 16 ARG NH2 N -0.078 -1.122 -1.593 1.00 . A A . 24 ARG NH2 1 1
7 2588 1 1 16 ARG O O -1.051 1.718 -8.625 1.00 . A A . 24 ARG O 1 1
7 2589 1 1 17 CYS C C -2.156 3.937 -10.224 1.00 . A A . 25 CYS C 1 1
7 2590 1 1 17 CYS CA C -3.048 3.566 -9.031 1.00 . A A . 25 CYS CA 1 1
7 2591 1 1 17 CYS CB C -4.126 4.639 -8.843 1.00 . A A . 25 CYS CB 1 1
7 2592 1 1 17 CYS H H -2.393 4.065 -7.075 1.00 . A A . 25 CYS H 1 1
7 2593 1 1 17 CYS HA H -3.527 2.619 -9.209 1.00 . A A . 25 CYS HA 1 1
7 2594 1 1 17 CYS HB2 H -4.874 4.279 -8.153 1.00 . A A . 25 CYS HB2 1 1
7 2595 1 1 17 CYS HB3 H -3.680 5.539 -8.448 1.00 . A A . 25 CYS HB3 1 1
7 2596 1 1 17 CYS N N -2.239 3.450 -7.822 1.00 . A A . 25 CYS N 1 1
7 2597 1 1 17 CYS O O -1.296 4.806 -10.099 1.00 . A A . 25 CYS O 1 1
7 2598 1 1 17 CYS SG S -4.905 5.003 -10.438 1.00 . A A . 25 CYS SG 1 1
7 2599 1 1 18 PRO C C -1.867 4.969 -13.196 1.00 . A A . 26 PRO C 1 1
7 2600 1 1 18 PRO CA C -1.491 3.625 -12.572 1.00 . A A . 26 PRO CA 1 1
7 2601 1 1 18 PRO CB C -1.790 2.461 -13.527 1.00 . A A . 26 PRO CB 1 1
7 2602 1 1 18 PRO CD C -3.314 2.252 -11.665 1.00 . A A . 26 PRO CD 1 1
7 2603 1 1 18 PRO CG C -3.176 2.029 -13.174 1.00 . A A . 26 PRO CG 1 1
7 2604 1 1 18 PRO HA H -0.446 3.618 -12.309 1.00 . A A . 26 PRO HA 1 1
7 2605 1 1 18 PRO HB2 H -1.740 2.789 -14.559 1.00 . A A . 26 PRO HB2 1 1
7 2606 1 1 18 PRO HB3 H -1.096 1.649 -13.358 1.00 . A A . 26 PRO HB3 1 1
7 2607 1 1 18 PRO HD2 H -4.314 2.580 -11.420 1.00 . A A . 26 PRO HD2 1 1
7 2608 1 1 18 PRO HD3 H -3.064 1.353 -11.122 1.00 . A A . 26 PRO HD3 1 1
7 2609 1 1 18 PRO HG2 H -3.899 2.631 -13.712 1.00 . A A . 26 PRO HG2 1 1
7 2610 1 1 18 PRO HG3 H -3.316 0.984 -13.404 1.00 . A A . 26 PRO HG3 1 1
7 2611 1 1 18 PRO N N -2.326 3.312 -11.373 1.00 . A A . 26 PRO N 1 1
7 2612 1 1 18 PRO O O -1.683 5.181 -14.394 1.00 . A A . 26 PRO O 1 1
7 2613 1 1 19 TYR C C -2.670 8.232 -11.740 1.00 . A A . 27 TYR C 1 1
7 2614 1 1 19 TYR CA C -2.796 7.195 -12.853 1.00 . A A . 27 TYR CA 1 1
7 2615 1 1 19 TYR CB C -4.242 7.153 -13.350 1.00 . A A . 27 TYR CB 1 1
7 2616 1 1 19 TYR CD1 C -3.692 6.445 -15.707 1.00 . A A . 27 TYR CD1 1 1
7 2617 1 1 19 TYR CD2 C -5.108 5.004 -14.363 1.00 . A A . 27 TYR CD2 1 1
7 2618 1 1 19 TYR CE1 C -3.791 5.544 -16.774 1.00 . A A . 27 TYR CE1 1 1
7 2619 1 1 19 TYR CE2 C -5.205 4.104 -15.430 1.00 . A A . 27 TYR CE2 1 1
7 2620 1 1 19 TYR CG C -4.351 6.177 -14.501 1.00 . A A . 27 TYR CG 1 1
7 2621 1 1 19 TYR CZ C -4.547 4.374 -16.636 1.00 . A A . 27 TYR CZ 1 1
7 2622 1 1 19 TYR H H -2.521 5.647 -11.428 1.00 . A A . 27 TYR H 1 1
7 2623 1 1 19 TYR HA H -2.155 7.486 -13.673 1.00 . A A . 27 TYR HA 1 1
7 2624 1 1 19 TYR HB2 H -4.890 6.841 -12.545 1.00 . A A . 27 TYR HB2 1 1
7 2625 1 1 19 TYR HB3 H -4.535 8.136 -13.687 1.00 . A A . 27 TYR HB3 1 1
7 2626 1 1 19 TYR HD1 H -3.109 7.347 -15.815 1.00 . A A . 27 TYR HD1 1 1
7 2627 1 1 19 TYR HD2 H -5.616 4.796 -13.434 1.00 . A A . 27 TYR HD2 1 1
7 2628 1 1 19 TYR HE1 H -3.282 5.751 -17.704 1.00 . A A . 27 TYR HE1 1 1
7 2629 1 1 19 TYR HE2 H -5.788 3.201 -15.324 1.00 . A A . 27 TYR HE2 1 1
7 2630 1 1 19 TYR HH H -4.651 3.993 -18.504 1.00 . A A . 27 TYR HH 1 1
7 2631 1 1 19 TYR N N -2.397 5.872 -12.374 1.00 . A A . 27 TYR N 1 1
7 2632 1 1 19 TYR O O -3.450 9.182 -11.675 1.00 . A A . 27 TYR O 1 1
7 2633 1 1 19 TYR OH O -4.642 3.486 -17.688 1.00 . A A . 27 TYR OH 1 1
7 2634 1 1 20 LYS C C -0.876 10.286 -10.279 1.00 . A A . 28 LYS C 1 1
7 2635 1 1 20 LYS CA C -1.469 8.977 -9.766 1.00 . A A . 28 LYS CA 1 1
7 2636 1 1 20 LYS CB C -0.543 8.356 -8.703 1.00 . A A . 28 LYS CB 1 1
7 2637 1 1 20 LYS CD C 1.284 8.352 -10.431 1.00 . A A . 28 LYS CD 1 1
7 2638 1 1 20 LYS CE C 2.581 7.647 -10.831 1.00 . A A . 28 LYS CE 1 1
7 2639 1 1 20 LYS CG C 0.557 7.520 -9.372 1.00 . A A . 28 LYS CG 1 1
7 2640 1 1 20 LYS H H -1.092 7.273 -10.972 1.00 . A A . 28 LYS H 1 1
7 2641 1 1 20 LYS HA H -2.425 9.192 -9.310 1.00 . A A . 28 LYS HA 1 1
7 2642 1 1 20 LYS HB2 H -0.088 9.139 -8.113 1.00 . A A . 28 LYS HB2 1 1
7 2643 1 1 20 LYS HB3 H -1.125 7.717 -8.054 1.00 . A A . 28 LYS HB3 1 1
7 2644 1 1 20 LYS HD2 H 0.652 8.459 -11.300 1.00 . A A . 28 LYS HD2 1 1
7 2645 1 1 20 LYS HD3 H 1.517 9.326 -10.028 1.00 . A A . 28 LYS HD3 1 1
7 2646 1 1 20 LYS HE2 H 3.309 7.758 -10.040 1.00 . A A . 28 LYS HE2 1 1
7 2647 1 1 20 LYS HE3 H 2.386 6.598 -10.996 1.00 . A A . 28 LYS HE3 1 1
7 2648 1 1 20 LYS HG2 H 1.266 7.201 -8.621 1.00 . A A . 28 LYS HG2 1 1
7 2649 1 1 20 LYS HG3 H 0.119 6.654 -9.837 1.00 . A A . 28 LYS HG3 1 1
7 2650 1 1 20 LYS HZ1 H 2.738 7.743 -12.905 1.00 . A A . 28 LYS HZ1 1 1
7 2651 1 1 20 LYS HZ2 H 4.152 8.203 -12.081 1.00 . A A . 28 LYS HZ2 1 1
7 2652 1 1 20 LYS HZ3 H 2.817 9.252 -12.136 1.00 . A A . 28 LYS HZ3 1 1
7 2653 1 1 20 LYS N N -1.683 8.045 -10.869 1.00 . A A . 28 LYS N 1 1
7 2654 1 1 20 LYS NZ N 3.112 8.257 -12.083 1.00 . A A . 28 LYS NZ 1 1
7 2655 1 1 20 LYS O O -0.316 11.071 -9.513 1.00 . A A . 28 LYS O 1 1
7 2656 1 1 21 ASP C C -1.079 12.958 -11.566 1.00 . A A . 29 ASP C 1 1
7 2657 1 1 21 ASP CA C -0.481 11.707 -12.202 1.00 . A A . 29 ASP CA 1 1
7 2658 1 1 21 ASP CB C -0.794 11.646 -13.699 1.00 . A A . 29 ASP CB 1 1
7 2659 1 1 21 ASP CG C -2.219 12.121 -13.987 1.00 . A A . 29 ASP CG 1 1
7 2660 1 1 21 ASP H H -1.450 9.851 -12.143 1.00 . A A . 29 ASP H 1 1
7 2661 1 1 21 ASP HA H 0.584 11.729 -12.067 1.00 . A A . 29 ASP HA 1 1
7 2662 1 1 21 ASP HB2 H -0.099 12.258 -14.229 1.00 . A A . 29 ASP HB2 1 1
7 2663 1 1 21 ASP HB3 H -0.692 10.625 -14.033 1.00 . A A . 29 ASP HB3 1 1
7 2664 1 1 21 ASP N N -1.001 10.509 -11.581 1.00 . A A . 29 ASP N 1 1
7 2665 1 1 21 ASP O O -0.718 14.083 -11.911 1.00 . A A . 29 ASP O 1 1
7 2666 1 1 21 ASP OD1 O -3.140 11.365 -13.724 1.00 . A A . 29 ASP OD1 1 1
7 2667 1 1 21 ASP OD2 O -2.366 13.233 -14.464 1.00 . A A . 29 ASP OD2 1 1
7 2668 1 1 22 THR C C -1.752 14.387 -8.836 1.00 . A A . 30 THR C 1 1
7 2669 1 1 22 THR CA C -2.650 13.840 -9.941 1.00 . A A . 30 THR CA 1 1
7 2670 1 1 22 THR CB C -3.972 13.360 -9.338 1.00 . A A . 30 THR CB 1 1
7 2671 1 1 22 THR CG2 C -4.885 12.842 -10.449 1.00 . A A . 30 THR CG2 1 1
7 2672 1 1 22 THR H H -2.227 11.818 -10.416 1.00 . A A . 30 THR H 1 1
7 2673 1 1 22 THR HA H -2.857 14.630 -10.648 1.00 . A A . 30 THR HA 1 1
7 2674 1 1 22 THR HB H -4.456 14.180 -8.832 1.00 . A A . 30 THR HB 1 1
7 2675 1 1 22 THR HG1 H -4.325 11.599 -8.590 1.00 . A A . 30 THR HG1 1 1
7 2676 1 1 22 THR HG21 H -5.221 13.671 -11.055 1.00 . A A . 30 THR HG21 1 1
7 2677 1 1 22 THR HG22 H -5.739 12.346 -10.012 1.00 . A A . 30 THR HG22 1 1
7 2678 1 1 22 THR HG23 H -4.340 12.143 -11.067 1.00 . A A . 30 THR HG23 1 1
7 2679 1 1 22 THR N N -1.992 12.740 -10.637 1.00 . A A . 30 THR N 1 1
7 2680 1 1 22 THR O O -1.087 15.407 -9.011 1.00 . A A . 30 THR O 1 1
7 2681 1 1 22 THR OG1 O -3.713 12.317 -8.408 1.00 . A A . 30 THR OG1 1 1
7 2682 1 1 23 LEU C C 0.472 14.548 -7.035 1.00 . A A . 31 LEU C 1 1
7 2683 1 1 23 LEU CA C -0.922 14.127 -6.565 1.00 . A A . 31 LEU CA 1 1
7 2684 1 1 23 LEU CB C -0.810 12.986 -5.530 1.00 . A A . 31 LEU CB 1 1
7 2685 1 1 23 LEU CD1 C -1.932 10.972 -6.570 1.00 . A A . 31 LEU CD1 1 1
7 2686 1 1 23 LEU CD2 C -2.341 11.519 -4.163 1.00 . A A . 31 LEU CD2 1 1
7 2687 1 1 23 LEU CG C -2.089 12.116 -5.556 1.00 . A A . 31 LEU CG 1 1
7 2688 1 1 23 LEU H H -2.293 12.897 -7.614 1.00 . A A . 31 LEU H 1 1
7 2689 1 1 23 LEU HA H -1.398 14.976 -6.096 1.00 . A A . 31 LEU HA 1 1
7 2690 1 1 23 LEU HB2 H 0.052 12.370 -5.759 1.00 . A A . 31 LEU HB2 1 1
7 2691 1 1 23 LEU HB3 H -0.685 13.415 -4.545 1.00 . A A . 31 LEU HB3 1 1
7 2692 1 1 23 LEU HD11 H -2.907 10.595 -6.842 1.00 . A A . 31 LEU HD11 1 1
7 2693 1 1 23 LEU HD12 H -1.348 10.174 -6.133 1.00 . A A . 31 LEU HD12 1 1
7 2694 1 1 23 LEU HD13 H -1.430 11.337 -7.454 1.00 . A A . 31 LEU HD13 1 1
7 2695 1 1 23 LEU HD21 H -2.575 12.312 -3.468 1.00 . A A . 31 LEU HD21 1 1
7 2696 1 1 23 LEU HD22 H -1.456 10.997 -3.830 1.00 . A A . 31 LEU HD22 1 1
7 2697 1 1 23 LEU HD23 H -3.170 10.828 -4.212 1.00 . A A . 31 LEU HD23 1 1
7 2698 1 1 23 LEU HG H -2.938 12.726 -5.839 1.00 . A A . 31 LEU HG 1 1
7 2699 1 1 23 LEU N N -1.741 13.701 -7.697 1.00 . A A . 31 LEU N 1 1
7 2700 1 1 23 LEU O O 0.898 15.680 -6.808 1.00 . A A . 31 LEU O 1 1
7 2701 1 1 24 GLY C C 2.455 14.716 -9.483 1.00 . A A . 32 GLY C 1 1
7 2702 1 1 24 GLY CA C 2.514 13.915 -8.188 1.00 . A A . 32 GLY CA 1 1
7 2703 1 1 24 GLY H H 0.782 12.742 -7.843 1.00 . A A . 32 GLY H 1 1
7 2704 1 1 24 GLY HA2 H 3.054 14.481 -7.442 1.00 . A A . 32 GLY HA2 1 1
7 2705 1 1 24 GLY HA3 H 3.030 12.985 -8.372 1.00 . A A . 32 GLY HA3 1 1
7 2706 1 1 24 GLY N N 1.172 13.628 -7.690 1.00 . A A . 32 GLY N 1 1
7 2707 1 1 24 GLY O O 2.407 15.933 -9.402 1.00 . A A . 32 GLY O 1 1
7 2708 1 1 24 GLY OXT O 2.459 14.102 -10.537 1.00 . A A . 32 GLY OXT 1 1
7 2709 2 2 1 ZN ZN ZN -6.924 3.867 -10.395 1.00 . B A . 300 ZN ZN 1 1
8 2710 1 1 1 LYS C C -10.912 -5.133 0.680 1.00 . A A . 9 LYS C 1 1
8 2711 1 1 1 LYS CA C -10.129 -6.261 1.350 1.00 . A A . 9 LYS CA 1 1
8 2712 1 1 1 LYS CB C -11.084 -7.349 1.875 1.00 . A A . 9 LYS CB 1 1
8 2713 1 1 1 LYS CD C -12.333 -5.646 3.230 1.00 . A A . 9 LYS CD 1 1
8 2714 1 1 1 LYS CE C -13.175 -5.482 4.498 1.00 . A A . 9 LYS CE 1 1
8 2715 1 1 1 LYS CG C -11.592 -6.985 3.276 1.00 . A A . 9 LYS CG 1 1
8 2716 1 1 1 LYS H1 H -9.837 -4.902 2.902 1.00 . A A . 9 LYS H1 1 1
8 2717 1 1 1 LYS H2 H -8.407 -5.385 2.125 1.00 . A A . 9 LYS H2 1 1
8 2718 1 1 1 LYS H3 H -9.189 -6.441 3.200 1.00 . A A . 9 LYS H3 1 1
8 2719 1 1 1 LYS HA H -9.455 -6.698 0.626 1.00 . A A . 9 LYS HA 1 1
8 2720 1 1 1 LYS HB2 H -11.926 -7.447 1.203 1.00 . A A . 9 LYS HB2 1 1
8 2721 1 1 1 LYS HB3 H -10.559 -8.292 1.924 1.00 . A A . 9 LYS HB3 1 1
8 2722 1 1 1 LYS HD2 H -11.618 -4.839 3.169 1.00 . A A . 9 LYS HD2 1 1
8 2723 1 1 1 LYS HD3 H -12.979 -5.623 2.367 1.00 . A A . 9 LYS HD3 1 1
8 2724 1 1 1 LYS HE2 H -13.489 -4.453 4.590 1.00 . A A . 9 LYS HE2 1 1
8 2725 1 1 1 LYS HE3 H -14.044 -6.120 4.437 1.00 . A A . 9 LYS HE3 1 1
8 2726 1 1 1 LYS HG2 H -12.267 -7.757 3.620 1.00 . A A . 9 LYS HG2 1 1
8 2727 1 1 1 LYS HG3 H -10.758 -6.911 3.958 1.00 . A A . 9 LYS HG3 1 1
8 2728 1 1 1 LYS HZ1 H -11.760 -5.063 5.966 1.00 . A A . 9 LYS HZ1 1 1
8 2729 1 1 1 LYS HZ2 H -11.766 -6.682 5.451 1.00 . A A . 9 LYS HZ2 1 1
8 2730 1 1 1 LYS HZ3 H -12.993 -6.108 6.475 1.00 . A A . 9 LYS HZ3 1 1
8 2731 1 1 1 LYS N N -9.330 -5.706 2.479 1.00 . A A . 9 LYS N 1 1
8 2732 1 1 1 LYS NZ N -12.362 -5.863 5.687 1.00 . A A . 9 LYS NZ 1 1
8 2733 1 1 1 LYS O O -10.781 -3.967 1.055 1.00 . A A . 9 LYS O 1 1
8 2734 1 1 2 ILE C C -11.760 -3.213 -1.244 1.00 . A A . 10 ILE C 1 1
8 2735 1 1 2 ILE CA C -12.533 -4.517 -1.040 1.00 . A A . 10 ILE CA 1 1
8 2736 1 1 2 ILE CB C -13.823 -4.257 -0.265 1.00 . A A . 10 ILE CB 1 1
8 2737 1 1 2 ILE CD1 C -15.832 -5.384 0.704 1.00 . A A . 10 ILE CD1 1 1
8 2738 1 1 2 ILE CG1 C -14.704 -5.508 -0.322 1.00 . A A . 10 ILE CG1 1 1
8 2739 1 1 2 ILE CG2 C -14.581 -3.072 -0.877 1.00 . A A . 10 ILE CG2 1 1
8 2740 1 1 2 ILE H H -11.789 -6.431 -0.558 1.00 . A A . 10 ILE H 1 1
8 2741 1 1 2 ILE HA H -12.786 -4.927 -2.007 1.00 . A A . 10 ILE HA 1 1
8 2742 1 1 2 ILE HB H -13.576 -4.041 0.760 1.00 . A A . 10 ILE HB 1 1
8 2743 1 1 2 ILE HD11 H -15.412 -5.340 1.698 1.00 . A A . 10 ILE HD11 1 1
8 2744 1 1 2 ILE HD12 H -16.486 -6.240 0.626 1.00 . A A . 10 ILE HD12 1 1
8 2745 1 1 2 ILE HD13 H -16.396 -4.483 0.511 1.00 . A A . 10 ILE HD13 1 1
8 2746 1 1 2 ILE HG12 H -15.125 -5.607 -1.312 1.00 . A A . 10 ILE HG12 1 1
8 2747 1 1 2 ILE HG13 H -14.108 -6.379 -0.095 1.00 . A A . 10 ILE HG13 1 1
8 2748 1 1 2 ILE HG21 H -14.101 -2.149 -0.588 1.00 . A A . 10 ILE HG21 1 1
8 2749 1 1 2 ILE HG22 H -15.602 -3.073 -0.521 1.00 . A A . 10 ILE HG22 1 1
8 2750 1 1 2 ILE HG23 H -14.576 -3.159 -1.953 1.00 . A A . 10 ILE HG23 1 1
8 2751 1 1 2 ILE N N -11.725 -5.492 -0.313 1.00 . A A . 10 ILE N 1 1
8 2752 1 1 2 ILE O O -11.769 -2.333 -0.385 1.00 . A A . 10 ILE O 1 1
8 2753 1 1 3 VAL C C -10.950 -1.127 -3.838 1.00 . A A . 11 VAL C 1 1
8 2754 1 1 3 VAL CA C -10.303 -1.908 -2.711 1.00 . A A . 11 VAL CA 1 1
8 2755 1 1 3 VAL CB C -8.885 -2.307 -3.114 1.00 . A A . 11 VAL CB 1 1
8 2756 1 1 3 VAL CG1 C -8.942 -3.270 -4.303 1.00 . A A . 11 VAL CG1 1 1
8 2757 1 1 3 VAL CG2 C -8.095 -1.057 -3.507 1.00 . A A . 11 VAL CG2 1 1
8 2758 1 1 3 VAL H H -11.118 -3.842 -3.033 1.00 . A A . 11 VAL H 1 1
8 2759 1 1 3 VAL HA H -10.246 -1.265 -1.848 1.00 . A A . 11 VAL HA 1 1
8 2760 1 1 3 VAL HB H -8.402 -2.793 -2.282 1.00 . A A . 11 VAL HB 1 1
8 2761 1 1 3 VAL HG11 H -7.970 -3.717 -4.450 1.00 . A A . 11 VAL HG11 1 1
8 2762 1 1 3 VAL HG12 H -9.227 -2.727 -5.192 1.00 . A A . 11 VAL HG12 1 1
8 2763 1 1 3 VAL HG13 H -9.668 -4.045 -4.105 1.00 . A A . 11 VAL HG13 1 1
8 2764 1 1 3 VAL HG21 H -8.413 -0.720 -4.482 1.00 . A A . 11 VAL HG21 1 1
8 2765 1 1 3 VAL HG22 H -7.041 -1.292 -3.534 1.00 . A A . 11 VAL HG22 1 1
8 2766 1 1 3 VAL HG23 H -8.270 -0.276 -2.782 1.00 . A A . 11 VAL HG23 1 1
8 2767 1 1 3 VAL N N -11.088 -3.104 -2.390 1.00 . A A . 11 VAL N 1 1
8 2768 1 1 3 VAL O O -11.349 -1.690 -4.857 1.00 . A A . 11 VAL O 1 1
8 2769 1 1 4 SER C C -10.735 2.281 -4.853 1.00 . A A . 12 SER C 1 1
8 2770 1 1 4 SER CA C -11.624 1.070 -4.642 1.00 . A A . 12 SER CA 1 1
8 2771 1 1 4 SER CB C -13.006 1.534 -4.204 1.00 . A A . 12 SER CB 1 1
8 2772 1 1 4 SER H H -10.690 0.562 -2.810 1.00 . A A . 12 SER H 1 1
8 2773 1 1 4 SER HA H -11.717 0.544 -5.583 1.00 . A A . 12 SER HA 1 1
8 2774 1 1 4 SER HB2 H -12.912 2.230 -3.389 1.00 . A A . 12 SER HB2 1 1
8 2775 1 1 4 SER HB3 H -13.489 2.023 -5.039 1.00 . A A . 12 SER HB3 1 1
8 2776 1 1 4 SER HG H -14.615 0.440 -4.238 1.00 . A A . 12 SER HG 1 1
8 2777 1 1 4 SER N N -11.037 0.183 -3.643 1.00 . A A . 12 SER N 1 1
8 2778 1 1 4 SER O O -10.470 3.053 -3.931 1.00 . A A . 12 SER O 1 1
8 2779 1 1 4 SER OG O -13.771 0.413 -3.782 1.00 . A A . 12 SER OG 1 1
8 2780 1 1 5 CYS C C -10.217 4.844 -6.492 1.00 . A A . 13 CYS C 1 1
8 2781 1 1 5 CYS CA C -9.417 3.545 -6.447 1.00 . A A . 13 CYS CA 1 1
8 2782 1 1 5 CYS CB C -8.782 3.277 -7.812 1.00 . A A . 13 CYS CB 1 1
8 2783 1 1 5 CYS H H -10.541 1.775 -6.756 1.00 . A A . 13 CYS H 1 1
8 2784 1 1 5 CYS HA H -8.635 3.639 -5.710 1.00 . A A . 13 CYS HA 1 1
8 2785 1 1 5 CYS HB2 H -8.446 2.252 -7.857 1.00 . A A . 13 CYS HB2 1 1
8 2786 1 1 5 CYS HB3 H -9.510 3.451 -8.587 1.00 . A A . 13 CYS HB3 1 1
8 2787 1 1 5 CYS N N -10.282 2.431 -6.081 1.00 . A A . 13 CYS N 1 1
8 2788 1 1 5 CYS O O -11.441 4.824 -6.625 1.00 . A A . 13 CYS O 1 1
8 2789 1 1 5 CYS SG S -7.370 4.382 -8.055 1.00 . A A . 13 CYS SG 1 1
8 2790 1 1 6 ARG C C -9.763 8.075 -7.643 1.00 . A A . 14 ARG C 1 1
8 2791 1 1 6 ARG CA C -10.170 7.291 -6.396 1.00 . A A . 14 ARG CA 1 1
8 2792 1 1 6 ARG CB C -9.781 8.079 -5.129 1.00 . A A . 14 ARG CB 1 1
8 2793 1 1 6 ARG CD C -10.376 10.058 -3.718 1.00 . A A . 14 ARG CD 1 1
8 2794 1 1 6 ARG CG C -10.901 9.054 -4.744 1.00 . A A . 14 ARG CG 1 1
8 2795 1 1 6 ARG CZ C -8.640 11.755 -3.651 1.00 . A A . 14 ARG CZ 1 1
8 2796 1 1 6 ARG H H -8.544 5.926 -6.269 1.00 . A A . 14 ARG H 1 1
8 2797 1 1 6 ARG HA H -11.244 7.158 -6.409 1.00 . A A . 14 ARG HA 1 1
8 2798 1 1 6 ARG HB2 H -9.619 7.385 -4.317 1.00 . A A . 14 ARG HB2 1 1
8 2799 1 1 6 ARG HB3 H -8.869 8.634 -5.307 1.00 . A A . 14 ARG HB3 1 1
8 2800 1 1 6 ARG HD2 H -11.207 10.582 -3.272 1.00 . A A . 14 ARG HD2 1 1
8 2801 1 1 6 ARG HD3 H -9.833 9.529 -2.946 1.00 . A A . 14 ARG HD3 1 1
8 2802 1 1 6 ARG HE H -9.523 11.129 -5.334 1.00 . A A . 14 ARG HE 1 1
8 2803 1 1 6 ARG HG2 H -11.237 9.581 -5.626 1.00 . A A . 14 ARG HG2 1 1
8 2804 1 1 6 ARG HG3 H -11.726 8.503 -4.318 1.00 . A A . 14 ARG HG3 1 1
8 2805 1 1 6 ARG HH11 H -9.185 10.964 -1.894 1.00 . A A . 14 ARG HH11 1 1
8 2806 1 1 6 ARG HH12 H -7.947 12.171 -1.819 1.00 . A A . 14 ARG HH12 1 1
8 2807 1 1 6 ARG HH21 H -7.899 12.715 -5.243 1.00 . A A . 14 ARG HH21 1 1
8 2808 1 1 6 ARG HH22 H -7.219 13.164 -3.715 1.00 . A A . 14 ARG HH22 1 1
8 2809 1 1 6 ARG N N -9.518 5.976 -6.375 1.00 . A A . 14 ARG N 1 1
8 2810 1 1 6 ARG NE N -9.490 11.022 -4.361 1.00 . A A . 14 ARG NE 1 1
8 2811 1 1 6 ARG NH1 N -8.587 11.619 -2.354 1.00 . A A . 14 ARG NH1 1 1
8 2812 1 1 6 ARG NH2 N -7.859 12.611 -4.250 1.00 . A A . 14 ARG NH2 1 1
8 2813 1 1 6 ARG O O -9.850 9.303 -7.670 1.00 . A A . 14 ARG O 1 1
8 2814 1 1 7 ILE C C -9.555 7.296 -11.118 1.00 . A A . 15 ILE C 1 1
8 2815 1 1 7 ILE CA C -8.899 7.988 -9.929 1.00 . A A . 15 ILE CA 1 1
8 2816 1 1 7 ILE CB C -7.379 7.899 -10.071 1.00 . A A . 15 ILE CB 1 1
8 2817 1 1 7 ILE CD1 C -5.233 8.195 -8.826 1.00 . A A . 15 ILE CD1 1 1
8 2818 1 1 7 ILE CG1 C -6.709 8.592 -8.881 1.00 . A A . 15 ILE CG1 1 1
8 2819 1 1 7 ILE CG2 C -6.947 8.587 -11.368 1.00 . A A . 15 ILE CG2 1 1
8 2820 1 1 7 ILE H H -9.274 6.381 -8.592 1.00 . A A . 15 ILE H 1 1
8 2821 1 1 7 ILE HA H -9.189 9.030 -9.928 1.00 . A A . 15 ILE HA 1 1
8 2822 1 1 7 ILE HB H -7.081 6.861 -10.100 1.00 . A A . 15 ILE HB 1 1
8 2823 1 1 7 ILE HD11 H -5.152 7.119 -8.787 1.00 . A A . 15 ILE HD11 1 1
8 2824 1 1 7 ILE HD12 H -4.777 8.624 -7.946 1.00 . A A . 15 ILE HD12 1 1
8 2825 1 1 7 ILE HD13 H -4.729 8.562 -9.708 1.00 . A A . 15 ILE HD13 1 1
8 2826 1 1 7 ILE HG12 H -6.792 9.663 -8.993 1.00 . A A . 15 ILE HG12 1 1
8 2827 1 1 7 ILE HG13 H -7.194 8.287 -7.966 1.00 . A A . 15 ILE HG13 1 1
8 2828 1 1 7 ILE HG21 H -7.266 7.995 -12.213 1.00 . A A . 15 ILE HG21 1 1
8 2829 1 1 7 ILE HG22 H -5.871 8.686 -11.382 1.00 . A A . 15 ILE HG22 1 1
8 2830 1 1 7 ILE HG23 H -7.399 9.567 -11.423 1.00 . A A . 15 ILE HG23 1 1
8 2831 1 1 7 ILE N N -9.320 7.357 -8.675 1.00 . A A . 15 ILE N 1 1
8 2832 1 1 7 ILE O O -9.990 7.949 -12.067 1.00 . A A . 15 ILE O 1 1
8 2833 1 1 8 CYS C C -11.162 4.127 -11.560 1.00 . A A . 16 CYS C 1 1
8 2834 1 1 8 CYS CA C -10.215 5.174 -12.136 1.00 . A A . 16 CYS CA 1 1
8 2835 1 1 8 CYS CB C -9.108 4.486 -12.930 1.00 . A A . 16 CYS CB 1 1
8 2836 1 1 8 CYS H H -9.249 5.505 -10.282 1.00 . A A . 16 CYS H 1 1
8 2837 1 1 8 CYS HA H -10.772 5.822 -12.800 1.00 . A A . 16 CYS HA 1 1
8 2838 1 1 8 CYS HB2 H -9.533 3.994 -13.793 1.00 . A A . 16 CYS HB2 1 1
8 2839 1 1 8 CYS HB3 H -8.390 5.223 -13.252 1.00 . A A . 16 CYS HB3 1 1
8 2840 1 1 8 CYS N N -9.618 5.967 -11.061 1.00 . A A . 16 CYS N 1 1
8 2841 1 1 8 CYS O O -11.880 3.454 -12.299 1.00 . A A . 16 CYS O 1 1
8 2842 1 1 8 CYS SG S -8.283 3.265 -11.880 1.00 . A A . 16 CYS SG 1 1
8 2843 1 1 9 LYS C C -11.775 1.627 -10.100 1.00 . A A . 17 LYS C 1 1
8 2844 1 1 9 LYS CA C -12.026 3.036 -9.572 1.00 . A A . 17 LYS CA 1 1
8 2845 1 1 9 LYS CB C -13.489 3.416 -9.791 1.00 . A A . 17 LYS CB 1 1
8 2846 1 1 9 LYS CD C -15.083 5.345 -9.836 1.00 . A A . 17 LYS CD 1 1
8 2847 1 1 9 LYS CE C -16.210 4.466 -9.283 1.00 . A A . 17 LYS CE 1 1
8 2848 1 1 9 LYS CG C -13.730 4.850 -9.314 1.00 . A A . 17 LYS CG 1 1
8 2849 1 1 9 LYS H H -10.572 4.561 -9.696 1.00 . A A . 17 LYS H 1 1
8 2850 1 1 9 LYS HA H -11.820 3.054 -8.513 1.00 . A A . 17 LYS HA 1 1
8 2851 1 1 9 LYS HB2 H -13.728 3.339 -10.842 1.00 . A A . 17 LYS HB2 1 1
8 2852 1 1 9 LYS HB3 H -14.113 2.745 -9.231 1.00 . A A . 17 LYS HB3 1 1
8 2853 1 1 9 LYS HD2 H -15.237 6.367 -9.521 1.00 . A A . 17 LYS HD2 1 1
8 2854 1 1 9 LYS HD3 H -15.090 5.297 -10.915 1.00 . A A . 17 LYS HD3 1 1
8 2855 1 1 9 LYS HE2 H -16.003 4.213 -8.253 1.00 . A A . 17 LYS HE2 1 1
8 2856 1 1 9 LYS HE3 H -17.144 5.005 -9.337 1.00 . A A . 17 LYS HE3 1 1
8 2857 1 1 9 LYS HG2 H -13.730 4.874 -8.234 1.00 . A A . 17 LYS HG2 1 1
8 2858 1 1 9 LYS HG3 H -12.947 5.493 -9.688 1.00 . A A . 17 LYS HG3 1 1
8 2859 1 1 9 LYS HZ1 H -15.577 3.222 -10.828 1.00 . A A . 17 LYS HZ1 1 1
8 2860 1 1 9 LYS HZ2 H -17.250 3.169 -10.537 1.00 . A A . 17 LYS HZ2 1 1
8 2861 1 1 9 LYS HZ3 H -16.176 2.393 -9.475 1.00 . A A . 17 LYS HZ3 1 1
8 2862 1 1 9 LYS N N -11.161 3.998 -10.237 1.00 . A A . 17 LYS N 1 1
8 2863 1 1 9 LYS NZ N -16.311 3.219 -10.092 1.00 . A A . 17 LYS NZ 1 1
8 2864 1 1 9 LYS O O -12.714 0.868 -10.339 1.00 . A A . 17 LYS O 1 1
8 2865 1 1 10 GLY C C -9.993 -1.032 -9.622 1.00 . A A . 18 GLY C 1 1
8 2866 1 1 10 GLY CA C -10.132 -0.039 -10.772 1.00 . A A . 18 GLY CA 1 1
8 2867 1 1 10 GLY H H -9.796 1.931 -10.065 1.00 . A A . 18 GLY H 1 1
8 2868 1 1 10 GLY HA2 H -10.892 -0.391 -11.458 1.00 . A A . 18 GLY HA2 1 1
8 2869 1 1 10 GLY HA3 H -9.190 0.029 -11.293 1.00 . A A . 18 GLY HA3 1 1
8 2870 1 1 10 GLY N N -10.502 1.284 -10.275 1.00 . A A . 18 GLY N 1 1
8 2871 1 1 10 GLY O O -10.985 -1.443 -9.021 1.00 . A A . 18 GLY O 1 1
8 2872 1 1 11 ASP C C -7.148 -2.024 -7.568 1.00 . A A . 19 ASP C 1 1
8 2873 1 1 11 ASP CA C -8.478 -2.360 -8.245 1.00 . A A . 19 ASP CA 1 1
8 2874 1 1 11 ASP CB C -8.446 -3.788 -8.818 1.00 . A A . 19 ASP CB 1 1
8 2875 1 1 11 ASP CG C -8.858 -4.806 -7.755 1.00 . A A . 19 ASP CG 1 1
8 2876 1 1 11 ASP H H -8.003 -1.052 -9.841 1.00 . A A . 19 ASP H 1 1
8 2877 1 1 11 ASP HA H -9.268 -2.292 -7.507 1.00 . A A . 19 ASP HA 1 1
8 2878 1 1 11 ASP HB2 H -9.134 -3.848 -9.648 1.00 . A A . 19 ASP HB2 1 1
8 2879 1 1 11 ASP HB3 H -7.451 -4.017 -9.169 1.00 . A A . 19 ASP HB3 1 1
8 2880 1 1 11 ASP N N -8.752 -1.412 -9.323 1.00 . A A . 19 ASP N 1 1
8 2881 1 1 11 ASP O O -6.193 -2.800 -7.628 1.00 . A A . 19 ASP O 1 1
8 2882 1 1 11 ASP OD1 O -10.044 -4.909 -7.491 1.00 . A A . 19 ASP OD1 1 1
8 2883 1 1 11 ASP OD2 O -7.980 -5.465 -7.222 1.00 . A A . 19 ASP OD2 1 1
8 2884 1 1 12 HIS C C -6.085 0.980 -5.677 1.00 . A A . 20 HIS C 1 1
8 2885 1 1 12 HIS CA C -5.888 -0.424 -6.241 1.00 . A A . 20 HIS CA 1 1
8 2886 1 1 12 HIS CB C -4.702 -0.433 -7.216 1.00 . A A . 20 HIS CB 1 1
8 2887 1 1 12 HIS CD2 C -5.626 1.251 -9.010 1.00 . A A . 20 HIS CD2 1 1
8 2888 1 1 12 HIS CE1 C -5.658 -0.088 -10.712 1.00 . A A . 20 HIS CE1 1 1
8 2889 1 1 12 HIS CG C -5.166 0.035 -8.568 1.00 . A A . 20 HIS CG 1 1
8 2890 1 1 12 HIS H H -7.887 -0.286 -6.910 1.00 . A A . 20 HIS H 1 1
8 2891 1 1 12 HIS HA H -5.677 -1.104 -5.429 1.00 . A A . 20 HIS HA 1 1
8 2892 1 1 12 HIS HB2 H -3.926 0.225 -6.854 1.00 . A A . 20 HIS HB2 1 1
8 2893 1 1 12 HIS HB3 H -4.310 -1.435 -7.299 1.00 . A A . 20 HIS HB3 1 1
8 2894 1 1 12 HIS HD2 H -5.728 2.136 -8.401 1.00 . A A . 20 HIS HD2 1 1
8 2895 1 1 12 HIS HE1 H -5.788 -0.485 -11.708 1.00 . A A . 20 HIS HE1 1 1
8 2896 1 1 12 HIS N N -7.096 -0.862 -6.925 1.00 . A A . 20 HIS N 1 1
8 2897 1 1 12 HIS ND1 N -5.196 -0.804 -9.670 1.00 . A A . 20 HIS ND1 1 1
8 2898 1 1 12 HIS NE2 N -5.936 1.170 -10.364 1.00 . A A . 20 HIS NE2 1 1
8 2899 1 1 12 HIS O O -6.728 1.825 -6.298 1.00 . A A . 20 HIS O 1 1
8 2900 1 1 13 TRP C C -5.240 3.628 -4.830 1.00 . A A . 21 TRP C 1 1
8 2901 1 1 13 TRP CA C -5.648 2.524 -3.859 1.00 . A A . 21 TRP CA 1 1
8 2902 1 1 13 TRP CB C -4.760 2.583 -2.613 1.00 . A A . 21 TRP CB 1 1
8 2903 1 1 13 TRP CD1 C -5.432 0.393 -1.542 1.00 . A A . 21 TRP CD1 1 1
8 2904 1 1 13 TRP CD2 C -5.969 2.174 -0.277 1.00 . A A . 21 TRP CD2 1 1
8 2905 1 1 13 TRP CE2 C -6.396 1.027 0.434 1.00 . A A . 21 TRP CE2 1 1
8 2906 1 1 13 TRP CE3 C -6.189 3.436 0.304 1.00 . A A . 21 TRP CE3 1 1
8 2907 1 1 13 TRP CG C -5.359 1.743 -1.529 1.00 . A A . 21 TRP CG 1 1
8 2908 1 1 13 TRP CH2 C -7.231 2.389 2.241 1.00 . A A . 21 TRP CH2 1 1
8 2909 1 1 13 TRP CZ2 C -7.020 1.129 1.678 1.00 . A A . 21 TRP CZ2 1 1
8 2910 1 1 13 TRP CZ3 C -6.818 3.541 1.556 1.00 . A A . 21 TRP CZ3 1 1
8 2911 1 1 13 TRP H H -5.030 0.505 -4.051 1.00 . A A . 21 TRP H 1 1
8 2912 1 1 13 TRP HA H -6.676 2.678 -3.566 1.00 . A A . 21 TRP HA 1 1
8 2913 1 1 13 TRP HB2 H -3.777 2.209 -2.855 1.00 . A A . 21 TRP HB2 1 1
8 2914 1 1 13 TRP HB3 H -4.684 3.606 -2.274 1.00 . A A . 21 TRP HB3 1 1
8 2915 1 1 13 TRP HD1 H -5.069 -0.249 -2.332 1.00 . A A . 21 TRP HD1 1 1
8 2916 1 1 13 TRP HE1 H -6.221 -0.968 -0.140 1.00 . A A . 21 TRP HE1 1 1
8 2917 1 1 13 TRP HE3 H -5.873 4.328 -0.215 1.00 . A A . 21 TRP HE3 1 1
8 2918 1 1 13 TRP HH2 H -7.714 2.478 3.204 1.00 . A A . 21 TRP HH2 1 1
8 2919 1 1 13 TRP HZ2 H -7.337 0.239 2.201 1.00 . A A . 21 TRP HZ2 1 1
8 2920 1 1 13 TRP HZ3 H -6.982 4.514 1.994 1.00 . A A . 21 TRP HZ3 1 1
8 2921 1 1 13 TRP N N -5.529 1.218 -4.498 1.00 . A A . 21 TRP N 1 1
8 2922 1 1 13 TRP NE1 N -6.046 -0.034 -0.378 1.00 . A A . 21 TRP NE1 1 1
8 2923 1 1 13 TRP O O -4.937 3.361 -5.992 1.00 . A A . 21 TRP O 1 1
8 2924 1 1 14 THR C C -3.349 6.123 -5.294 1.00 . A A . 22 THR C 1 1
8 2925 1 1 14 THR CA C -4.867 6.003 -5.184 1.00 . A A . 22 THR CA 1 1
8 2926 1 1 14 THR CB C -5.439 7.293 -4.593 1.00 . A A . 22 THR CB 1 1
8 2927 1 1 14 THR CG2 C -6.849 7.033 -4.059 1.00 . A A . 22 THR CG2 1 1
8 2928 1 1 14 THR H H -5.489 5.018 -3.412 1.00 . A A . 22 THR H 1 1
8 2929 1 1 14 THR HA H -5.278 5.861 -6.172 1.00 . A A . 22 THR HA 1 1
8 2930 1 1 14 THR HB H -5.485 8.052 -5.359 1.00 . A A . 22 THR HB 1 1
8 2931 1 1 14 THR HG1 H -5.107 8.357 -2.998 1.00 . A A . 22 THR HG1 1 1
8 2932 1 1 14 THR HG21 H -7.460 6.619 -4.846 1.00 . A A . 22 THR HG21 1 1
8 2933 1 1 14 THR HG22 H -7.281 7.960 -3.716 1.00 . A A . 22 THR HG22 1 1
8 2934 1 1 14 THR HG23 H -6.798 6.334 -3.237 1.00 . A A . 22 THR HG23 1 1
8 2935 1 1 14 THR N N -5.236 4.866 -4.346 1.00 . A A . 22 THR N 1 1
8 2936 1 1 14 THR O O -2.833 6.756 -6.214 1.00 . A A . 22 THR O 1 1
8 2937 1 1 14 THR OG1 O -4.603 7.739 -3.533 1.00 . A A . 22 THR OG1 1 1
8 2938 1 1 15 THR C C -0.607 4.577 -5.361 1.00 . A A . 23 THR C 1 1
8 2939 1 1 15 THR CA C -1.182 5.565 -4.350 1.00 . A A . 23 THR CA 1 1
8 2940 1 1 15 THR CB C -0.647 5.237 -2.954 1.00 . A A . 23 THR CB 1 1
8 2941 1 1 15 THR CG2 C 0.830 5.623 -2.867 1.00 . A A . 23 THR CG2 1 1
8 2942 1 1 15 THR H H -3.105 5.026 -3.637 1.00 . A A . 23 THR H 1 1
8 2943 1 1 15 THR HA H -0.866 6.561 -4.617 1.00 . A A . 23 THR HA 1 1
8 2944 1 1 15 THR HB H -0.751 4.180 -2.768 1.00 . A A . 23 THR HB 1 1
8 2945 1 1 15 THR HG1 H -1.293 5.515 -1.140 1.00 . A A . 23 THR HG1 1 1
8 2946 1 1 15 THR HG21 H 1.380 5.118 -3.646 1.00 . A A . 23 THR HG21 1 1
8 2947 1 1 15 THR HG22 H 1.222 5.332 -1.903 1.00 . A A . 23 THR HG22 1 1
8 2948 1 1 15 THR HG23 H 0.931 6.691 -2.988 1.00 . A A . 23 THR HG23 1 1
8 2949 1 1 15 THR N N -2.640 5.515 -4.349 1.00 . A A . 23 THR N 1 1
8 2950 1 1 15 THR O O 0.262 4.927 -6.158 1.00 . A A . 23 THR O 1 1
8 2951 1 1 15 THR OG1 O -1.387 5.964 -1.984 1.00 . A A . 23 THR OG1 1 1
8 2952 1 1 16 ARG C C -1.461 2.291 -7.513 1.00 . A A . 24 ARG C 1 1
8 2953 1 1 16 ARG CA C -0.626 2.300 -6.233 1.00 . A A . 24 ARG CA 1 1
8 2954 1 1 16 ARG CB C -0.708 0.929 -5.540 1.00 . A A . 24 ARG CB 1 1
8 2955 1 1 16 ARG CD C -2.263 -0.557 -4.261 1.00 . A A . 24 ARG CD 1 1
8 2956 1 1 16 ARG CG C -1.939 0.892 -4.628 1.00 . A A . 24 ARG CG 1 1
8 2957 1 1 16 ARG CZ C -2.697 -2.655 -5.406 1.00 . A A . 24 ARG CZ 1 1
8 2958 1 1 16 ARG H H -1.787 3.121 -4.658 1.00 . A A . 24 ARG H 1 1
8 2959 1 1 16 ARG HA H 0.407 2.496 -6.493 1.00 . A A . 24 ARG HA 1 1
8 2960 1 1 16 ARG HB2 H -0.782 0.144 -6.283 1.00 . A A . 24 ARG HB2 1 1
8 2961 1 1 16 ARG HB3 H 0.180 0.774 -4.942 1.00 . A A . 24 ARG HB3 1 1
8 2962 1 1 16 ARG HD2 H -1.429 -0.986 -3.726 1.00 . A A . 24 ARG HD2 1 1
8 2963 1 1 16 ARG HD3 H -3.139 -0.578 -3.629 1.00 . A A . 24 ARG HD3 1 1
8 2964 1 1 16 ARG HE H -2.549 -0.888 -6.335 1.00 . A A . 24 ARG HE 1 1
8 2965 1 1 16 ARG HG2 H -1.735 1.454 -3.728 1.00 . A A . 24 ARG HG2 1 1
8 2966 1 1 16 ARG HG3 H -2.782 1.329 -5.140 1.00 . A A . 24 ARG HG3 1 1
8 2967 1 1 16 ARG HH11 H -2.482 -2.747 -3.417 1.00 . A A . 24 ARG HH11 1 1
8 2968 1 1 16 ARG HH12 H -2.792 -4.256 -4.208 1.00 . A A . 24 ARG HH12 1 1
8 2969 1 1 16 ARG HH21 H -2.956 -2.864 -7.380 1.00 . A A . 24 ARG HH21 1 1
8 2970 1 1 16 ARG HH22 H -3.060 -4.323 -6.452 1.00 . A A . 24 ARG HH22 1 1
8 2971 1 1 16 ARG N N -1.097 3.339 -5.319 1.00 . A A . 24 ARG N 1 1
8 2972 1 1 16 ARG NE N -2.515 -1.340 -5.466 1.00 . A A . 24 ARG NE 1 1
8 2973 1 1 16 ARG NH1 N -2.654 -3.267 -4.254 1.00 . A A . 24 ARG NH1 1 1
8 2974 1 1 16 ARG NH2 N -2.921 -3.333 -6.497 1.00 . A A . 24 ARG NH2 1 1
8 2975 1 1 16 ARG O O -1.548 1.273 -8.200 1.00 . A A . 24 ARG O 1 1
8 2976 1 1 17 CYS C C -2.021 3.870 -10.250 1.00 . A A . 25 CYS C 1 1
8 2977 1 1 17 CYS CA C -2.897 3.538 -9.033 1.00 . A A . 25 CYS CA 1 1
8 2978 1 1 17 CYS CB C -3.944 4.638 -8.841 1.00 . A A . 25 CYS CB 1 1
8 2979 1 1 17 CYS H H -1.967 4.211 -7.248 1.00 . A A . 25 CYS H 1 1
8 2980 1 1 17 CYS HA H -3.404 2.601 -9.187 1.00 . A A . 25 CYS HA 1 1
8 2981 1 1 17 CYS HB2 H -4.688 4.303 -8.135 1.00 . A A . 25 CYS HB2 1 1
8 2982 1 1 17 CYS HB3 H -3.465 5.527 -8.461 1.00 . A A . 25 CYS HB3 1 1
8 2983 1 1 17 CYS N N -2.073 3.430 -7.830 1.00 . A A . 25 CYS N 1 1
8 2984 1 1 17 CYS O O -1.136 4.720 -10.153 1.00 . A A . 25 CYS O 1 1
8 2985 1 1 17 CYS SG S -4.740 5.010 -10.425 1.00 . A A . 25 CYS SG 1 1
8 2986 1 1 18 PRO C C -1.786 4.857 -13.245 1.00 . A A . 26 PRO C 1 1
8 2987 1 1 18 PRO CA C -1.423 3.514 -12.611 1.00 . A A . 26 PRO CA 1 1
8 2988 1 1 18 PRO CB C -1.768 2.344 -13.541 1.00 . A A . 26 PRO CB 1 1
8 2989 1 1 18 PRO CD C -3.255 2.199 -11.643 1.00 . A A . 26 PRO CD 1 1
8 2990 1 1 18 PRO CG C -3.156 1.950 -13.150 1.00 . A A . 26 PRO CG 1 1
8 2991 1 1 18 PRO HA H -0.371 3.489 -12.373 1.00 . A A . 26 PRO HA 1 1
8 2992 1 1 18 PRO HB2 H -1.736 2.657 -14.578 1.00 . A A . 26 PRO HB2 1 1
8 2993 1 1 18 PRO HB3 H -1.090 1.519 -13.377 1.00 . A A . 26 PRO HB3 1 1
8 2994 1 1 18 PRO HD2 H -4.242 2.557 -11.381 1.00 . A A . 26 PRO HD2 1 1
8 2995 1 1 18 PRO HD3 H -3.017 1.301 -11.092 1.00 . A A . 26 PRO HD3 1 1
8 2996 1 1 18 PRO HG2 H -3.877 2.559 -13.681 1.00 . A A . 26 PRO HG2 1 1
8 2997 1 1 18 PRO HG3 H -3.325 0.904 -13.361 1.00 . A A . 26 PRO HG3 1 1
8 2998 1 1 18 PRO N N -2.234 3.237 -11.386 1.00 . A A . 26 PRO N 1 1
8 2999 1 1 18 PRO O O -1.552 5.077 -14.433 1.00 . A A . 26 PRO O 1 1
8 3000 1 1 19 TYR C C -2.677 8.099 -11.800 1.00 . A A . 27 TYR C 1 1
8 3001 1 1 19 TYR CA C -2.753 7.073 -12.927 1.00 . A A . 27 TYR CA 1 1
8 3002 1 1 19 TYR CB C -4.181 7.024 -13.476 1.00 . A A . 27 TYR CB 1 1
8 3003 1 1 19 TYR CD1 C -3.540 6.259 -15.791 1.00 . A A . 27 TYR CD1 1 1
8 3004 1 1 19 TYR CD2 C -5.031 4.865 -14.478 1.00 . A A . 27 TYR CD2 1 1
8 3005 1 1 19 TYR CE1 C -3.605 5.336 -16.842 1.00 . A A . 27 TYR CE1 1 1
8 3006 1 1 19 TYR CE2 C -5.094 3.943 -15.530 1.00 . A A . 27 TYR CE2 1 1
8 3007 1 1 19 TYR CG C -4.253 6.025 -14.608 1.00 . A A . 27 TYR CG 1 1
8 3008 1 1 19 TYR CZ C -4.381 4.178 -16.712 1.00 . A A . 27 TYR CZ 1 1
8 3009 1 1 19 TYR H H -2.520 5.518 -11.502 1.00 . A A . 27 TYR H 1 1
8 3010 1 1 19 TYR HA H -2.084 7.375 -13.720 1.00 . A A . 27 TYR HA 1 1
8 3011 1 1 19 TYR HB2 H -4.860 6.732 -12.688 1.00 . A A . 27 TYR HB2 1 1
8 3012 1 1 19 TYR HB3 H -4.458 8.002 -13.843 1.00 . A A . 27 TYR HB3 1 1
8 3013 1 1 19 TYR HD1 H -2.942 7.151 -15.893 1.00 . A A . 27 TYR HD1 1 1
8 3014 1 1 19 TYR HD2 H -5.581 4.683 -13.567 1.00 . A A . 27 TYR HD2 1 1
8 3015 1 1 19 TYR HE1 H -3.055 5.517 -17.753 1.00 . A A . 27 TYR HE1 1 1
8 3016 1 1 19 TYR HE2 H -5.693 3.050 -15.429 1.00 . A A . 27 TYR HE2 1 1
8 3017 1 1 19 TYR HH H -4.336 3.750 -18.571 1.00 . A A . 27 TYR HH 1 1
8 3018 1 1 19 TYR N N -2.359 5.751 -12.440 1.00 . A A . 27 TYR N 1 1
8 3019 1 1 19 TYR O O -3.528 8.980 -11.692 1.00 . A A . 27 TYR O 1 1
8 3020 1 1 19 TYR OH O -4.444 3.269 -17.747 1.00 . A A . 27 TYR OH 1 1
8 3021 1 1 20 LYS C C -0.944 10.242 -10.348 1.00 . A A . 28 LYS C 1 1
8 3022 1 1 20 LYS CA C -1.472 8.900 -9.850 1.00 . A A . 28 LYS CA 1 1
8 3023 1 1 20 LYS CB C -0.508 8.304 -8.807 1.00 . A A . 28 LYS CB 1 1
8 3024 1 1 20 LYS CD C 1.300 8.403 -10.552 1.00 . A A . 28 LYS CD 1 1
8 3025 1 1 20 LYS CE C 2.623 7.759 -10.975 1.00 . A A . 28 LYS CE 1 1
8 3026 1 1 20 LYS CG C 0.617 7.524 -9.500 1.00 . A A . 28 LYS CG 1 1
8 3027 1 1 20 LYS H H -1.004 7.255 -11.104 1.00 . A A . 28 LYS H 1 1
8 3028 1 1 20 LYS HA H -2.431 9.063 -9.384 1.00 . A A . 28 LYS HA 1 1
8 3029 1 1 20 LYS HB2 H -0.079 9.098 -8.212 1.00 . A A . 28 LYS HB2 1 1
8 3030 1 1 20 LYS HB3 H -1.055 7.634 -8.160 1.00 . A A . 28 LYS HB3 1 1
8 3031 1 1 20 LYS HD2 H 0.657 8.501 -11.414 1.00 . A A . 28 LYS HD2 1 1
8 3032 1 1 20 LYS HD3 H 1.497 9.379 -10.135 1.00 . A A . 28 LYS HD3 1 1
8 3033 1 1 20 LYS HE2 H 3.295 7.731 -10.131 1.00 . A A . 28 LYS HE2 1 1
8 3034 1 1 20 LYS HE3 H 2.438 6.754 -11.322 1.00 . A A . 28 LYS HE3 1 1
8 3035 1 1 20 LYS HG2 H 1.346 7.221 -8.763 1.00 . A A . 28 LYS HG2 1 1
8 3036 1 1 20 LYS HG3 H 0.208 6.648 -9.977 1.00 . A A . 28 LYS HG3 1 1
8 3037 1 1 20 LYS HZ1 H 3.625 7.919 -12.793 1.00 . A A . 28 LYS HZ1 1 1
8 3038 1 1 20 LYS HZ2 H 3.999 9.150 -11.684 1.00 . A A . 28 LYS HZ2 1 1
8 3039 1 1 20 LYS HZ3 H 2.512 9.167 -12.506 1.00 . A A . 28 LYS HZ3 1 1
8 3040 1 1 20 LYS N N -1.650 7.976 -10.966 1.00 . A A . 28 LYS N 1 1
8 3041 1 1 20 LYS NZ N 3.236 8.559 -12.072 1.00 . A A . 28 LYS NZ 1 1
8 3042 1 1 20 LYS O O -0.410 11.038 -9.576 1.00 . A A . 28 LYS O 1 1
8 3043 1 1 21 ASP C C -1.273 12.921 -11.578 1.00 . A A . 29 ASP C 1 1
8 3044 1 1 21 ASP CA C -0.637 11.710 -12.251 1.00 . A A . 29 ASP CA 1 1
8 3045 1 1 21 ASP CB C -0.978 11.665 -13.742 1.00 . A A . 29 ASP CB 1 1
8 3046 1 1 21 ASP CG C -2.433 12.065 -13.987 1.00 . A A . 29 ASP CG 1 1
8 3047 1 1 21 ASP H H -1.521 9.811 -12.211 1.00 . A A . 29 ASP H 1 1
8 3048 1 1 21 ASP HA H 0.428 11.774 -12.136 1.00 . A A . 29 ASP HA 1 1
8 3049 1 1 21 ASP HB2 H -0.331 12.328 -14.271 1.00 . A A . 29 ASP HB2 1 1
8 3050 1 1 21 ASP HB3 H -0.826 10.660 -14.103 1.00 . A A . 29 ASP HB3 1 1
8 3051 1 1 21 ASP N N -1.095 10.479 -11.644 1.00 . A A . 29 ASP N 1 1
8 3052 1 1 21 ASP O O -0.953 14.067 -11.895 1.00 . A A . 29 ASP O 1 1
8 3053 1 1 21 ASP OD1 O -3.294 11.212 -13.848 1.00 . A A . 29 ASP OD1 1 1
8 3054 1 1 21 ASP OD2 O -2.663 13.219 -14.312 1.00 . A A . 29 ASP OD2 1 1
8 3055 1 1 22 THR C C -1.996 14.226 -8.780 1.00 . A A . 30 THR C 1 1
8 3056 1 1 22 THR CA C -2.865 13.706 -9.922 1.00 . A A . 30 THR CA 1 1
8 3057 1 1 22 THR CB C -4.185 13.175 -9.358 1.00 . A A . 30 THR CB 1 1
8 3058 1 1 22 THR CG2 C -5.013 12.561 -10.488 1.00 . A A . 30 THR CG2 1 1
8 3059 1 1 22 THR H H -2.373 11.712 -10.454 1.00 . A A . 30 THR H 1 1
8 3060 1 1 22 THR HA H -3.078 14.520 -10.598 1.00 . A A . 30 THR HA 1 1
8 3061 1 1 22 THR HB H -4.738 13.985 -8.911 1.00 . A A . 30 THR HB 1 1
8 3062 1 1 22 THR HG1 H -4.525 12.316 -7.648 1.00 . A A . 30 THR HG1 1 1
8 3063 1 1 22 THR HG21 H -4.498 11.698 -10.884 1.00 . A A . 30 THR HG21 1 1
8 3064 1 1 22 THR HG22 H -5.148 13.291 -11.272 1.00 . A A . 30 THR HG22 1 1
8 3065 1 1 22 THR HG23 H -5.977 12.262 -10.105 1.00 . A A . 30 THR HG23 1 1
8 3066 1 1 22 THR N N -2.173 12.648 -10.652 1.00 . A A . 30 THR N 1 1
8 3067 1 1 22 THR O O -2.247 15.301 -8.237 1.00 . A A . 30 THR O 1 1
8 3068 1 1 22 THR OG1 O -3.913 12.186 -8.376 1.00 . A A . 30 THR OG1 1 1
8 3069 1 1 23 LEU C C -0.840 14.017 -6.039 1.00 . A A . 31 LEU C 1 1
8 3070 1 1 23 LEU CA C -0.071 13.843 -7.345 1.00 . A A . 31 LEU CA 1 1
8 3071 1 1 23 LEU CB C 0.642 15.154 -7.704 1.00 . A A . 31 LEU CB 1 1
8 3072 1 1 23 LEU CD1 C 3.063 14.659 -7.165 1.00 . A A . 31 LEU CD1 1 1
8 3073 1 1 23 LEU CD2 C 2.116 16.917 -6.684 1.00 . A A . 31 LEU CD2 1 1
8 3074 1 1 23 LEU CG C 1.803 15.416 -6.721 1.00 . A A . 31 LEU CG 1 1
8 3075 1 1 23 LEU H H -0.824 12.608 -8.894 1.00 . A A . 31 LEU H 1 1
8 3076 1 1 23 LEU HA H 0.667 13.068 -7.214 1.00 . A A . 31 LEU HA 1 1
8 3077 1 1 23 LEU HB2 H 1.024 15.088 -8.713 1.00 . A A . 31 LEU HB2 1 1
8 3078 1 1 23 LEU HB3 H -0.068 15.967 -7.646 1.00 . A A . 31 LEU HB3 1 1
8 3079 1 1 23 LEU HD11 H 2.908 13.598 -7.051 1.00 . A A . 31 LEU HD11 1 1
8 3080 1 1 23 LEU HD12 H 3.898 14.966 -6.553 1.00 . A A . 31 LEU HD12 1 1
8 3081 1 1 23 LEU HD13 H 3.276 14.885 -8.199 1.00 . A A . 31 LEU HD13 1 1
8 3082 1 1 23 LEU HD21 H 3.030 17.081 -6.131 1.00 . A A . 31 LEU HD21 1 1
8 3083 1 1 23 LEU HD22 H 1.304 17.442 -6.202 1.00 . A A . 31 LEU HD22 1 1
8 3084 1 1 23 LEU HD23 H 2.236 17.285 -7.692 1.00 . A A . 31 LEU HD23 1 1
8 3085 1 1 23 LEU HG H 1.521 15.088 -5.730 1.00 . A A . 31 LEU HG 1 1
8 3086 1 1 23 LEU N N -0.974 13.455 -8.423 1.00 . A A . 31 LEU N 1 1
8 3087 1 1 23 LEU O O -0.781 13.163 -5.154 1.00 . A A . 31 LEU O 1 1
8 3088 1 1 24 GLY C C -1.426 15.795 -3.562 1.00 . A A . 32 GLY C 1 1
8 3089 1 1 24 GLY CA C -2.337 15.401 -4.720 1.00 . A A . 32 GLY CA 1 1
8 3090 1 1 24 GLY H H -1.572 15.775 -6.660 1.00 . A A . 32 GLY H 1 1
8 3091 1 1 24 GLY HA2 H -3.029 16.207 -4.920 1.00 . A A . 32 GLY HA2 1 1
8 3092 1 1 24 GLY HA3 H -2.892 14.517 -4.446 1.00 . A A . 32 GLY HA3 1 1
8 3093 1 1 24 GLY N N -1.561 15.128 -5.923 1.00 . A A . 32 GLY N 1 1
8 3094 1 1 24 GLY O O -0.571 16.640 -3.769 1.00 . A A . 32 GLY O 1 1
8 3095 1 1 24 GLY OXT O -1.597 15.245 -2.487 1.00 . A A . 32 GLY OXT 1 1
8 3096 2 2 1 ZN ZN ZN -6.637 3.426 -10.308 1.00 . B A . 300 ZN ZN 1 1
9 3097 1 1 1 LYS C C -12.917 -5.041 1.278 1.00 . A A . 9 LYS C 1 1
9 3098 1 1 1 LYS CA C -12.839 -5.034 2.800 1.00 . A A . 9 LYS CA 1 1
9 3099 1 1 1 LYS CB C -13.516 -3.779 3.354 1.00 . A A . 9 LYS CB 1 1
9 3100 1 1 1 LYS CD C -14.289 -2.631 5.435 1.00 . A A . 9 LYS CD 1 1
9 3101 1 1 1 LYS CE C -14.820 -2.887 6.848 1.00 . A A . 9 LYS CE 1 1
9 3102 1 1 1 LYS CG C -13.711 -3.928 4.864 1.00 . A A . 9 LYS CG 1 1
9 3103 1 1 1 LYS H1 H -10.809 -5.268 2.401 1.00 . A A . 9 LYS H1 1 1
9 3104 1 1 1 LYS H2 H -11.274 -5.780 3.953 1.00 . A A . 9 LYS H2 1 1
9 3105 1 1 1 LYS H3 H -11.149 -4.121 3.604 1.00 . A A . 9 LYS H3 1 1
9 3106 1 1 1 LYS HA H -13.337 -5.911 3.188 1.00 . A A . 9 LYS HA 1 1
9 3107 1 1 1 LYS HB2 H -12.895 -2.917 3.154 1.00 . A A . 9 LYS HB2 1 1
9 3108 1 1 1 LYS HB3 H -14.476 -3.648 2.880 1.00 . A A . 9 LYS HB3 1 1
9 3109 1 1 1 LYS HD2 H -13.515 -1.878 5.472 1.00 . A A . 9 LYS HD2 1 1
9 3110 1 1 1 LYS HD3 H -15.097 -2.289 4.807 1.00 . A A . 9 LYS HD3 1 1
9 3111 1 1 1 LYS HE2 H -15.279 -1.987 7.228 1.00 . A A . 9 LYS HE2 1 1
9 3112 1 1 1 LYS HE3 H -15.551 -3.681 6.819 1.00 . A A . 9 LYS HE3 1 1
9 3113 1 1 1 LYS HG2 H -14.392 -4.744 5.060 1.00 . A A . 9 LYS HG2 1 1
9 3114 1 1 1 LYS HG3 H -12.760 -4.133 5.332 1.00 . A A . 9 LYS HG3 1 1
9 3115 1 1 1 LYS HZ1 H -13.773 -2.780 8.645 1.00 . A A . 9 LYS HZ1 1 1
9 3116 1 1 1 LYS HZ2 H -12.789 -3.036 7.283 1.00 . A A . 9 LYS HZ2 1 1
9 3117 1 1 1 LYS HZ3 H -13.727 -4.308 7.908 1.00 . A A . 9 LYS HZ3 1 1
9 3118 1 1 1 LYS N N -11.410 -5.052 3.221 1.00 . A A . 9 LYS N 1 1
9 3119 1 1 1 LYS NZ N -13.692 -3.283 7.739 1.00 . A A . 9 LYS NZ 1 1
9 3120 1 1 1 LYS O O -12.942 -6.102 0.652 1.00 . A A . 9 LYS O 1 1
9 3121 1 1 2 ILE C C -12.201 -2.530 -1.240 1.00 . A A . 10 ILE C 1 1
9 3122 1 1 2 ILE CA C -13.036 -3.717 -0.769 1.00 . A A . 10 ILE CA 1 1
9 3123 1 1 2 ILE CB C -14.502 -3.538 -1.186 1.00 . A A . 10 ILE CB 1 1
9 3124 1 1 2 ILE CD1 C -14.369 -5.200 -3.096 1.00 . A A . 10 ILE CD1 1 1
9 3125 1 1 2 ILE CG1 C -14.641 -3.737 -2.706 1.00 . A A . 10 ILE CG1 1 1
9 3126 1 1 2 ILE CG2 C -14.995 -2.132 -0.804 1.00 . A A . 10 ILE CG2 1 1
9 3127 1 1 2 ILE H H -12.939 -3.042 1.232 1.00 . A A . 10 ILE H 1 1
9 3128 1 1 2 ILE HA H -12.650 -4.615 -1.229 1.00 . A A . 10 ILE HA 1 1
9 3129 1 1 2 ILE HB H -15.103 -4.269 -0.668 1.00 . A A . 10 ILE HB 1 1
9 3130 1 1 2 ILE HD11 H -13.323 -5.319 -3.340 1.00 . A A . 10 ILE HD11 1 1
9 3131 1 1 2 ILE HD12 H -14.967 -5.456 -3.959 1.00 . A A . 10 ILE HD12 1 1
9 3132 1 1 2 ILE HD13 H -14.625 -5.859 -2.278 1.00 . A A . 10 ILE HD13 1 1
9 3133 1 1 2 ILE HG12 H -15.642 -3.467 -3.009 1.00 . A A . 10 ILE HG12 1 1
9 3134 1 1 2 ILE HG13 H -13.933 -3.097 -3.213 1.00 . A A . 10 ILE HG13 1 1
9 3135 1 1 2 ILE HG21 H -16.072 -2.138 -0.733 1.00 . A A . 10 ILE HG21 1 1
9 3136 1 1 2 ILE HG22 H -14.690 -1.420 -1.558 1.00 . A A . 10 ILE HG22 1 1
9 3137 1 1 2 ILE HG23 H -14.575 -1.846 0.151 1.00 . A A . 10 ILE HG23 1 1
9 3138 1 1 2 ILE N N -12.958 -3.849 0.684 1.00 . A A . 10 ILE N 1 1
9 3139 1 1 2 ILE O O -12.459 -1.384 -0.867 1.00 . A A . 10 ILE O 1 1
9 3140 1 1 3 VAL C C -10.965 -1.047 -3.737 1.00 . A A . 11 VAL C 1 1
9 3141 1 1 3 VAL CA C -10.317 -1.768 -2.571 1.00 . A A . 11 VAL CA 1 1
9 3142 1 1 3 VAL CB C -8.983 -2.366 -3.018 1.00 . A A . 11 VAL CB 1 1
9 3143 1 1 3 VAL CG1 C -9.230 -3.433 -4.086 1.00 . A A . 11 VAL CG1 1 1
9 3144 1 1 3 VAL CG2 C -8.099 -1.260 -3.600 1.00 . A A . 11 VAL CG2 1 1
9 3145 1 1 3 VAL H H -11.033 -3.746 -2.309 1.00 . A A . 11 VAL H 1 1
9 3146 1 1 3 VAL HA H -10.127 -1.046 -1.793 1.00 . A A . 11 VAL HA 1 1
9 3147 1 1 3 VAL HB H -8.490 -2.812 -2.169 1.00 . A A . 11 VAL HB 1 1
9 3148 1 1 3 VAL HG11 H -9.558 -2.959 -4.999 1.00 . A A . 11 VAL HG11 1 1
9 3149 1 1 3 VAL HG12 H -9.991 -4.118 -3.742 1.00 . A A . 11 VAL HG12 1 1
9 3150 1 1 3 VAL HG13 H -8.315 -3.975 -4.270 1.00 . A A . 11 VAL HG13 1 1
9 3151 1 1 3 VAL HG21 H -7.084 -1.618 -3.683 1.00 . A A . 11 VAL HG21 1 1
9 3152 1 1 3 VAL HG22 H -8.125 -0.398 -2.951 1.00 . A A . 11 VAL HG22 1 1
9 3153 1 1 3 VAL HG23 H -8.464 -0.984 -4.579 1.00 . A A . 11 VAL HG23 1 1
9 3154 1 1 3 VAL N N -11.193 -2.814 -2.054 1.00 . A A . 11 VAL N 1 1
9 3155 1 1 3 VAL O O -11.502 -1.668 -4.654 1.00 . A A . 11 VAL O 1 1
9 3156 1 1 4 SER C C -10.627 2.361 -4.927 1.00 . A A . 12 SER C 1 1
9 3157 1 1 4 SER CA C -11.462 1.108 -4.742 1.00 . A A . 12 SER CA 1 1
9 3158 1 1 4 SER CB C -12.895 1.502 -4.411 1.00 . A A . 12 SER CB 1 1
9 3159 1 1 4 SER H H -10.445 0.703 -2.933 1.00 . A A . 12 SER H 1 1
9 3160 1 1 4 SER HA H -11.462 0.555 -5.673 1.00 . A A . 12 SER HA 1 1
9 3161 1 1 4 SER HB2 H -13.228 2.244 -5.116 1.00 . A A . 12 SER HB2 1 1
9 3162 1 1 4 SER HB3 H -13.531 0.630 -4.479 1.00 . A A . 12 SER HB3 1 1
9 3163 1 1 4 SER HG H -12.061 2.345 -2.868 1.00 . A A . 12 SER HG 1 1
9 3164 1 1 4 SER N N -10.897 0.276 -3.691 1.00 . A A . 12 SER N 1 1
9 3165 1 1 4 SER O O -10.462 3.163 -4.008 1.00 . A A . 12 SER O 1 1
9 3166 1 1 4 SER OG O -12.943 2.043 -3.098 1.00 . A A . 12 SER OG 1 1
9 3167 1 1 5 CYS C C -10.112 4.940 -6.433 1.00 . A A . 13 CYS C 1 1
9 3168 1 1 5 CYS CA C -9.281 3.662 -6.465 1.00 . A A . 13 CYS CA 1 1
9 3169 1 1 5 CYS CB C -8.675 3.468 -7.855 1.00 . A A . 13 CYS CB 1 1
9 3170 1 1 5 CYS H H -10.288 1.829 -6.801 1.00 . A A . 13 CYS H 1 1
9 3171 1 1 5 CYS HA H -8.482 3.744 -5.744 1.00 . A A . 13 CYS HA 1 1
9 3172 1 1 5 CYS HB2 H -8.314 2.456 -7.952 1.00 . A A . 13 CYS HB2 1 1
9 3173 1 1 5 CYS HB3 H -9.427 3.651 -8.603 1.00 . A A . 13 CYS HB3 1 1
9 3174 1 1 5 CYS N N -10.107 2.511 -6.127 1.00 . A A . 13 CYS N 1 1
9 3175 1 1 5 CYS O O -11.342 4.888 -6.408 1.00 . A A . 13 CYS O 1 1
9 3176 1 1 5 CYS SG S -7.302 4.621 -8.088 1.00 . A A . 13 CYS SG 1 1
9 3177 1 1 6 ARG C C -9.744 8.225 -7.620 1.00 . A A . 14 ARG C 1 1
9 3178 1 1 6 ARG CA C -10.118 7.392 -6.394 1.00 . A A . 14 ARG CA 1 1
9 3179 1 1 6 ARG CB C -9.732 8.146 -5.106 1.00 . A A . 14 ARG CB 1 1
9 3180 1 1 6 ARG CD C -10.361 10.050 -3.611 1.00 . A A . 14 ARG CD 1 1
9 3181 1 1 6 ARG CG C -10.872 9.077 -4.674 1.00 . A A . 14 ARG CG 1 1
9 3182 1 1 6 ARG CZ C -12.423 10.448 -2.390 1.00 . A A . 14 ARG CZ 1 1
9 3183 1 1 6 ARG H H -8.453 6.068 -6.447 1.00 . A A . 14 ARG H 1 1
9 3184 1 1 6 ARG HA H -11.189 7.232 -6.402 1.00 . A A . 14 ARG HA 1 1
9 3185 1 1 6 ARG HB2 H -9.543 7.429 -4.321 1.00 . A A . 14 ARG HB2 1 1
9 3186 1 1 6 ARG HB3 H -8.838 8.729 -5.277 1.00 . A A . 14 ARG HB3 1 1
9 3187 1 1 6 ARG HD2 H -9.977 9.492 -2.771 1.00 . A A . 14 ARG HD2 1 1
9 3188 1 1 6 ARG HD3 H -9.569 10.653 -4.030 1.00 . A A . 14 ARG HD3 1 1
9 3189 1 1 6 ARG HE H -11.447 11.860 -3.421 1.00 . A A . 14 ARG HE 1 1
9 3190 1 1 6 ARG HG2 H -11.227 9.631 -5.531 1.00 . A A . 14 ARG HG2 1 1
9 3191 1 1 6 ARG HG3 H -11.680 8.490 -4.264 1.00 . A A . 14 ARG HG3 1 1
9 3192 1 1 6 ARG HH11 H -11.695 8.584 -2.335 1.00 . A A . 14 ARG HH11 1 1
9 3193 1 1 6 ARG HH12 H -13.166 8.841 -1.457 1.00 . A A . 14 ARG HH12 1 1
9 3194 1 1 6 ARG HH21 H -13.375 12.205 -2.270 1.00 . A A . 14 ARG HH21 1 1
9 3195 1 1 6 ARG HH22 H -14.117 10.891 -1.420 1.00 . A A . 14 ARG HH22 1 1
9 3196 1 1 6 ARG N N -9.433 6.091 -6.429 1.00 . A A . 14 ARG N 1 1
9 3197 1 1 6 ARG NE N -11.443 10.916 -3.157 1.00 . A A . 14 ARG NE 1 1
9 3198 1 1 6 ARG NH1 N -12.429 9.193 -2.033 1.00 . A A . 14 ARG NH1 1 1
9 3199 1 1 6 ARG NH2 N -13.380 11.244 -1.997 1.00 . A A . 14 ARG NH2 1 1
9 3200 1 1 6 ARG O O -9.667 9.451 -7.549 1.00 . A A . 14 ARG O 1 1
9 3201 1 1 7 ILE C C -9.758 7.492 -11.177 1.00 . A A . 15 ILE C 1 1
9 3202 1 1 7 ILE CA C -9.147 8.223 -9.987 1.00 . A A . 15 ILE CA 1 1
9 3203 1 1 7 ILE CB C -7.622 8.251 -10.137 1.00 . A A . 15 ILE CB 1 1
9 3204 1 1 7 ILE CD1 C -5.460 8.658 -8.962 1.00 . A A . 15 ILE CD1 1 1
9 3205 1 1 7 ILE CG1 C -6.977 8.592 -8.791 1.00 . A A . 15 ILE CG1 1 1
9 3206 1 1 7 ILE CG2 C -7.224 9.306 -11.172 1.00 . A A . 15 ILE CG2 1 1
9 3207 1 1 7 ILE H H -9.592 6.570 -8.734 1.00 . A A . 15 ILE H 1 1
9 3208 1 1 7 ILE HA H -9.520 9.237 -9.968 1.00 . A A . 15 ILE HA 1 1
9 3209 1 1 7 ILE HB H -7.273 7.281 -10.465 1.00 . A A . 15 ILE HB 1 1
9 3210 1 1 7 ILE HD11 H -4.991 8.713 -7.991 1.00 . A A . 15 ILE HD11 1 1
9 3211 1 1 7 ILE HD12 H -5.200 9.534 -9.537 1.00 . A A . 15 ILE HD12 1 1
9 3212 1 1 7 ILE HD13 H -5.119 7.773 -9.477 1.00 . A A . 15 ILE HD13 1 1
9 3213 1 1 7 ILE HG12 H -7.345 9.547 -8.446 1.00 . A A . 15 ILE HG12 1 1
9 3214 1 1 7 ILE HG13 H -7.220 7.828 -8.069 1.00 . A A . 15 ILE HG13 1 1
9 3215 1 1 7 ILE HG21 H -6.193 9.161 -11.458 1.00 . A A . 15 ILE HG21 1 1
9 3216 1 1 7 ILE HG22 H -7.343 10.291 -10.746 1.00 . A A . 15 ILE HG22 1 1
9 3217 1 1 7 ILE HG23 H -7.857 9.212 -12.043 1.00 . A A . 15 ILE HG23 1 1
9 3218 1 1 7 ILE N N -9.514 7.546 -8.741 1.00 . A A . 15 ILE N 1 1
9 3219 1 1 7 ILE O O -10.261 8.114 -12.113 1.00 . A A . 15 ILE O 1 1
9 3220 1 1 8 CYS C C -11.184 4.280 -11.615 1.00 . A A . 16 CYS C 1 1
9 3221 1 1 8 CYS CA C -10.239 5.324 -12.196 1.00 . A A . 16 CYS CA 1 1
9 3222 1 1 8 CYS CB C -9.088 4.629 -12.923 1.00 . A A . 16 CYS CB 1 1
9 3223 1 1 8 CYS H H -9.283 5.734 -10.357 1.00 . A A . 16 CYS H 1 1
9 3224 1 1 8 CYS HA H -10.783 5.933 -12.906 1.00 . A A . 16 CYS HA 1 1
9 3225 1 1 8 CYS HB2 H -9.475 4.058 -13.754 1.00 . A A . 16 CYS HB2 1 1
9 3226 1 1 8 CYS HB3 H -8.396 5.372 -13.287 1.00 . A A . 16 CYS HB3 1 1
9 3227 1 1 8 CYS N N -9.701 6.163 -11.130 1.00 . A A . 16 CYS N 1 1
9 3228 1 1 8 CYS O O -11.992 3.689 -12.332 1.00 . A A . 16 CYS O 1 1
9 3229 1 1 8 CYS SG S -8.233 3.524 -11.774 1.00 . A A . 16 CYS SG 1 1
9 3230 1 1 9 LYS C C -11.730 1.701 -10.205 1.00 . A A . 17 LYS C 1 1
9 3231 1 1 9 LYS CA C -11.938 3.098 -9.630 1.00 . A A . 17 LYS CA 1 1
9 3232 1 1 9 LYS CB C -13.401 3.509 -9.782 1.00 . A A . 17 LYS CB 1 1
9 3233 1 1 9 LYS CD C -15.012 5.416 -9.630 1.00 . A A . 17 LYS CD 1 1
9 3234 1 1 9 LYS CE C -15.229 6.784 -8.977 1.00 . A A . 17 LYS CE 1 1
9 3235 1 1 9 LYS CG C -13.546 5.005 -9.484 1.00 . A A . 17 LYS CG 1 1
9 3236 1 1 9 LYS H H -10.425 4.567 -9.781 1.00 . A A . 17 LYS H 1 1
9 3237 1 1 9 LYS HA H -11.691 3.083 -8.580 1.00 . A A . 17 LYS HA 1 1
9 3238 1 1 9 LYS HB2 H -13.730 3.307 -10.791 1.00 . A A . 17 LYS HB2 1 1
9 3239 1 1 9 LYS HB3 H -14.002 2.949 -9.087 1.00 . A A . 17 LYS HB3 1 1
9 3240 1 1 9 LYS HD2 H -15.265 5.474 -10.679 1.00 . A A . 17 LYS HD2 1 1
9 3241 1 1 9 LYS HD3 H -15.642 4.684 -9.147 1.00 . A A . 17 LYS HD3 1 1
9 3242 1 1 9 LYS HE2 H -14.446 7.459 -9.288 1.00 . A A . 17 LYS HE2 1 1
9 3243 1 1 9 LYS HE3 H -16.187 7.179 -9.281 1.00 . A A . 17 LYS HE3 1 1
9 3244 1 1 9 LYS HG2 H -13.213 5.204 -8.475 1.00 . A A . 17 LYS HG2 1 1
9 3245 1 1 9 LYS HG3 H -12.946 5.571 -10.179 1.00 . A A . 17 LYS HG3 1 1
9 3246 1 1 9 LYS HZ1 H -15.540 5.689 -7.233 1.00 . A A . 17 LYS HZ1 1 1
9 3247 1 1 9 LYS HZ2 H -15.812 7.358 -7.062 1.00 . A A . 17 LYS HZ2 1 1
9 3248 1 1 9 LYS HZ3 H -14.225 6.757 -7.153 1.00 . A A . 17 LYS HZ3 1 1
9 3249 1 1 9 LYS N N -11.083 4.064 -10.305 1.00 . A A . 17 LYS N 1 1
9 3250 1 1 9 LYS NZ N -15.199 6.636 -7.494 1.00 . A A . 17 LYS NZ 1 1
9 3251 1 1 9 LYS O O -12.614 1.149 -10.859 1.00 . A A . 17 LYS O 1 1
9 3252 1 1 10 GLY C C -9.974 -1.159 -9.277 1.00 . A A . 18 GLY C 1 1
9 3253 1 1 10 GLY CA C -10.214 -0.205 -10.441 1.00 . A A . 18 GLY CA 1 1
9 3254 1 1 10 GLY H H -9.888 1.629 -9.424 1.00 . A A . 18 GLY H 1 1
9 3255 1 1 10 GLY HA2 H -11.022 -0.587 -11.054 1.00 . A A . 18 GLY HA2 1 1
9 3256 1 1 10 GLY HA3 H -9.316 -0.147 -11.037 1.00 . A A . 18 GLY HA3 1 1
9 3257 1 1 10 GLY N N -10.550 1.135 -9.953 1.00 . A A . 18 GLY N 1 1
9 3258 1 1 10 GLY O O -10.844 -1.347 -8.426 1.00 . A A . 18 GLY O 1 1
9 3259 1 1 11 ASP C C -7.107 -2.297 -7.533 1.00 . A A . 19 ASP C 1 1
9 3260 1 1 11 ASP CA C -8.425 -2.707 -8.185 1.00 . A A . 19 ASP CA 1 1
9 3261 1 1 11 ASP CB C -8.292 -4.115 -8.769 1.00 . A A . 19 ASP CB 1 1
9 3262 1 1 11 ASP CG C -7.095 -4.180 -9.712 1.00 . A A . 19 ASP CG 1 1
9 3263 1 1 11 ASP H H -8.138 -1.575 -9.956 1.00 . A A . 19 ASP H 1 1
9 3264 1 1 11 ASP HA H -9.199 -2.718 -7.428 1.00 . A A . 19 ASP HA 1 1
9 3265 1 1 11 ASP HB2 H -8.157 -4.825 -7.967 1.00 . A A . 19 ASP HB2 1 1
9 3266 1 1 11 ASP HB3 H -9.190 -4.358 -9.318 1.00 . A A . 19 ASP HB3 1 1
9 3267 1 1 11 ASP N N -8.787 -1.765 -9.247 1.00 . A A . 19 ASP N 1 1
9 3268 1 1 11 ASP O O -6.131 -3.046 -7.558 1.00 . A A . 19 ASP O 1 1
9 3269 1 1 11 ASP OD1 O -7.064 -3.406 -10.655 1.00 . A A . 19 ASP OD1 1 1
9 3270 1 1 11 ASP OD2 O -6.224 -5.003 -9.476 1.00 . A A . 19 ASP OD2 1 1
9 3271 1 1 12 HIS C C -6.153 0.790 -5.717 1.00 . A A . 20 HIS C 1 1
9 3272 1 1 12 HIS CA C -5.892 -0.598 -6.293 1.00 . A A . 20 HIS CA 1 1
9 3273 1 1 12 HIS CB C -4.730 -0.533 -7.290 1.00 . A A . 20 HIS CB 1 1
9 3274 1 1 12 HIS CD2 C -5.636 1.292 -8.955 1.00 . A A . 20 HIS CD2 1 1
9 3275 1 1 12 HIS CE1 C -5.765 0.059 -10.732 1.00 . A A . 20 HIS CE1 1 1
9 3276 1 1 12 HIS CG C -5.217 0.033 -8.597 1.00 . A A . 20 HIS CG 1 1
9 3277 1 1 12 HIS H H -7.896 -0.550 -6.957 1.00 . A A . 20 HIS H 1 1
9 3278 1 1 12 HIS HA H -5.624 -1.267 -5.489 1.00 . A A . 20 HIS HA 1 1
9 3279 1 1 12 HIS HB2 H -3.948 0.097 -6.895 1.00 . A A . 20 HIS HB2 1 1
9 3280 1 1 12 HIS HB3 H -4.339 -1.527 -7.454 1.00 . A A . 20 HIS HB3 1 1
9 3281 1 1 12 HIS HD2 H -5.689 2.143 -8.292 1.00 . A A . 20 HIS HD2 1 1
9 3282 1 1 12 HIS HE1 H -5.935 -0.270 -11.746 1.00 . A A . 20 HIS HE1 1 1
9 3283 1 1 12 HIS N N -7.089 -1.102 -6.949 1.00 . A A . 20 HIS N 1 1
9 3284 1 1 12 HIS ND1 N -5.308 -0.736 -9.746 1.00 . A A . 20 HIS ND1 1 1
9 3285 1 1 12 HIS NE2 N -5.982 1.306 -10.302 1.00 . A A . 20 HIS NE2 1 1
9 3286 1 1 12 HIS O O -6.842 1.607 -6.324 1.00 . A A . 20 HIS O 1 1
9 3287 1 1 13 TRP C C -5.366 3.469 -4.842 1.00 . A A . 21 TRP C 1 1
9 3288 1 1 13 TRP CA C -5.771 2.342 -3.893 1.00 . A A . 21 TRP CA 1 1
9 3289 1 1 13 TRP CB C -4.923 2.411 -2.619 1.00 . A A . 21 TRP CB 1 1
9 3290 1 1 13 TRP CD1 C -5.254 0.269 -1.317 1.00 . A A . 21 TRP CD1 1 1
9 3291 1 1 13 TRP CD2 C -6.560 1.943 -0.574 1.00 . A A . 21 TRP CD2 1 1
9 3292 1 1 13 TRP CE2 C -6.845 0.818 0.234 1.00 . A A . 21 TRP CE2 1 1
9 3293 1 1 13 TRP CE3 C -7.253 3.139 -0.313 1.00 . A A . 21 TRP CE3 1 1
9 3294 1 1 13 TRP CG C -5.546 1.568 -1.551 1.00 . A A . 21 TRP CG 1 1
9 3295 1 1 13 TRP CH2 C -8.462 2.072 1.511 1.00 . A A . 21 TRP CH2 1 1
9 3296 1 1 13 TRP CZ2 C -7.783 0.875 1.265 1.00 . A A . 21 TRP CZ2 1 1
9 3297 1 1 13 TRP CZ3 C -8.199 3.202 0.723 1.00 . A A . 21 TRP CZ3 1 1
9 3298 1 1 13 TRP H H -5.056 0.357 -4.106 1.00 . A A . 21 TRP H 1 1
9 3299 1 1 13 TRP HA H -6.812 2.463 -3.631 1.00 . A A . 21 TRP HA 1 1
9 3300 1 1 13 TRP HB2 H -3.929 2.046 -2.830 1.00 . A A . 21 TRP HB2 1 1
9 3301 1 1 13 TRP HB3 H -4.866 3.436 -2.280 1.00 . A A . 21 TRP HB3 1 1
9 3302 1 1 13 TRP HD1 H -4.538 -0.323 -1.866 1.00 . A A . 21 TRP HD1 1 1
9 3303 1 1 13 TRP HE1 H -6.002 -1.085 0.114 1.00 . A A . 21 TRP HE1 1 1
9 3304 1 1 13 TRP HE3 H -7.057 4.014 -0.915 1.00 . A A . 21 TRP HE3 1 1
9 3305 1 1 13 TRP HH2 H -9.191 2.126 2.307 1.00 . A A . 21 TRP HH2 1 1
9 3306 1 1 13 TRP HZ2 H -7.983 0.003 1.869 1.00 . A A . 21 TRP HZ2 1 1
9 3307 1 1 13 TRP HZ3 H -8.725 4.125 0.915 1.00 . A A . 21 TRP HZ3 1 1
9 3308 1 1 13 TRP N N -5.595 1.047 -4.543 1.00 . A A . 21 TRP N 1 1
9 3309 1 1 13 TRP NE1 N -6.024 -0.178 -0.257 1.00 . A A . 21 TRP NE1 1 1
9 3310 1 1 13 TRP O O -5.149 3.242 -6.032 1.00 . A A . 21 TRP O 1 1
9 3311 1 1 14 THR C C -3.376 5.928 -5.257 1.00 . A A . 22 THR C 1 1
9 3312 1 1 14 THR CA C -4.893 5.839 -5.114 1.00 . A A . 22 THR CA 1 1
9 3313 1 1 14 THR CB C -5.421 7.119 -4.464 1.00 . A A . 22 THR CB 1 1
9 3314 1 1 14 THR CG2 C -6.923 6.986 -4.219 1.00 . A A . 22 THR CG2 1 1
9 3315 1 1 14 THR H H -5.456 4.803 -3.351 1.00 . A A . 22 THR H 1 1
9 3316 1 1 14 THR HA H -5.332 5.742 -6.096 1.00 . A A . 22 THR HA 1 1
9 3317 1 1 14 THR HB H -5.240 7.957 -5.120 1.00 . A A . 22 THR HB 1 1
9 3318 1 1 14 THR HG1 H -3.907 7.745 -3.414 1.00 . A A . 22 THR HG1 1 1
9 3319 1 1 14 THR HG21 H -7.290 7.878 -3.734 1.00 . A A . 22 THR HG21 1 1
9 3320 1 1 14 THR HG22 H -7.110 6.130 -3.587 1.00 . A A . 22 THR HG22 1 1
9 3321 1 1 14 THR HG23 H -7.432 6.854 -5.163 1.00 . A A . 22 THR HG23 1 1
9 3322 1 1 14 THR N N -5.269 4.682 -4.306 1.00 . A A . 22 THR N 1 1
9 3323 1 1 14 THR O O -2.865 6.378 -6.281 1.00 . A A . 22 THR O 1 1
9 3324 1 1 14 THR OG1 O -4.753 7.331 -3.228 1.00 . A A . 22 THR OG1 1 1
9 3325 1 1 15 THR C C -0.651 4.580 -5.287 1.00 . A A . 23 THR C 1 1
9 3326 1 1 15 THR CA C -1.205 5.543 -4.241 1.00 . A A . 23 THR CA 1 1
9 3327 1 1 15 THR CB C -0.653 5.174 -2.863 1.00 . A A . 23 THR CB 1 1
9 3328 1 1 15 THR CG2 C 0.858 5.402 -2.838 1.00 . A A . 23 THR CG2 1 1
9 3329 1 1 15 THR H H -3.123 5.156 -3.427 1.00 . A A . 23 THR H 1 1
9 3330 1 1 15 THR HA H -0.886 6.544 -4.484 1.00 . A A . 23 THR HA 1 1
9 3331 1 1 15 THR HB H -0.859 4.136 -2.660 1.00 . A A . 23 THR HB 1 1
9 3332 1 1 15 THR HG1 H -1.536 5.415 -1.146 1.00 . A A . 23 THR HG1 1 1
9 3333 1 1 15 THR HG21 H 1.343 4.680 -3.477 1.00 . A A . 23 THR HG21 1 1
9 3334 1 1 15 THR HG22 H 1.222 5.291 -1.827 1.00 . A A . 23 THR HG22 1 1
9 3335 1 1 15 THR HG23 H 1.078 6.399 -3.191 1.00 . A A . 23 THR HG23 1 1
9 3336 1 1 15 THR N N -2.663 5.502 -4.221 1.00 . A A . 23 THR N 1 1
9 3337 1 1 15 THR O O 0.223 4.941 -6.075 1.00 . A A . 23 THR O 1 1
9 3338 1 1 15 THR OG1 O -1.275 5.983 -1.874 1.00 . A A . 23 THR OG1 1 1
9 3339 1 1 16 ARG C C -1.551 2.388 -7.517 1.00 . A A . 24 ARG C 1 1
9 3340 1 1 16 ARG CA C -0.713 2.337 -6.238 1.00 . A A . 24 ARG CA 1 1
9 3341 1 1 16 ARG CB C -0.823 0.945 -5.596 1.00 . A A . 24 ARG CB 1 1
9 3342 1 1 16 ARG CD C -2.429 -0.575 -4.420 1.00 . A A . 24 ARG CD 1 1
9 3343 1 1 16 ARG CG C -2.076 0.885 -4.716 1.00 . A A . 24 ARG CG 1 1
9 3344 1 1 16 ARG CZ C -1.249 -2.522 -3.576 1.00 . A A . 24 ARG CZ 1 1
9 3345 1 1 16 ARG H H -1.857 3.122 -4.634 1.00 . A A . 24 ARG H 1 1
9 3346 1 1 16 ARG HA H 0.322 2.522 -6.492 1.00 . A A . 24 ARG HA 1 1
9 3347 1 1 16 ARG HB2 H -0.883 0.188 -6.369 1.00 . A A . 24 ARG HB2 1 1
9 3348 1 1 16 ARG HB3 H 0.049 0.763 -4.984 1.00 . A A . 24 ARG HB3 1 1
9 3349 1 1 16 ARG HD2 H -3.356 -0.613 -3.869 1.00 . A A . 24 ARG HD2 1 1
9 3350 1 1 16 ARG HD3 H -2.547 -1.110 -5.352 1.00 . A A . 24 ARG HD3 1 1
9 3351 1 1 16 ARG HE H -0.748 -0.636 -3.130 1.00 . A A . 24 ARG HE 1 1
9 3352 1 1 16 ARG HG2 H -1.886 1.404 -3.788 1.00 . A A . 24 ARG HG2 1 1
9 3353 1 1 16 ARG HG3 H -2.902 1.356 -5.229 1.00 . A A . 24 ARG HG3 1 1
9 3354 1 1 16 ARG HH11 H -2.805 -2.872 -4.786 1.00 . A A . 24 ARG HH11 1 1
9 3355 1 1 16 ARG HH12 H -1.981 -4.278 -4.199 1.00 . A A . 24 ARG HH12 1 1
9 3356 1 1 16 ARG HH21 H 0.336 -2.475 -2.354 1.00 . A A . 24 ARG HH21 1 1
9 3357 1 1 16 ARG HH22 H -0.204 -4.053 -2.821 1.00 . A A . 24 ARG HH22 1 1
9 3358 1 1 16 ARG N N -1.164 3.352 -5.287 1.00 . A A . 24 ARG N 1 1
9 3359 1 1 16 ARG NE N -1.375 -1.200 -3.630 1.00 . A A . 24 ARG NE 1 1
9 3360 1 1 16 ARG NH1 N -2.076 -3.283 -4.238 1.00 . A A . 24 ARG NH1 1 1
9 3361 1 1 16 ARG NH2 N -0.298 -3.059 -2.861 1.00 . A A . 24 ARG NH2 1 1
9 3362 1 1 16 ARG O O -1.676 1.391 -8.228 1.00 . A A . 24 ARG O 1 1
9 3363 1 1 17 CYS C C -2.044 3.932 -10.232 1.00 . A A . 25 CYS C 1 1
9 3364 1 1 17 CYS CA C -2.939 3.718 -9.004 1.00 . A A . 25 CYS CA 1 1
9 3365 1 1 17 CYS CB C -3.865 4.926 -8.840 1.00 . A A . 25 CYS CB 1 1
9 3366 1 1 17 CYS H H -1.987 4.319 -7.206 1.00 . A A . 25 CYS H 1 1
9 3367 1 1 17 CYS HA H -3.539 2.834 -9.132 1.00 . A A . 25 CYS HA 1 1
9 3368 1 1 17 CYS HB2 H -4.617 4.703 -8.100 1.00 . A A . 25 CYS HB2 1 1
9 3369 1 1 17 CYS HB3 H -3.288 5.780 -8.521 1.00 . A A . 25 CYS HB3 1 1
9 3370 1 1 17 CYS N N -2.120 3.556 -7.806 1.00 . A A . 25 CYS N 1 1
9 3371 1 1 17 CYS O O -1.085 4.699 -10.163 1.00 . A A . 25 CYS O 1 1
9 3372 1 1 17 CYS SG S -4.663 5.296 -10.423 1.00 . A A . 25 CYS SG 1 1
9 3373 1 1 18 PRO C C -1.748 4.822 -13.242 1.00 . A A . 26 PRO C 1 1
9 3374 1 1 18 PRO CA C -1.497 3.467 -12.581 1.00 . A A . 26 PRO CA 1 1
9 3375 1 1 18 PRO CB C -1.948 2.310 -13.480 1.00 . A A . 26 PRO CB 1 1
9 3376 1 1 18 PRO CD C -3.433 2.344 -11.575 1.00 . A A . 26 PRO CD 1 1
9 3377 1 1 18 PRO CG C -3.362 2.048 -13.076 1.00 . A A . 26 PRO CG 1 1
9 3378 1 1 18 PRO HA H -0.450 3.357 -12.346 1.00 . A A . 26 PRO HA 1 1
9 3379 1 1 18 PRO HB2 H -1.894 2.595 -14.525 1.00 . A A . 26 PRO HB2 1 1
9 3380 1 1 18 PRO HB3 H -1.343 1.433 -13.299 1.00 . A A . 26 PRO HB3 1 1
9 3381 1 1 18 PRO HD2 H -4.382 2.794 -11.322 1.00 . A A . 26 PRO HD2 1 1
9 3382 1 1 18 PRO HD3 H -3.274 1.444 -11.000 1.00 . A A . 26 PRO HD3 1 1
9 3383 1 1 18 PRO HG2 H -4.032 2.704 -13.622 1.00 . A A . 26 PRO HG2 1 1
9 3384 1 1 18 PRO HG3 H -3.622 1.016 -13.259 1.00 . A A . 26 PRO HG3 1 1
9 3385 1 1 18 PRO N N -2.323 3.293 -11.349 1.00 . A A . 26 PRO N 1 1
9 3386 1 1 18 PRO O O -1.423 5.021 -14.413 1.00 . A A . 26 PRO O 1 1
9 3387 1 1 19 TYR C C -2.585 8.125 -11.889 1.00 . A A . 27 TYR C 1 1
9 3388 1 1 19 TYR CA C -2.627 7.085 -13.005 1.00 . A A . 27 TYR CA 1 1
9 3389 1 1 19 TYR CB C -4.011 7.095 -13.659 1.00 . A A . 27 TYR CB 1 1
9 3390 1 1 19 TYR CD1 C -3.239 6.235 -15.901 1.00 . A A . 27 TYR CD1 1 1
9 3391 1 1 19 TYR CD2 C -4.898 4.958 -14.676 1.00 . A A . 27 TYR CD2 1 1
9 3392 1 1 19 TYR CE1 C -3.273 5.289 -16.932 1.00 . A A . 27 TYR CE1 1 1
9 3393 1 1 19 TYR CE2 C -4.932 4.013 -15.708 1.00 . A A . 27 TYR CE2 1 1
9 3394 1 1 19 TYR CG C -4.051 6.071 -14.772 1.00 . A A . 27 TYR CG 1 1
9 3395 1 1 19 TYR CZ C -4.119 4.178 -16.836 1.00 . A A . 27 TYR CZ 1 1
9 3396 1 1 19 TYR H H -2.571 5.532 -11.559 1.00 . A A . 27 TYR H 1 1
9 3397 1 1 19 TYR HA H -1.890 7.346 -13.750 1.00 . A A . 27 TYR HA 1 1
9 3398 1 1 19 TYR HB2 H -4.761 6.859 -12.918 1.00 . A A . 27 TYR HB2 1 1
9 3399 1 1 19 TYR HB3 H -4.207 8.075 -14.068 1.00 . A A . 27 TYR HB3 1 1
9 3400 1 1 19 TYR HD1 H -2.585 7.092 -15.975 1.00 . A A . 27 TYR HD1 1 1
9 3401 1 1 19 TYR HD2 H -5.525 4.829 -13.806 1.00 . A A . 27 TYR HD2 1 1
9 3402 1 1 19 TYR HE1 H -2.646 5.417 -17.802 1.00 . A A . 27 TYR HE1 1 1
9 3403 1 1 19 TYR HE2 H -5.584 3.156 -15.634 1.00 . A A . 27 TYR HE2 1 1
9 3404 1 1 19 TYR HH H -3.778 3.651 -18.639 1.00 . A A . 27 TYR HH 1 1
9 3405 1 1 19 TYR N N -2.333 5.750 -12.484 1.00 . A A . 27 TYR N 1 1
9 3406 1 1 19 TYR O O -3.507 8.929 -11.744 1.00 . A A . 27 TYR O 1 1
9 3407 1 1 19 TYR OH O -4.152 3.246 -17.853 1.00 . A A . 27 TYR OH 1 1
9 3408 1 1 20 LYS C C -0.858 10.410 -10.556 1.00 . A A . 28 LYS C 1 1
9 3409 1 1 20 LYS CA C -1.355 9.072 -10.014 1.00 . A A . 28 LYS CA 1 1
9 3410 1 1 20 LYS CB C -0.383 8.530 -8.935 1.00 . A A . 28 LYS CB 1 1
9 3411 1 1 20 LYS CD C 1.466 8.229 -10.633 1.00 . A A . 28 LYS CD 1 1
9 3412 1 1 20 LYS CE C 2.286 9.382 -10.032 1.00 . A A . 28 LYS CE 1 1
9 3413 1 1 20 LYS CG C 0.623 7.544 -9.548 1.00 . A A . 28 LYS CG 1 1
9 3414 1 1 20 LYS H H -0.804 7.456 -11.277 1.00 . A A . 28 LYS H 1 1
9 3415 1 1 20 LYS HA H -2.323 9.231 -9.561 1.00 . A A . 28 LYS HA 1 1
9 3416 1 1 20 LYS HB2 H 0.156 9.349 -8.480 1.00 . A A . 28 LYS HB2 1 1
9 3417 1 1 20 LYS HB3 H -0.949 8.018 -8.170 1.00 . A A . 28 LYS HB3 1 1
9 3418 1 1 20 LYS HD2 H 2.139 7.504 -11.068 1.00 . A A . 28 LYS HD2 1 1
9 3419 1 1 20 LYS HD3 H 0.818 8.616 -11.404 1.00 . A A . 28 LYS HD3 1 1
9 3420 1 1 20 LYS HE2 H 3.151 9.569 -10.652 1.00 . A A . 28 LYS HE2 1 1
9 3421 1 1 20 LYS HE3 H 1.680 10.272 -9.990 1.00 . A A . 28 LYS HE3 1 1
9 3422 1 1 20 LYS HG2 H 1.273 7.171 -8.771 1.00 . A A . 28 LYS HG2 1 1
9 3423 1 1 20 LYS HG3 H 0.091 6.713 -9.981 1.00 . A A . 28 LYS HG3 1 1
9 3424 1 1 20 LYS HZ1 H 1.973 9.216 -7.979 1.00 . A A . 28 LYS HZ1 1 1
9 3425 1 1 20 LYS HZ2 H 3.574 9.590 -8.408 1.00 . A A . 28 LYS HZ2 1 1
9 3426 1 1 20 LYS HZ3 H 2.980 8.013 -8.623 1.00 . A A . 28 LYS HZ3 1 1
9 3427 1 1 20 LYS N N -1.507 8.113 -11.108 1.00 . A A . 28 LYS N 1 1
9 3428 1 1 20 LYS NZ N 2.737 9.023 -8.657 1.00 . A A . 28 LYS NZ 1 1
9 3429 1 1 20 LYS O O -0.427 11.280 -9.800 1.00 . A A . 28 LYS O 1 1
9 3430 1 1 21 ASP C C -1.218 12.991 -11.970 1.00 . A A . 29 ASP C 1 1
9 3431 1 1 21 ASP CA C -0.486 11.774 -12.525 1.00 . A A . 29 ASP CA 1 1
9 3432 1 1 21 ASP CB C -0.728 11.624 -14.029 1.00 . A A . 29 ASP CB 1 1
9 3433 1 1 21 ASP CG C -2.181 11.939 -14.388 1.00 . A A . 29 ASP CG 1 1
9 3434 1 1 21 ASP H H -1.274 9.835 -12.423 1.00 . A A . 29 ASP H 1 1
9 3435 1 1 21 ASP HA H 0.565 11.898 -12.350 1.00 . A A . 29 ASP HA 1 1
9 3436 1 1 21 ASP HB2 H -0.078 12.286 -14.557 1.00 . A A . 29 ASP HB2 1 1
9 3437 1 1 21 ASP HB3 H -0.508 10.609 -14.317 1.00 . A A . 29 ASP HB3 1 1
9 3438 1 1 21 ASP N N -0.924 10.560 -11.873 1.00 . A A . 29 ASP N 1 1
9 3439 1 1 21 ASP O O -0.926 14.130 -12.331 1.00 . A A . 29 ASP O 1 1
9 3440 1 1 21 ASP OD1 O -3.049 11.620 -13.593 1.00 . A A . 29 ASP OD1 1 1
9 3441 1 1 21 ASP OD2 O -2.400 12.492 -15.453 1.00 . A A . 29 ASP OD2 1 1
9 3442 1 1 22 THR C C -2.183 14.419 -9.316 1.00 . A A . 30 THR C 1 1
9 3443 1 1 22 THR CA C -2.953 13.792 -10.474 1.00 . A A . 30 THR CA 1 1
9 3444 1 1 22 THR CB C -4.280 13.229 -9.963 1.00 . A A . 30 THR CB 1 1
9 3445 1 1 22 THR CG2 C -4.013 12.021 -9.062 1.00 . A A . 30 THR CG2 1 1
9 3446 1 1 22 THR H H -2.341 11.797 -10.854 1.00 . A A . 30 THR H 1 1
9 3447 1 1 22 THR HA H -3.158 14.553 -11.212 1.00 . A A . 30 THR HA 1 1
9 3448 1 1 22 THR HB H -4.887 12.920 -10.800 1.00 . A A . 30 THR HB 1 1
9 3449 1 1 22 THR HG1 H -4.632 14.217 -8.324 1.00 . A A . 30 THR HG1 1 1
9 3450 1 1 22 THR HG21 H -3.329 12.305 -8.276 1.00 . A A . 30 THR HG21 1 1
9 3451 1 1 22 THR HG22 H -3.577 11.225 -9.648 1.00 . A A . 30 THR HG22 1 1
9 3452 1 1 22 THR HG23 H -4.941 11.684 -8.628 1.00 . A A . 30 THR HG23 1 1
9 3453 1 1 22 THR N N -2.168 12.728 -11.092 1.00 . A A . 30 THR N 1 1
9 3454 1 1 22 THR O O -2.636 15.391 -8.711 1.00 . A A . 30 THR O 1 1
9 3455 1 1 22 THR OG1 O -4.965 14.232 -9.225 1.00 . A A . 30 THR OG1 1 1
9 3456 1 1 23 LEU C C 0.426 15.709 -8.314 1.00 . A A . 31 LEU C 1 1
9 3457 1 1 23 LEU CA C -0.191 14.368 -7.926 1.00 . A A . 31 LEU CA 1 1
9 3458 1 1 23 LEU CB C 0.914 13.355 -7.596 1.00 . A A . 31 LEU CB 1 1
9 3459 1 1 23 LEU CD1 C 1.119 14.415 -5.320 1.00 . A A . 31 LEU CD1 1 1
9 3460 1 1 23 LEU CD2 C 2.884 12.842 -6.148 1.00 . A A . 31 LEU CD2 1 1
9 3461 1 1 23 LEU CG C 1.888 13.933 -6.558 1.00 . A A . 31 LEU CG 1 1
9 3462 1 1 23 LEU H H -0.708 13.084 -9.532 1.00 . A A . 31 LEU H 1 1
9 3463 1 1 23 LEU HA H -0.812 14.505 -7.055 1.00 . A A . 31 LEU HA 1 1
9 3464 1 1 23 LEU HB2 H 0.465 12.456 -7.202 1.00 . A A . 31 LEU HB2 1 1
9 3465 1 1 23 LEU HB3 H 1.457 13.115 -8.499 1.00 . A A . 31 LEU HB3 1 1
9 3466 1 1 23 LEU HD11 H 1.793 14.483 -4.478 1.00 . A A . 31 LEU HD11 1 1
9 3467 1 1 23 LEU HD12 H 0.327 13.719 -5.091 1.00 . A A . 31 LEU HD12 1 1
9 3468 1 1 23 LEU HD13 H 0.695 15.389 -5.517 1.00 . A A . 31 LEU HD13 1 1
9 3469 1 1 23 LEU HD21 H 2.347 11.936 -5.907 1.00 . A A . 31 LEU HD21 1 1
9 3470 1 1 23 LEU HD22 H 3.441 13.171 -5.283 1.00 . A A . 31 LEU HD22 1 1
9 3471 1 1 23 LEU HD23 H 3.565 12.651 -6.964 1.00 . A A . 31 LEU HD23 1 1
9 3472 1 1 23 LEU HG H 2.428 14.762 -6.990 1.00 . A A . 31 LEU HG 1 1
9 3473 1 1 23 LEU N N -1.018 13.856 -9.014 1.00 . A A . 31 LEU N 1 1
9 3474 1 1 23 LEU O O 1.075 15.825 -9.354 1.00 . A A . 31 LEU O 1 1
9 3475 1 1 24 GLY C C 2.286 18.025 -7.717 1.00 . A A . 32 GLY C 1 1
9 3476 1 1 24 GLY CA C 0.762 18.044 -7.739 1.00 . A A . 32 GLY CA 1 1
9 3477 1 1 24 GLY H H -0.305 16.564 -6.659 1.00 . A A . 32 GLY H 1 1
9 3478 1 1 24 GLY HA2 H 0.423 18.376 -8.710 1.00 . A A . 32 GLY HA2 1 1
9 3479 1 1 24 GLY HA3 H 0.407 18.729 -6.984 1.00 . A A . 32 GLY HA3 1 1
9 3480 1 1 24 GLY N N 0.220 16.716 -7.472 1.00 . A A . 32 GLY N 1 1
9 3481 1 1 24 GLY O O 2.869 19.077 -7.518 1.00 . A A . 32 GLY O 1 1
9 3482 1 1 24 GLY OXT O 2.848 16.958 -7.901 1.00 . A A . 32 GLY OXT 1 1
9 3483 2 2 1 ZN ZN ZN -6.506 3.616 -10.315 1.00 . B A . 300 ZN ZN 1 1
10 3484 1 1 1 LYS C C -11.553 -3.297 1.660 1.00 . A A . 9 LYS C 1 1
10 3485 1 1 1 LYS CA C -10.922 -3.741 2.976 1.00 . A A . 9 LYS CA 1 1
10 3486 1 1 1 LYS CB C -11.930 -4.559 3.789 1.00 . A A . 9 LYS CB 1 1
10 3487 1 1 1 LYS CD C -13.401 -6.583 3.689 1.00 . A A . 9 LYS CD 1 1
10 3488 1 1 1 LYS CE C -13.317 -6.632 5.218 1.00 . A A . 9 LYS CE 1 1
10 3489 1 1 1 LYS CG C -12.143 -5.920 3.119 1.00 . A A . 9 LYS CG 1 1
10 3490 1 1 1 LYS H1 H -10.930 -1.690 3.331 1.00 . A A . 9 LYS H1 1 1
10 3491 1 1 1 LYS H2 H -9.477 -2.460 3.755 1.00 . A A . 9 LYS H2 1 1
10 3492 1 1 1 LYS H3 H -10.851 -2.634 4.738 1.00 . A A . 9 LYS H3 1 1
10 3493 1 1 1 LYS HA H -10.052 -4.346 2.769 1.00 . A A . 9 LYS HA 1 1
10 3494 1 1 1 LYS HB2 H -11.548 -4.705 4.789 1.00 . A A . 9 LYS HB2 1 1
10 3495 1 1 1 LYS HB3 H -12.869 -4.030 3.834 1.00 . A A . 9 LYS HB3 1 1
10 3496 1 1 1 LYS HD2 H -14.272 -6.014 3.395 1.00 . A A . 9 LYS HD2 1 1
10 3497 1 1 1 LYS HD3 H -13.483 -7.588 3.304 1.00 . A A . 9 LYS HD3 1 1
10 3498 1 1 1 LYS HE2 H -14.012 -7.369 5.593 1.00 . A A . 9 LYS HE2 1 1
10 3499 1 1 1 LYS HE3 H -12.314 -6.898 5.519 1.00 . A A . 9 LYS HE3 1 1
10 3500 1 1 1 LYS HG2 H -12.260 -5.782 2.053 1.00 . A A . 9 LYS HG2 1 1
10 3501 1 1 1 LYS HG3 H -11.289 -6.552 3.308 1.00 . A A . 9 LYS HG3 1 1
10 3502 1 1 1 LYS HZ1 H -12.810 -4.843 6.156 1.00 . A A . 9 LYS HZ1 1 1
10 3503 1 1 1 LYS HZ2 H -14.365 -5.410 6.539 1.00 . A A . 9 LYS HZ2 1 1
10 3504 1 1 1 LYS HZ3 H -14.066 -4.698 5.026 1.00 . A A . 9 LYS HZ3 1 1
10 3505 1 1 1 LYS N N -10.515 -2.540 3.759 1.00 . A A . 9 LYS N 1 1
10 3506 1 1 1 LYS NZ N -13.666 -5.295 5.777 1.00 . A A . 9 LYS NZ 1 1
10 3507 1 1 1 LYS O O -11.284 -3.873 0.606 1.00 . A A . 9 LYS O 1 1
10 3508 1 1 2 ILE C C -12.105 -0.883 -0.273 1.00 . A A . 10 ILE C 1 1
10 3509 1 1 2 ILE CA C -13.058 -1.755 0.538 1.00 . A A . 10 ILE CA 1 1
10 3510 1 1 2 ILE CB C -14.287 -0.939 0.937 1.00 . A A . 10 ILE CB 1 1
10 3511 1 1 2 ILE CD1 C -16.332 -0.928 2.375 1.00 . A A . 10 ILE CD1 1 1
10 3512 1 1 2 ILE CG1 C -15.203 -1.795 1.815 1.00 . A A . 10 ILE CG1 1 1
10 3513 1 1 2 ILE CG2 C -15.045 -0.508 -0.320 1.00 . A A . 10 ILE CG2 1 1
10 3514 1 1 2 ILE H H -12.569 -1.850 2.599 1.00 . A A . 10 ILE H 1 1
10 3515 1 1 2 ILE HA H -13.376 -2.588 -0.072 1.00 . A A . 10 ILE HA 1 1
10 3516 1 1 2 ILE HB H -13.975 -0.062 1.486 1.00 . A A . 10 ILE HB 1 1
10 3517 1 1 2 ILE HD11 H -16.974 -0.606 1.567 1.00 . A A . 10 ILE HD11 1 1
10 3518 1 1 2 ILE HD12 H -15.911 -0.063 2.867 1.00 . A A . 10 ILE HD12 1 1
10 3519 1 1 2 ILE HD13 H -16.909 -1.501 3.085 1.00 . A A . 10 ILE HD13 1 1
10 3520 1 1 2 ILE HG12 H -15.623 -2.595 1.223 1.00 . A A . 10 ILE HG12 1 1
10 3521 1 1 2 ILE HG13 H -14.633 -2.212 2.632 1.00 . A A . 10 ILE HG13 1 1
10 3522 1 1 2 ILE HG21 H -15.949 0.010 -0.036 1.00 . A A . 10 ILE HG21 1 1
10 3523 1 1 2 ILE HG22 H -15.300 -1.380 -0.903 1.00 . A A . 10 ILE HG22 1 1
10 3524 1 1 2 ILE HG23 H -14.422 0.149 -0.908 1.00 . A A . 10 ILE HG23 1 1
10 3525 1 1 2 ILE N N -12.393 -2.270 1.731 1.00 . A A . 10 ILE N 1 1
10 3526 1 1 2 ILE O O -12.129 0.344 -0.167 1.00 . A A . 10 ILE O 1 1
10 3527 1 1 3 VAL C C -10.977 -0.238 -3.149 1.00 . A A . 11 VAL C 1 1
10 3528 1 1 3 VAL CA C -10.310 -0.795 -1.908 1.00 . A A . 11 VAL CA 1 1
10 3529 1 1 3 VAL CB C -9.151 -1.707 -2.313 1.00 . A A . 11 VAL CB 1 1
10 3530 1 1 3 VAL CG1 C -9.689 -2.938 -3.049 1.00 . A A . 11 VAL CG1 1 1
10 3531 1 1 3 VAL CG2 C -8.197 -0.942 -3.236 1.00 . A A . 11 VAL CG2 1 1
10 3532 1 1 3 VAL H H -11.294 -2.502 -1.124 1.00 . A A . 11 VAL H 1 1
10 3533 1 1 3 VAL HA H -9.912 0.033 -1.342 1.00 . A A . 11 VAL HA 1 1
10 3534 1 1 3 VAL HB H -8.620 -2.020 -1.429 1.00 . A A . 11 VAL HB 1 1
10 3535 1 1 3 VAL HG11 H -10.031 -2.648 -4.031 1.00 . A A . 11 VAL HG11 1 1
10 3536 1 1 3 VAL HG12 H -10.510 -3.362 -2.493 1.00 . A A . 11 VAL HG12 1 1
10 3537 1 1 3 VAL HG13 H -8.902 -3.671 -3.146 1.00 . A A . 11 VAL HG13 1 1
10 3538 1 1 3 VAL HG21 H -7.261 -1.477 -3.310 1.00 . A A . 11 VAL HG21 1 1
10 3539 1 1 3 VAL HG22 H -8.018 0.042 -2.831 1.00 . A A . 11 VAL HG22 1 1
10 3540 1 1 3 VAL HG23 H -8.639 -0.851 -4.217 1.00 . A A . 11 VAL HG23 1 1
10 3541 1 1 3 VAL N N -11.267 -1.524 -1.082 1.00 . A A . 11 VAL N 1 1
10 3542 1 1 3 VAL O O -11.659 -0.952 -3.886 1.00 . A A . 11 VAL O 1 1
10 3543 1 1 4 SER C C -10.570 3.003 -4.823 1.00 . A A . 12 SER C 1 1
10 3544 1 1 4 SER CA C -11.329 1.721 -4.529 1.00 . A A . 12 SER CA 1 1
10 3545 1 1 4 SER CB C -12.798 2.046 -4.300 1.00 . A A . 12 SER CB 1 1
10 3546 1 1 4 SER H H -10.202 1.553 -2.748 1.00 . A A . 12 SER H 1 1
10 3547 1 1 4 SER HA H -11.249 1.067 -5.385 1.00 . A A . 12 SER HA 1 1
10 3548 1 1 4 SER HB2 H -12.885 2.835 -3.573 1.00 . A A . 12 SER HB2 1 1
10 3549 1 1 4 SER HB3 H -13.234 2.371 -5.237 1.00 . A A . 12 SER HB3 1 1
10 3550 1 1 4 SER HG H -13.777 1.069 -2.932 1.00 . A A . 12 SER HG 1 1
10 3551 1 1 4 SER N N -10.763 1.048 -3.373 1.00 . A A . 12 SER N 1 1
10 3552 1 1 4 SER O O -10.494 3.908 -3.992 1.00 . A A . 12 SER O 1 1
10 3553 1 1 4 SER OG O -13.471 0.888 -3.824 1.00 . A A . 12 SER OG 1 1
10 3554 1 1 5 CYS C C -10.172 5.452 -6.522 1.00 . A A . 13 CYS C 1 1
10 3555 1 1 5 CYS CA C -9.261 4.230 -6.453 1.00 . A A . 13 CYS CA 1 1
10 3556 1 1 5 CYS CB C -8.646 3.959 -7.827 1.00 . A A . 13 CYS CB 1 1
10 3557 1 1 5 CYS H H -10.128 2.303 -6.622 1.00 . A A . 13 CYS H 1 1
10 3558 1 1 5 CYS HA H -8.469 4.421 -5.746 1.00 . A A . 13 CYS HA 1 1
10 3559 1 1 5 CYS HB2 H -8.188 2.982 -7.829 1.00 . A A . 13 CYS HB2 1 1
10 3560 1 1 5 CYS HB3 H -9.416 3.993 -8.578 1.00 . A A . 13 CYS HB3 1 1
10 3561 1 1 5 CYS N N -10.019 3.063 -6.018 1.00 . A A . 13 CYS N 1 1
10 3562 1 1 5 CYS O O -11.395 5.323 -6.485 1.00 . A A . 13 CYS O 1 1
10 3563 1 1 5 CYS SG S -7.393 5.211 -8.199 1.00 . A A . 13 CYS SG 1 1
10 3564 1 1 6 ARG C C -10.039 8.630 -7.988 1.00 . A A . 14 ARG C 1 1
10 3565 1 1 6 ARG CA C -10.341 7.889 -6.690 1.00 . A A . 14 ARG CA 1 1
10 3566 1 1 6 ARG CB C -9.998 8.783 -5.493 1.00 . A A . 14 ARG CB 1 1
10 3567 1 1 6 ARG CD C -8.115 9.927 -4.308 1.00 . A A . 14 ARG CD 1 1
10 3568 1 1 6 ARG CG C -8.578 9.335 -5.641 1.00 . A A . 14 ARG CG 1 1
10 3569 1 1 6 ARG CZ C -8.778 12.246 -4.588 1.00 . A A . 14 ARG CZ 1 1
10 3570 1 1 6 ARG H H -8.591 6.679 -6.644 1.00 . A A . 14 ARG H 1 1
10 3571 1 1 6 ARG HA H -11.400 7.664 -6.661 1.00 . A A . 14 ARG HA 1 1
10 3572 1 1 6 ARG HB2 H -10.699 9.603 -5.446 1.00 . A A . 14 ARG HB2 1 1
10 3573 1 1 6 ARG HB3 H -10.063 8.204 -4.584 1.00 . A A . 14 ARG HB3 1 1
10 3574 1 1 6 ARG HD2 H -8.208 9.181 -3.534 1.00 . A A . 14 ARG HD2 1 1
10 3575 1 1 6 ARG HD3 H -7.081 10.228 -4.391 1.00 . A A . 14 ARG HD3 1 1
10 3576 1 1 6 ARG HE H -9.604 11.005 -3.252 1.00 . A A . 14 ARG HE 1 1
10 3577 1 1 6 ARG HG2 H -7.911 8.538 -5.934 1.00 . A A . 14 ARG HG2 1 1
10 3578 1 1 6 ARG HG3 H -8.569 10.106 -6.396 1.00 . A A . 14 ARG HG3 1 1
10 3579 1 1 6 ARG HH11 H -7.319 11.581 -5.786 1.00 . A A . 14 ARG HH11 1 1
10 3580 1 1 6 ARG HH12 H -7.772 13.238 -6.006 1.00 . A A . 14 ARG HH12 1 1
10 3581 1 1 6 ARG HH21 H -10.204 13.177 -3.534 1.00 . A A . 14 ARG HH21 1 1
10 3582 1 1 6 ARG HH22 H -9.405 14.142 -4.731 1.00 . A A . 14 ARG HH22 1 1
10 3583 1 1 6 ARG N N -9.571 6.640 -6.619 1.00 . A A . 14 ARG N 1 1
10 3584 1 1 6 ARG NE N -8.931 11.084 -3.960 1.00 . A A . 14 ARG NE 1 1
10 3585 1 1 6 ARG NH1 N -7.887 12.365 -5.533 1.00 . A A . 14 ARG NH1 1 1
10 3586 1 1 6 ARG NH2 N -9.520 13.267 -4.259 1.00 . A A . 14 ARG NH2 1 1
10 3587 1 1 6 ARG O O -10.208 9.846 -8.074 1.00 . A A . 14 ARG O 1 1
10 3588 1 1 7 ILE C C -9.892 7.654 -11.419 1.00 . A A . 15 ILE C 1 1
10 3589 1 1 7 ILE CA C -9.259 8.470 -10.298 1.00 . A A . 15 ILE CA 1 1
10 3590 1 1 7 ILE CB C -7.740 8.492 -10.488 1.00 . A A . 15 ILE CB 1 1
10 3591 1 1 7 ILE CD1 C -5.571 8.999 -9.359 1.00 . A A . 15 ILE CD1 1 1
10 3592 1 1 7 ILE CG1 C -7.082 9.230 -9.320 1.00 . A A . 15 ILE CG1 1 1
10 3593 1 1 7 ILE CG2 C -7.401 9.210 -11.796 1.00 . A A . 15 ILE CG2 1 1
10 3594 1 1 7 ILE H H -9.475 6.921 -8.864 1.00 . A A . 15 ILE H 1 1
10 3595 1 1 7 ILE HA H -9.631 9.483 -10.348 1.00 . A A . 15 ILE HA 1 1
10 3596 1 1 7 ILE HB H -7.370 7.477 -10.531 1.00 . A A . 15 ILE HB 1 1
10 3597 1 1 7 ILE HD11 H -5.158 9.472 -10.237 1.00 . A A . 15 ILE HD11 1 1
10 3598 1 1 7 ILE HD12 H -5.370 7.938 -9.393 1.00 . A A . 15 ILE HD12 1 1
10 3599 1 1 7 ILE HD13 H -5.119 9.423 -8.476 1.00 . A A . 15 ILE HD13 1 1
10 3600 1 1 7 ILE HG12 H -7.289 10.287 -9.399 1.00 . A A . 15 ILE HG12 1 1
10 3601 1 1 7 ILE HG13 H -7.476 8.854 -8.387 1.00 . A A . 15 ILE HG13 1 1
10 3602 1 1 7 ILE HG21 H -7.800 8.649 -12.628 1.00 . A A . 15 ILE HG21 1 1
10 3603 1 1 7 ILE HG22 H -6.329 9.288 -11.895 1.00 . A A . 15 ILE HG22 1 1
10 3604 1 1 7 ILE HG23 H -7.835 10.199 -11.786 1.00 . A A . 15 ILE HG23 1 1
10 3605 1 1 7 ILE N N -9.589 7.885 -8.996 1.00 . A A . 15 ILE N 1 1
10 3606 1 1 7 ILE O O -10.359 8.204 -12.416 1.00 . A A . 15 ILE O 1 1
10 3607 1 1 8 CYS C C -11.268 4.315 -11.586 1.00 . A A . 16 CYS C 1 1
10 3608 1 1 8 CYS CA C -10.455 5.427 -12.249 1.00 . A A . 16 CYS CA 1 1
10 3609 1 1 8 CYS CB C -9.317 4.812 -13.061 1.00 . A A . 16 CYS CB 1 1
10 3610 1 1 8 CYS H H -9.496 5.958 -10.440 1.00 . A A . 16 CYS H 1 1
10 3611 1 1 8 CYS HA H -11.100 5.978 -12.918 1.00 . A A . 16 CYS HA 1 1
10 3612 1 1 8 CYS HB2 H -9.722 4.265 -13.898 1.00 . A A . 16 CYS HB2 1 1
10 3613 1 1 8 CYS HB3 H -8.673 5.600 -13.421 1.00 . A A . 16 CYS HB3 1 1
10 3614 1 1 8 CYS N N -9.892 6.332 -11.249 1.00 . A A . 16 CYS N 1 1
10 3615 1 1 8 CYS O O -12.021 3.607 -12.254 1.00 . A A . 16 CYS O 1 1
10 3616 1 1 8 CYS SG S -8.365 3.694 -12.006 1.00 . A A . 16 CYS SG 1 1
10 3617 1 1 9 LYS C C -11.507 1.753 -10.079 1.00 . A A . 17 LYS C 1 1
10 3618 1 1 9 LYS CA C -11.850 3.137 -9.542 1.00 . A A . 17 LYS CA 1 1
10 3619 1 1 9 LYS CB C -13.352 3.385 -9.669 1.00 . A A . 17 LYS CB 1 1
10 3620 1 1 9 LYS CD C -15.154 5.114 -9.574 1.00 . A A . 17 LYS CD 1 1
10 3621 1 1 9 LYS CE C -15.506 6.484 -8.992 1.00 . A A . 17 LYS CE 1 1
10 3622 1 1 9 LYS CG C -13.652 4.868 -9.431 1.00 . A A . 17 LYS CG 1 1
10 3623 1 1 9 LYS H H -10.509 4.754 -9.784 1.00 . A A . 17 LYS H 1 1
10 3624 1 1 9 LYS HA H -11.577 3.180 -8.499 1.00 . A A . 17 LYS HA 1 1
10 3625 1 1 9 LYS HB2 H -13.681 3.104 -10.659 1.00 . A A . 17 LYS HB2 1 1
10 3626 1 1 9 LYS HB3 H -13.873 2.795 -8.934 1.00 . A A . 17 LYS HB3 1 1
10 3627 1 1 9 LYS HD2 H -15.423 5.086 -10.620 1.00 . A A . 17 LYS HD2 1 1
10 3628 1 1 9 LYS HD3 H -15.697 4.348 -9.041 1.00 . A A . 17 LYS HD3 1 1
10 3629 1 1 9 LYS HE2 H -16.561 6.675 -9.134 1.00 . A A . 17 LYS HE2 1 1
10 3630 1 1 9 LYS HE3 H -15.277 6.497 -7.937 1.00 . A A . 17 LYS HE3 1 1
10 3631 1 1 9 LYS HG2 H -13.335 5.144 -8.436 1.00 . A A . 17 LYS HG2 1 1
10 3632 1 1 9 LYS HG3 H -13.123 5.467 -10.157 1.00 . A A . 17 LYS HG3 1 1
10 3633 1 1 9 LYS HZ1 H -14.849 7.454 -10.713 1.00 . A A . 17 LYS HZ1 1 1
10 3634 1 1 9 LYS HZ2 H -13.705 7.419 -9.457 1.00 . A A . 17 LYS HZ2 1 1
10 3635 1 1 9 LYS HZ3 H -15.033 8.475 -9.372 1.00 . A A . 17 LYS HZ3 1 1
10 3636 1 1 9 LYS N N -11.117 4.166 -10.271 1.00 . A A . 17 LYS N 1 1
10 3637 1 1 9 LYS NZ N -14.714 7.538 -9.686 1.00 . A A . 17 LYS NZ 1 1
10 3638 1 1 9 LYS O O -12.392 0.935 -10.327 1.00 . A A . 17 LYS O 1 1
10 3639 1 1 10 GLY C C -9.680 -0.812 -9.622 1.00 . A A . 18 GLY C 1 1
10 3640 1 1 10 GLY CA C -9.757 0.208 -10.752 1.00 . A A . 18 GLY CA 1 1
10 3641 1 1 10 GLY H H -9.555 2.190 -10.031 1.00 . A A . 18 GLY H 1 1
10 3642 1 1 10 GLY HA2 H -10.446 -0.146 -11.507 1.00 . A A . 18 GLY HA2 1 1
10 3643 1 1 10 GLY HA3 H -8.777 0.323 -11.190 1.00 . A A . 18 GLY HA3 1 1
10 3644 1 1 10 GLY N N -10.213 1.498 -10.250 1.00 . A A . 18 GLY N 1 1
10 3645 1 1 10 GLY O O -10.681 -1.108 -8.971 1.00 . A A . 18 GLY O 1 1
10 3646 1 1 11 ASP C C -6.935 -2.129 -7.647 1.00 . A A . 19 ASP C 1 1
10 3647 1 1 11 ASP CA C -8.276 -2.347 -8.347 1.00 . A A . 19 ASP CA 1 1
10 3648 1 1 11 ASP CB C -8.318 -3.743 -8.967 1.00 . A A . 19 ASP CB 1 1
10 3649 1 1 11 ASP CG C -7.119 -3.948 -9.889 1.00 . A A . 19 ASP CG 1 1
10 3650 1 1 11 ASP H H -7.725 -1.084 -9.953 1.00 . A A . 19 ASP H 1 1
10 3651 1 1 11 ASP HA H -9.067 -2.268 -7.614 1.00 . A A . 19 ASP HA 1 1
10 3652 1 1 11 ASP HB2 H -8.303 -4.487 -8.184 1.00 . A A . 19 ASP HB2 1 1
10 3653 1 1 11 ASP HB3 H -9.225 -3.843 -9.542 1.00 . A A . 19 ASP HB3 1 1
10 3654 1 1 11 ASP N N -8.483 -1.352 -9.397 1.00 . A A . 19 ASP N 1 1
10 3655 1 1 11 ASP O O -6.027 -2.953 -7.753 1.00 . A A . 19 ASP O 1 1
10 3656 1 1 11 ASP OD1 O -6.793 -3.026 -10.619 1.00 . A A . 19 ASP OD1 1 1
10 3657 1 1 11 ASP OD2 O -6.544 -5.023 -9.850 1.00 . A A . 19 ASP OD2 1 1
10 3658 1 1 12 HIS C C -5.878 0.203 -5.024 1.00 . A A . 20 HIS C 1 1
10 3659 1 1 12 HIS CA C -5.584 -0.711 -6.210 1.00 . A A . 20 HIS CA 1 1
10 3660 1 1 12 HIS CB C -4.563 -0.042 -7.158 1.00 . A A . 20 HIS CB 1 1
10 3661 1 1 12 HIS CD2 C -5.860 1.908 -8.341 1.00 . A A . 20 HIS CD2 1 1
10 3662 1 1 12 HIS CE1 C -6.143 0.975 -10.275 1.00 . A A . 20 HIS CE1 1 1
10 3663 1 1 12 HIS CG C -5.285 0.666 -8.271 1.00 . A A . 20 HIS CG 1 1
10 3664 1 1 12 HIS H H -7.566 -0.393 -6.863 1.00 . A A . 20 HIS H 1 1
10 3665 1 1 12 HIS HA H -5.161 -1.632 -5.833 1.00 . A A . 20 HIS HA 1 1
10 3666 1 1 12 HIS HB2 H -3.968 0.674 -6.611 1.00 . A A . 20 HIS HB2 1 1
10 3667 1 1 12 HIS HB3 H -3.910 -0.794 -7.579 1.00 . A A . 20 HIS HB3 1 1
10 3668 1 1 12 HIS HD2 H -5.890 2.625 -7.535 1.00 . A A . 20 HIS HD2 1 1
10 3669 1 1 12 HIS HE1 H -6.433 0.798 -11.300 1.00 . A A . 20 HIS HE1 1 1
10 3670 1 1 12 HIS N N -6.815 -1.016 -6.924 1.00 . A A . 20 HIS N 1 1
10 3671 1 1 12 HIS ND1 N -5.476 0.089 -9.515 1.00 . A A . 20 HIS ND1 1 1
10 3672 1 1 12 HIS NE2 N -6.402 2.103 -9.607 1.00 . A A . 20 HIS NE2 1 1
10 3673 1 1 12 HIS O O -6.985 0.719 -4.869 1.00 . A A . 20 HIS O 1 1
10 3674 1 1 13 TRP C C -4.913 2.704 -3.394 1.00 . A A . 21 TRP C 1 1
10 3675 1 1 13 TRP CA C -4.976 1.228 -3.011 1.00 . A A . 21 TRP CA 1 1
10 3676 1 1 13 TRP CB C -3.833 0.904 -2.040 1.00 . A A . 21 TRP CB 1 1
10 3677 1 1 13 TRP CD1 C -4.206 -1.595 -1.911 1.00 . A A . 21 TRP CD1 1 1
10 3678 1 1 13 TRP CD2 C -4.371 -0.593 0.096 1.00 . A A . 21 TRP CD2 1 1
10 3679 1 1 13 TRP CE2 C -4.599 -1.973 0.310 1.00 . A A . 21 TRP CE2 1 1
10 3680 1 1 13 TRP CE3 C -4.420 0.268 1.207 1.00 . A A . 21 TRP CE3 1 1
10 3681 1 1 13 TRP CG C -4.124 -0.380 -1.324 1.00 . A A . 21 TRP CG 1 1
10 3682 1 1 13 TRP CH2 C -4.910 -1.611 2.677 1.00 . A A . 21 TRP CH2 1 1
10 3683 1 1 13 TRP CZ2 C -4.865 -2.481 1.582 1.00 . A A . 21 TRP CZ2 1 1
10 3684 1 1 13 TRP CZ3 C -4.688 -0.240 2.489 1.00 . A A . 21 TRP CZ3 1 1
10 3685 1 1 13 TRP H H -4.021 -0.061 -4.390 1.00 . A A . 21 TRP H 1 1
10 3686 1 1 13 TRP HA H -5.919 1.033 -2.525 1.00 . A A . 21 TRP HA 1 1
10 3687 1 1 13 TRP HB2 H -2.912 0.802 -2.594 1.00 . A A . 21 TRP HB2 1 1
10 3688 1 1 13 TRP HB3 H -3.730 1.702 -1.320 1.00 . A A . 21 TRP HB3 1 1
10 3689 1 1 13 TRP HD1 H -4.072 -1.794 -2.964 1.00 . A A . 21 TRP HD1 1 1
10 3690 1 1 13 TRP HE1 H -4.599 -3.502 -1.105 1.00 . A A . 21 TRP HE1 1 1
10 3691 1 1 13 TRP HE3 H -4.250 1.327 1.074 1.00 . A A . 21 TRP HE3 1 1
10 3692 1 1 13 TRP HH2 H -5.116 -1.995 3.665 1.00 . A A . 21 TRP HH2 1 1
10 3693 1 1 13 TRP HZ2 H -5.036 -3.537 1.722 1.00 . A A . 21 TRP HZ2 1 1
10 3694 1 1 13 TRP HZ3 H -4.723 0.431 3.336 1.00 . A A . 21 TRP HZ3 1 1
10 3695 1 1 13 TRP N N -4.865 0.385 -4.196 1.00 . A A . 21 TRP N 1 1
10 3696 1 1 13 TRP NE1 N -4.488 -2.541 -0.942 1.00 . A A . 21 TRP NE1 1 1
10 3697 1 1 13 TRP O O -4.470 3.536 -2.604 1.00 . A A . 21 TRP O 1 1
10 3698 1 1 14 THR C C -3.905 4.905 -5.199 1.00 . A A . 22 THR C 1 1
10 3699 1 1 14 THR CA C -5.339 4.397 -5.082 1.00 . A A . 22 THR CA 1 1
10 3700 1 1 14 THR CB C -6.131 5.295 -4.121 1.00 . A A . 22 THR CB 1 1
10 3701 1 1 14 THR CG2 C -6.515 6.599 -4.827 1.00 . A A . 22 THR CG2 1 1
10 3702 1 1 14 THR H H -5.695 2.311 -5.193 1.00 . A A . 22 THR H 1 1
10 3703 1 1 14 THR HA H -5.802 4.432 -6.057 1.00 . A A . 22 THR HA 1 1
10 3704 1 1 14 THR HB H -5.526 5.525 -3.259 1.00 . A A . 22 THR HB 1 1
10 3705 1 1 14 THR HG1 H -7.205 3.687 -3.919 1.00 . A A . 22 THR HG1 1 1
10 3706 1 1 14 THR HG21 H -7.062 6.372 -5.730 1.00 . A A . 22 THR HG21 1 1
10 3707 1 1 14 THR HG22 H -5.619 7.150 -5.078 1.00 . A A . 22 THR HG22 1 1
10 3708 1 1 14 THR HG23 H -7.132 7.195 -4.173 1.00 . A A . 22 THR HG23 1 1
10 3709 1 1 14 THR N N -5.354 3.018 -4.607 1.00 . A A . 22 THR N 1 1
10 3710 1 1 14 THR O O -3.411 5.145 -6.299 1.00 . A A . 22 THR O 1 1
10 3711 1 1 14 THR OG1 O -7.308 4.618 -3.706 1.00 . A A . 22 THR OG1 1 1
10 3712 1 1 15 THR C C -1.043 4.867 -5.138 1.00 . A A . 23 THR C 1 1
10 3713 1 1 15 THR CA C -1.864 5.544 -4.043 1.00 . A A . 23 THR CA 1 1
10 3714 1 1 15 THR CB C -1.229 5.263 -2.680 1.00 . A A . 23 THR CB 1 1
10 3715 1 1 15 THR CG2 C 0.070 6.059 -2.546 1.00 . A A . 23 THR CG2 1 1
10 3716 1 1 15 THR H H -3.687 4.858 -3.211 1.00 . A A . 23 THR H 1 1
10 3717 1 1 15 THR HA H -1.863 6.609 -4.214 1.00 . A A . 23 THR HA 1 1
10 3718 1 1 15 THR HB H -1.011 4.210 -2.595 1.00 . A A . 23 THR HB 1 1
10 3719 1 1 15 THR HG1 H -1.635 5.720 -0.834 1.00 . A A . 23 THR HG1 1 1
10 3720 1 1 15 THR HG21 H 0.775 5.728 -3.294 1.00 . A A . 23 THR HG21 1 1
10 3721 1 1 15 THR HG22 H 0.489 5.902 -1.563 1.00 . A A . 23 THR HG22 1 1
10 3722 1 1 15 THR HG23 H -0.135 7.110 -2.684 1.00 . A A . 23 THR HG23 1 1
10 3723 1 1 15 THR N N -3.243 5.065 -4.057 1.00 . A A . 23 THR N 1 1
10 3724 1 1 15 THR O O -0.313 5.529 -5.876 1.00 . A A . 23 THR O 1 1
10 3725 1 1 15 THR OG1 O -2.132 5.646 -1.652 1.00 . A A . 23 THR OG1 1 1
10 3726 1 1 16 ARG C C -1.231 2.682 -7.543 1.00 . A A . 24 ARG C 1 1
10 3727 1 1 16 ARG CA C -0.425 2.787 -6.250 1.00 . A A . 24 ARG CA 1 1
10 3728 1 1 16 ARG CB C -0.106 1.383 -5.724 1.00 . A A . 24 ARG CB 1 1
10 3729 1 1 16 ARG CD C -1.153 -0.656 -4.718 1.00 . A A . 24 ARG CD 1 1
10 3730 1 1 16 ARG CG C -1.393 0.559 -5.616 1.00 . A A . 24 ARG CG 1 1
10 3731 1 1 16 ARG CZ C -2.147 -2.848 -4.395 1.00 . A A . 24 ARG CZ 1 1
10 3732 1 1 16 ARG H H -1.763 3.067 -4.621 1.00 . A A . 24 ARG H 1 1
10 3733 1 1 16 ARG HA H 0.506 3.295 -6.461 1.00 . A A . 24 ARG HA 1 1
10 3734 1 1 16 ARG HB2 H 0.580 0.892 -6.402 1.00 . A A . 24 ARG HB2 1 1
10 3735 1 1 16 ARG HB3 H 0.348 1.462 -4.747 1.00 . A A . 24 ARG HB3 1 1
10 3736 1 1 16 ARG HD2 H -0.235 -1.141 -5.009 1.00 . A A . 24 ARG HD2 1 1
10 3737 1 1 16 ARG HD3 H -1.074 -0.330 -3.691 1.00 . A A . 24 ARG HD3 1 1
10 3738 1 1 16 ARG HE H -3.093 -1.312 -5.264 1.00 . A A . 24 ARG HE 1 1
10 3739 1 1 16 ARG HG2 H -2.178 1.171 -5.194 1.00 . A A . 24 ARG HG2 1 1
10 3740 1 1 16 ARG HG3 H -1.686 0.223 -6.599 1.00 . A A . 24 ARG HG3 1 1
10 3741 1 1 16 ARG HH11 H -0.272 -2.610 -3.738 1.00 . A A . 24 ARG HH11 1 1
10 3742 1 1 16 ARG HH12 H -0.957 -4.182 -3.495 1.00 . A A . 24 ARG HH12 1 1
10 3743 1 1 16 ARG HH21 H -3.998 -3.371 -4.950 1.00 . A A . 24 ARG HH21 1 1
10 3744 1 1 16 ARG HH22 H -3.068 -4.613 -4.180 1.00 . A A . 24 ARG HH22 1 1
10 3745 1 1 16 ARG N N -1.165 3.543 -5.238 1.00 . A A . 24 ARG N 1 1
10 3746 1 1 16 ARG NE N -2.256 -1.601 -4.843 1.00 . A A . 24 ARG NE 1 1
10 3747 1 1 16 ARG NH1 N -1.039 -3.244 -3.832 1.00 . A A . 24 ARG NH1 1 1
10 3748 1 1 16 ARG NH2 N -3.150 -3.675 -4.518 1.00 . A A . 24 ARG NH2 1 1
10 3749 1 1 16 ARG O O -1.081 1.724 -8.302 1.00 . A A . 24 ARG O 1 1
10 3750 1 1 17 CYS C C -2.017 3.883 -10.238 1.00 . A A . 25 CYS C 1 1
10 3751 1 1 17 CYS CA C -2.900 3.680 -8.999 1.00 . A A . 25 CYS CA 1 1
10 3752 1 1 17 CYS CB C -3.938 4.807 -8.914 1.00 . A A . 25 CYS CB 1 1
10 3753 1 1 17 CYS H H -2.156 4.415 -7.154 1.00 . A A . 25 CYS H 1 1
10 3754 1 1 17 CYS HA H -3.415 2.737 -9.063 1.00 . A A . 25 CYS HA 1 1
10 3755 1 1 17 CYS HB2 H -4.711 4.531 -8.215 1.00 . A A . 25 CYS HB2 1 1
10 3756 1 1 17 CYS HB3 H -3.459 5.714 -8.577 1.00 . A A . 25 CYS HB3 1 1
10 3757 1 1 17 CYS N N -2.081 3.675 -7.792 1.00 . A A . 25 CYS N 1 1
10 3758 1 1 17 CYS O O -1.110 4.714 -10.216 1.00 . A A . 25 CYS O 1 1
10 3759 1 1 17 CYS SG S -4.677 5.090 -10.544 1.00 . A A . 25 CYS SG 1 1
10 3760 1 1 18 PRO C C -1.761 4.615 -13.293 1.00 . A A . 26 PRO C 1 1
10 3761 1 1 18 PRO CA C -1.439 3.311 -12.561 1.00 . A A . 26 PRO CA 1 1
10 3762 1 1 18 PRO CB C -1.833 2.085 -13.398 1.00 . A A . 26 PRO CB 1 1
10 3763 1 1 18 PRO CD C -3.302 2.133 -11.479 1.00 . A A . 26 PRO CD 1 1
10 3764 1 1 18 PRO CG C -3.227 1.765 -12.964 1.00 . A A . 26 PRO CG 1 1
10 3765 1 1 18 PRO HA H -0.387 3.267 -12.326 1.00 . A A . 26 PRO HA 1 1
10 3766 1 1 18 PRO HB2 H -1.805 2.319 -14.455 1.00 . A A . 26 PRO HB2 1 1
10 3767 1 1 18 PRO HB3 H -1.179 1.255 -13.178 1.00 . A A . 26 PRO HB3 1 1
10 3768 1 1 18 PRO HD2 H -4.276 2.534 -11.236 1.00 . A A . 26 PRO HD2 1 1
10 3769 1 1 18 PRO HD3 H -3.079 1.275 -10.863 1.00 . A A . 26 PRO HD3 1 1
10 3770 1 1 18 PRO HG2 H -3.937 2.354 -13.533 1.00 . A A . 26 PRO HG2 1 1
10 3771 1 1 18 PRO HG3 H -3.430 0.713 -13.091 1.00 . A A . 26 PRO HG3 1 1
10 3772 1 1 18 PRO N N -2.252 3.161 -11.316 1.00 . A A . 26 PRO N 1 1
10 3773 1 1 18 PRO O O -1.370 4.804 -14.445 1.00 . A A . 26 PRO O 1 1
10 3774 1 1 19 TYR C C -2.909 7.873 -12.114 1.00 . A A . 27 TYR C 1 1
10 3775 1 1 19 TYR CA C -2.845 6.800 -13.195 1.00 . A A . 27 TYR CA 1 1
10 3776 1 1 19 TYR CB C -4.208 6.692 -13.883 1.00 . A A . 27 TYR CB 1 1
10 3777 1 1 19 TYR CD1 C -3.320 5.633 -15.994 1.00 . A A . 27 TYR CD1 1 1
10 3778 1 1 19 TYR CD2 C -5.023 4.453 -14.734 1.00 . A A . 27 TYR CD2 1 1
10 3779 1 1 19 TYR CE1 C -3.294 4.595 -16.932 1.00 . A A . 27 TYR CE1 1 1
10 3780 1 1 19 TYR CE2 C -4.998 3.415 -15.672 1.00 . A A . 27 TYR CE2 1 1
10 3781 1 1 19 TYR CG C -4.183 5.565 -14.894 1.00 . A A . 27 TYR CG 1 1
10 3782 1 1 19 TYR CZ C -4.134 3.485 -16.771 1.00 . A A . 27 TYR CZ 1 1
10 3783 1 1 19 TYR H H -2.753 5.302 -11.695 1.00 . A A . 27 TYR H 1 1
10 3784 1 1 19 TYR HA H -2.105 7.088 -13.929 1.00 . A A . 27 TYR HA 1 1
10 3785 1 1 19 TYR HB2 H -4.970 6.498 -13.141 1.00 . A A . 27 TYR HB2 1 1
10 3786 1 1 19 TYR HB3 H -4.429 7.620 -14.388 1.00 . A A . 27 TYR HB3 1 1
10 3787 1 1 19 TYR HD1 H -2.672 6.488 -16.120 1.00 . A A . 27 TYR HD1 1 1
10 3788 1 1 19 TYR HD2 H -5.691 4.398 -13.886 1.00 . A A . 27 TYR HD2 1 1
10 3789 1 1 19 TYR HE1 H -2.628 4.648 -17.779 1.00 . A A . 27 TYR HE1 1 1
10 3790 1 1 19 TYR HE2 H -5.645 2.559 -15.548 1.00 . A A . 27 TYR HE2 1 1
10 3791 1 1 19 TYR HH H -3.196 2.321 -17.958 1.00 . A A . 27 TYR HH 1 1
10 3792 1 1 19 TYR N N -2.473 5.510 -12.611 1.00 . A A . 27 TYR N 1 1
10 3793 1 1 19 TYR O O -3.880 8.625 -12.029 1.00 . A A . 27 TYR O 1 1
10 3794 1 1 19 TYR OH O -4.109 2.461 -17.695 1.00 . A A . 27 TYR OH 1 1
10 3795 1 1 20 LYS C C -1.349 10.276 -10.756 1.00 . A A . 28 LYS C 1 1
10 3796 1 1 20 LYS CA C -1.814 8.928 -10.213 1.00 . A A . 28 LYS CA 1 1
10 3797 1 1 20 LYS CB C -0.871 8.452 -9.094 1.00 . A A . 28 LYS CB 1 1
10 3798 1 1 20 LYS CD C 1.021 8.587 -10.743 1.00 . A A . 28 LYS CD 1 1
10 3799 1 1 20 LYS CE C 2.406 8.018 -11.057 1.00 . A A . 28 LYS CE 1 1
10 3800 1 1 20 LYS CG C 0.335 7.713 -9.690 1.00 . A A . 28 LYS CG 1 1
10 3801 1 1 20 LYS H H -1.124 7.315 -11.407 1.00 . A A . 28 LYS H 1 1
10 3802 1 1 20 LYS HA H -2.806 9.048 -9.803 1.00 . A A . 28 LYS HA 1 1
10 3803 1 1 20 LYS HB2 H -0.522 9.302 -8.524 1.00 . A A . 28 LYS HB2 1 1
10 3804 1 1 20 LYS HB3 H -1.405 7.781 -8.438 1.00 . A A . 28 LYS HB3 1 1
10 3805 1 1 20 LYS HD2 H 0.426 8.600 -11.645 1.00 . A A . 28 LYS HD2 1 1
10 3806 1 1 20 LYS HD3 H 1.127 9.593 -10.364 1.00 . A A . 28 LYS HD3 1 1
10 3807 1 1 20 LYS HE2 H 3.076 8.229 -10.237 1.00 . A A . 28 LYS HE2 1 1
10 3808 1 1 20 LYS HE3 H 2.332 6.949 -11.196 1.00 . A A . 28 LYS HE3 1 1
10 3809 1 1 20 LYS HG2 H 1.037 7.484 -8.902 1.00 . A A . 28 LYS HG2 1 1
10 3810 1 1 20 LYS HG3 H 0.004 6.793 -10.147 1.00 . A A . 28 LYS HG3 1 1
10 3811 1 1 20 LYS HZ1 H 3.707 9.294 -12.063 1.00 . A A . 28 LYS HZ1 1 1
10 3812 1 1 20 LYS HZ2 H 2.167 9.175 -12.771 1.00 . A A . 28 LYS HZ2 1 1
10 3813 1 1 20 LYS HZ3 H 3.285 7.906 -12.941 1.00 . A A . 28 LYS HZ3 1 1
10 3814 1 1 20 LYS N N -1.868 7.939 -11.289 1.00 . A A . 28 LYS N 1 1
10 3815 1 1 20 LYS NZ N 2.931 8.645 -12.302 1.00 . A A . 28 LYS NZ 1 1
10 3816 1 1 20 LYS O O -0.904 11.142 -10.003 1.00 . A A . 28 LYS O 1 1
10 3817 1 1 21 ASP C C -1.787 12.866 -12.137 1.00 . A A . 29 ASP C 1 1
10 3818 1 1 21 ASP CA C -1.045 11.666 -12.718 1.00 . A A . 29 ASP CA 1 1
10 3819 1 1 21 ASP CB C -1.312 11.525 -14.219 1.00 . A A . 29 ASP CB 1 1
10 3820 1 1 21 ASP CG C -2.768 11.848 -14.556 1.00 . A A . 29 ASP CG 1 1
10 3821 1 1 21 ASP H H -1.809 9.717 -12.619 1.00 . A A . 29 ASP H 1 1
10 3822 1 1 21 ASP HA H 0.006 11.804 -12.560 1.00 . A A . 29 ASP HA 1 1
10 3823 1 1 21 ASP HB2 H -0.667 12.186 -14.754 1.00 . A A . 29 ASP HB2 1 1
10 3824 1 1 21 ASP HB3 H -1.102 10.509 -14.516 1.00 . A A . 29 ASP HB3 1 1
10 3825 1 1 21 ASP N N -1.453 10.439 -12.069 1.00 . A A . 29 ASP N 1 1
10 3826 1 1 21 ASP O O -1.526 14.012 -12.499 1.00 . A A . 29 ASP O 1 1
10 3827 1 1 21 ASP OD1 O -3.640 11.364 -13.854 1.00 . A A . 29 ASP OD1 1 1
10 3828 1 1 21 ASP OD2 O -2.988 12.574 -15.512 1.00 . A A . 29 ASP OD2 1 1
10 3829 1 1 22 THR C C -2.710 14.262 -9.452 1.00 . A A . 30 THR C 1 1
10 3830 1 1 22 THR CA C -3.497 13.626 -10.592 1.00 . A A . 30 THR CA 1 1
10 3831 1 1 22 THR CB C -4.801 13.036 -10.048 1.00 . A A . 30 THR CB 1 1
10 3832 1 1 22 THR CG2 C -5.603 12.423 -11.197 1.00 . A A . 30 THR CG2 1 1
10 3833 1 1 22 THR H H -2.859 11.644 -10.998 1.00 . A A . 30 THR H 1 1
10 3834 1 1 22 THR HA H -3.736 14.386 -11.321 1.00 . A A . 30 THR HA 1 1
10 3835 1 1 22 THR HB H -5.383 13.817 -9.585 1.00 . A A . 30 THR HB 1 1
10 3836 1 1 22 THR HG1 H -4.817 12.337 -8.234 1.00 . A A . 30 THR HG1 1 1
10 3837 1 1 22 THR HG21 H -5.109 11.527 -11.543 1.00 . A A . 30 THR HG21 1 1
10 3838 1 1 22 THR HG22 H -5.672 13.133 -12.008 1.00 . A A . 30 THR HG22 1 1
10 3839 1 1 22 THR HG23 H -6.596 12.176 -10.850 1.00 . A A . 30 THR HG23 1 1
10 3840 1 1 22 THR N N -2.709 12.580 -11.235 1.00 . A A . 30 THR N 1 1
10 3841 1 1 22 THR O O -2.989 15.390 -9.045 1.00 . A A . 30 THR O 1 1
10 3842 1 1 22 THR OG1 O -4.501 12.034 -9.088 1.00 . A A . 30 THR OG1 1 1
10 3843 1 1 23 LEU C C -0.060 15.218 -8.316 1.00 . A A . 31 LEU C 1 1
10 3844 1 1 23 LEU CA C -0.903 14.034 -7.844 1.00 . A A . 31 LEU CA 1 1
10 3845 1 1 23 LEU CB C 0.009 12.911 -7.323 1.00 . A A . 31 LEU CB 1 1
10 3846 1 1 23 LEU CD1 C 1.314 12.050 -5.372 1.00 . A A . 31 LEU CD1 1 1
10 3847 1 1 23 LEU CD2 C 1.157 14.518 -5.769 1.00 . A A . 31 LEU CD2 1 1
10 3848 1 1 23 LEU CG C 0.409 13.181 -5.866 1.00 . A A . 31 LEU CG 1 1
10 3849 1 1 23 LEU H H -1.548 12.638 -9.304 1.00 . A A . 31 LEU H 1 1
10 3850 1 1 23 LEU HA H -1.552 14.362 -7.046 1.00 . A A . 31 LEU HA 1 1
10 3851 1 1 23 LEU HB2 H -0.521 11.971 -7.377 1.00 . A A . 31 LEU HB2 1 1
10 3852 1 1 23 LEU HB3 H 0.899 12.852 -7.932 1.00 . A A . 31 LEU HB3 1 1
10 3853 1 1 23 LEU HD11 H 2.254 12.081 -5.906 1.00 . A A . 31 LEU HD11 1 1
10 3854 1 1 23 LEU HD12 H 0.833 11.099 -5.548 1.00 . A A . 31 LEU HD12 1 1
10 3855 1 1 23 LEU HD13 H 1.498 12.170 -4.315 1.00 . A A . 31 LEU HD13 1 1
10 3856 1 1 23 LEU HD21 H 1.728 14.549 -4.851 1.00 . A A . 31 LEU HD21 1 1
10 3857 1 1 23 LEU HD22 H 0.445 15.330 -5.773 1.00 . A A . 31 LEU HD22 1 1
10 3858 1 1 23 LEU HD23 H 1.827 14.621 -6.611 1.00 . A A . 31 LEU HD23 1 1
10 3859 1 1 23 LEU HG H -0.481 13.219 -5.253 1.00 . A A . 31 LEU HG 1 1
10 3860 1 1 23 LEU N N -1.725 13.531 -8.939 1.00 . A A . 31 LEU N 1 1
10 3861 1 1 23 LEU O O -0.249 16.346 -7.863 1.00 . A A . 31 LEU O 1 1
10 3862 1 1 24 GLY C C 2.464 15.528 -11.007 1.00 . A A . 32 GLY C 1 1
10 3863 1 1 24 GLY CA C 1.734 15.999 -9.753 1.00 . A A . 32 GLY CA 1 1
10 3864 1 1 24 GLY H H 0.975 14.031 -9.553 1.00 . A A . 32 GLY H 1 1
10 3865 1 1 24 GLY HA2 H 1.135 16.865 -9.996 1.00 . A A . 32 GLY HA2 1 1
10 3866 1 1 24 GLY HA3 H 2.462 16.269 -9.002 1.00 . A A . 32 GLY HA3 1 1
10 3867 1 1 24 GLY N N 0.869 14.950 -9.228 1.00 . A A . 32 GLY N 1 1
10 3868 1 1 24 GLY O O 2.094 14.490 -11.528 1.00 . A A . 32 GLY O 1 1
10 3869 1 1 24 GLY OXT O 3.383 16.212 -11.426 1.00 . A A . 32 GLY OXT 1 1
10 3870 2 2 1 ZN ZN ZN -6.769 4.263 -10.502 1.00 . B A . 300 ZN ZN 1 1
11 3871 1 1 1 LYS C C -13.453 -5.507 0.567 1.00 . A A . 9 LYS C 1 1
11 3872 1 1 1 LYS CA C -13.481 -5.586 2.089 1.00 . A A . 9 LYS CA 1 1
11 3873 1 1 1 LYS CB C -13.396 -7.046 2.538 1.00 . A A . 9 LYS CB 1 1
11 3874 1 1 1 LYS CD C -13.025 -8.560 4.492 1.00 . A A . 9 LYS CD 1 1
11 3875 1 1 1 LYS CE C -12.860 -8.620 6.011 1.00 . A A . 9 LYS CE 1 1
11 3876 1 1 1 LYS CG C -13.208 -7.105 4.055 1.00 . A A . 9 LYS CG 1 1
11 3877 1 1 1 LYS H1 H -14.765 -3.972 2.375 1.00 . A A . 9 LYS H1 1 1
11 3878 1 1 1 LYS H2 H -14.814 -5.125 3.622 1.00 . A A . 9 LYS H2 1 1
11 3879 1 1 1 LYS H3 H -15.559 -5.450 2.130 1.00 . A A . 9 LYS H3 1 1
11 3880 1 1 1 LYS HA H -12.643 -5.038 2.492 1.00 . A A . 9 LYS HA 1 1
11 3881 1 1 1 LYS HB2 H -14.308 -7.560 2.267 1.00 . A A . 9 LYS HB2 1 1
11 3882 1 1 1 LYS HB3 H -12.557 -7.523 2.055 1.00 . A A . 9 LYS HB3 1 1
11 3883 1 1 1 LYS HD2 H -13.892 -9.134 4.200 1.00 . A A . 9 LYS HD2 1 1
11 3884 1 1 1 LYS HD3 H -12.145 -8.969 4.020 1.00 . A A . 9 LYS HD3 1 1
11 3885 1 1 1 LYS HE2 H -12.159 -7.861 6.328 1.00 . A A . 9 LYS HE2 1 1
11 3886 1 1 1 LYS HE3 H -13.815 -8.447 6.484 1.00 . A A . 9 LYS HE3 1 1
11 3887 1 1 1 LYS HG2 H -12.334 -6.532 4.331 1.00 . A A . 9 LYS HG2 1 1
11 3888 1 1 1 LYS HG3 H -14.079 -6.692 4.542 1.00 . A A . 9 LYS HG3 1 1
11 3889 1 1 1 LYS HZ1 H -13.071 -10.463 6.956 1.00 . A A . 9 LYS HZ1 1 1
11 3890 1 1 1 LYS HZ2 H -11.485 -9.851 6.975 1.00 . A A . 9 LYS HZ2 1 1
11 3891 1 1 1 LYS HZ3 H -12.128 -10.513 5.548 1.00 . A A . 9 LYS HZ3 1 1
11 3892 1 1 1 LYS N N -14.751 -4.989 2.592 1.00 . A A . 9 LYS N 1 1
11 3893 1 1 1 LYS NZ N -12.347 -9.963 6.402 1.00 . A A . 9 LYS NZ 1 1
11 3894 1 1 1 LYS O O -13.466 -6.530 -0.118 1.00 . A A . 9 LYS O 1 1
11 3895 1 1 2 ILE C C -12.492 -2.879 -1.742 1.00 . A A . 10 ILE C 1 1
11 3896 1 1 2 ILE CA C -13.388 -4.067 -1.401 1.00 . A A . 10 ILE CA 1 1
11 3897 1 1 2 ILE CB C -14.815 -3.819 -1.906 1.00 . A A . 10 ILE CB 1 1
11 3898 1 1 2 ILE CD1 C -14.584 -5.352 -3.912 1.00 . A A . 10 ILE CD1 1 1
11 3899 1 1 2 ILE CG1 C -14.850 -3.911 -3.443 1.00 . A A . 10 ILE CG1 1 1
11 3900 1 1 2 ILE CG2 C -15.300 -2.429 -1.464 1.00 . A A . 10 ILE CG2 1 1
11 3901 1 1 2 ILE H H -13.410 -3.509 0.635 1.00 . A A . 10 ILE H 1 1
11 3902 1 1 2 ILE HA H -12.994 -4.948 -1.886 1.00 . A A . 10 ILE HA 1 1
11 3903 1 1 2 ILE HB H -15.469 -4.566 -1.483 1.00 . A A . 10 ILE HB 1 1
11 3904 1 1 2 ILE HD11 H -15.120 -5.531 -4.833 1.00 . A A . 10 ILE HD11 1 1
11 3905 1 1 2 ILE HD12 H -14.917 -6.057 -3.164 1.00 . A A . 10 ILE HD12 1 1
11 3906 1 1 2 ILE HD13 H -13.526 -5.485 -4.086 1.00 . A A . 10 ILE HD13 1 1
11 3907 1 1 2 ILE HG12 H -15.822 -3.597 -3.795 1.00 . A A . 10 ILE HG12 1 1
11 3908 1 1 2 ILE HG13 H -14.095 -3.258 -3.855 1.00 . A A . 10 ILE HG13 1 1
11 3909 1 1 2 ILE HG21 H -16.380 -2.406 -1.473 1.00 . A A . 10 ILE HG21 1 1
11 3910 1 1 2 ILE HG22 H -14.921 -1.677 -2.141 1.00 . A A . 10 ILE HG22 1 1
11 3911 1 1 2 ILE HG23 H -14.946 -2.222 -0.464 1.00 . A A . 10 ILE HG23 1 1
11 3912 1 1 2 ILE N N -13.415 -4.283 0.042 1.00 . A A . 10 ILE N 1 1
11 3913 1 1 2 ILE O O -12.740 -1.754 -1.312 1.00 . A A . 10 ILE O 1 1
11 3914 1 1 3 VAL C C -11.065 -1.279 -4.056 1.00 . A A . 11 VAL C 1 1
11 3915 1 1 3 VAL CA C -10.510 -2.094 -2.907 1.00 . A A . 11 VAL CA 1 1
11 3916 1 1 3 VAL CB C -9.168 -2.703 -3.313 1.00 . A A . 11 VAL CB 1 1
11 3917 1 1 3 VAL CG1 C -9.376 -3.684 -4.467 1.00 . A A . 11 VAL CG1 1 1
11 3918 1 1 3 VAL CG2 C -8.219 -1.588 -3.760 1.00 . A A . 11 VAL CG2 1 1
11 3919 1 1 3 VAL H H -11.295 -4.062 -2.819 1.00 . A A . 11 VAL H 1 1
11 3920 1 1 3 VAL HA H -10.348 -1.431 -2.073 1.00 . A A . 11 VAL HA 1 1
11 3921 1 1 3 VAL HB H -8.743 -3.221 -2.469 1.00 . A A . 11 VAL HB 1 1
11 3922 1 1 3 VAL HG11 H -8.487 -4.281 -4.596 1.00 . A A . 11 VAL HG11 1 1
11 3923 1 1 3 VAL HG12 H -9.575 -3.134 -5.375 1.00 . A A . 11 VAL HG12 1 1
11 3924 1 1 3 VAL HG13 H -10.214 -4.328 -4.246 1.00 . A A . 11 VAL HG13 1 1
11 3925 1 1 3 VAL HG21 H -8.531 -1.215 -4.724 1.00 . A A . 11 VAL HG21 1 1
11 3926 1 1 3 VAL HG22 H -7.215 -1.978 -3.832 1.00 . A A . 11 VAL HG22 1 1
11 3927 1 1 3 VAL HG23 H -8.243 -0.784 -3.039 1.00 . A A . 11 VAL HG23 1 1
11 3928 1 1 3 VAL N N -11.444 -3.144 -2.513 1.00 . A A . 11 VAL N 1 1
11 3929 1 1 3 VAL O O -11.531 -1.820 -5.059 1.00 . A A . 11 VAL O 1 1
11 3930 1 1 4 SER C C -10.609 2.200 -4.947 1.00 . A A . 12 SER C 1 1
11 3931 1 1 4 SER CA C -11.476 0.955 -4.918 1.00 . A A . 12 SER CA 1 1
11 3932 1 1 4 SER CB C -12.920 1.355 -4.649 1.00 . A A . 12 SER CB 1 1
11 3933 1 1 4 SER H H -10.602 0.394 -3.076 1.00 . A A . 12 SER H 1 1
11 3934 1 1 4 SER HA H -11.423 0.476 -5.886 1.00 . A A . 12 SER HA 1 1
11 3935 1 1 4 SER HB2 H -12.965 1.989 -3.781 1.00 . A A . 12 SER HB2 1 1
11 3936 1 1 4 SER HB3 H -13.299 1.894 -5.508 1.00 . A A . 12 SER HB3 1 1
11 3937 1 1 4 SER HG H -13.187 -0.410 -3.874 1.00 . A A . 12 SER HG 1 1
11 3938 1 1 4 SER N N -10.995 0.035 -3.898 1.00 . A A . 12 SER N 1 1
11 3939 1 1 4 SER O O -10.478 2.913 -3.953 1.00 . A A . 12 SER O 1 1
11 3940 1 1 4 SER OG O -13.700 0.188 -4.422 1.00 . A A . 12 SER OG 1 1
11 3941 1 1 5 CYS C C -9.945 4.890 -6.060 1.00 . A A . 13 CYS C 1 1
11 3942 1 1 5 CYS CA C -9.158 3.601 -6.287 1.00 . A A . 13 CYS CA 1 1
11 3943 1 1 5 CYS CB C -8.578 3.577 -7.703 1.00 . A A . 13 CYS CB 1 1
11 3944 1 1 5 CYS H H -10.178 1.829 -6.844 1.00 . A A . 13 CYS H 1 1
11 3945 1 1 5 CYS HA H -8.348 3.553 -5.577 1.00 . A A . 13 CYS HA 1 1
11 3946 1 1 5 CYS HB2 H -8.320 2.562 -7.967 1.00 . A A . 13 CYS HB2 1 1
11 3947 1 1 5 CYS HB3 H -9.309 3.952 -8.400 1.00 . A A . 13 CYS HB3 1 1
11 3948 1 1 5 CYS N N -10.023 2.444 -6.100 1.00 . A A . 13 CYS N 1 1
11 3949 1 1 5 CYS O O -11.078 4.857 -5.580 1.00 . A A . 13 CYS O 1 1
11 3950 1 1 5 CYS SG S -7.094 4.608 -7.776 1.00 . A A . 13 CYS SG 1 1
11 3951 1 1 6 ARG C C -9.675 8.241 -7.412 1.00 . A A . 14 ARG C 1 1
11 3952 1 1 6 ARG CA C -9.997 7.325 -6.234 1.00 . A A . 14 ARG CA 1 1
11 3953 1 1 6 ARG CB C -9.535 7.973 -4.912 1.00 . A A . 14 ARG CB 1 1
11 3954 1 1 6 ARG CD C -11.635 8.068 -3.512 1.00 . A A . 14 ARG CD 1 1
11 3955 1 1 6 ARG CG C -10.640 8.888 -4.345 1.00 . A A . 14 ARG CG 1 1
11 3956 1 1 6 ARG CZ C -13.969 8.206 -2.859 1.00 . A A . 14 ARG CZ 1 1
11 3957 1 1 6 ARG H H -8.434 5.991 -6.785 1.00 . A A . 14 ARG H 1 1
11 3958 1 1 6 ARG HA H -11.068 7.177 -6.201 1.00 . A A . 14 ARG HA 1 1
11 3959 1 1 6 ARG HB2 H -9.310 7.194 -4.197 1.00 . A A . 14 ARG HB2 1 1
11 3960 1 1 6 ARG HB3 H -8.643 8.558 -5.087 1.00 . A A . 14 ARG HB3 1 1
11 3961 1 1 6 ARG HD2 H -11.815 7.119 -3.995 1.00 . A A . 14 ARG HD2 1 1
11 3962 1 1 6 ARG HD3 H -11.218 7.894 -2.530 1.00 . A A . 14 ARG HD3 1 1
11 3963 1 1 6 ARG HE H -12.954 9.717 -3.690 1.00 . A A . 14 ARG HE 1 1
11 3964 1 1 6 ARG HG2 H -10.190 9.644 -3.717 1.00 . A A . 14 ARG HG2 1 1
11 3965 1 1 6 ARG HG3 H -11.165 9.369 -5.158 1.00 . A A . 14 ARG HG3 1 1
11 3966 1 1 6 ARG HH11 H -13.048 6.458 -2.528 1.00 . A A . 14 ARG HH11 1 1
11 3967 1 1 6 ARG HH12 H -14.713 6.530 -2.053 1.00 . A A . 14 ARG HH12 1 1
11 3968 1 1 6 ARG HH21 H -15.136 9.818 -3.069 1.00 . A A . 14 ARG HH21 1 1
11 3969 1 1 6 ARG HH22 H -15.894 8.432 -2.359 1.00 . A A . 14 ARG HH22 1 1
11 3970 1 1 6 ARG N N -9.340 6.025 -6.406 1.00 . A A . 14 ARG N 1 1
11 3971 1 1 6 ARG NE N -12.897 8.788 -3.384 1.00 . A A . 14 ARG NE 1 1
11 3972 1 1 6 ARG NH1 N -13.906 6.968 -2.448 1.00 . A A . 14 ARG NH1 1 1
11 3973 1 1 6 ARG NH2 N -15.087 8.870 -2.754 1.00 . A A . 14 ARG NH2 1 1
11 3974 1 1 6 ARG O O -9.899 9.450 -7.354 1.00 . A A . 14 ARG O 1 1
11 3975 1 1 7 ILE C C -9.390 7.726 -10.913 1.00 . A A . 15 ILE C 1 1
11 3976 1 1 7 ILE CA C -8.790 8.401 -9.686 1.00 . A A . 15 ILE CA 1 1
11 3977 1 1 7 ILE CB C -7.267 8.455 -9.832 1.00 . A A . 15 ILE CB 1 1
11 3978 1 1 7 ILE CD1 C -5.154 8.767 -8.533 1.00 . A A . 15 ILE CD1 1 1
11 3979 1 1 7 ILE CG1 C -6.650 9.082 -8.576 1.00 . A A . 15 ILE CG1 1 1
11 3980 1 1 7 ILE CG2 C -6.902 9.298 -11.057 1.00 . A A . 15 ILE CG2 1 1
11 3981 1 1 7 ILE H H -8.995 6.682 -8.463 1.00 . A A . 15 ILE H 1 1
11 3982 1 1 7 ILE HA H -9.173 9.410 -9.618 1.00 . A A . 15 ILE HA 1 1
11 3983 1 1 7 ILE HB H -6.887 7.452 -9.962 1.00 . A A . 15 ILE HB 1 1
11 3984 1 1 7 ILE HD11 H -4.664 9.228 -9.376 1.00 . A A . 15 ILE HD11 1 1
11 3985 1 1 7 ILE HD12 H -5.012 7.696 -8.574 1.00 . A A . 15 ILE HD12 1 1
11 3986 1 1 7 ILE HD13 H -4.732 9.150 -7.616 1.00 . A A . 15 ILE HD13 1 1
11 3987 1 1 7 ILE HG12 H -6.792 10.154 -8.600 1.00 . A A . 15 ILE HG12 1 1
11 3988 1 1 7 ILE HG13 H -7.124 8.676 -7.697 1.00 . A A . 15 ILE HG13 1 1
11 3989 1 1 7 ILE HG21 H -5.850 9.539 -11.026 1.00 . A A . 15 ILE HG21 1 1
11 3990 1 1 7 ILE HG22 H -7.481 10.209 -11.053 1.00 . A A . 15 ILE HG22 1 1
11 3991 1 1 7 ILE HG23 H -7.117 8.739 -11.956 1.00 . A A . 15 ILE HG23 1 1
11 3992 1 1 7 ILE N N -9.147 7.649 -8.482 1.00 . A A . 15 ILE N 1 1
11 3993 1 1 7 ILE O O -9.801 8.389 -11.866 1.00 . A A . 15 ILE O 1 1
11 3994 1 1 8 CYS C C -10.906 4.518 -11.450 1.00 . A A . 16 CYS C 1 1
11 3995 1 1 8 CYS CA C -9.976 5.606 -11.982 1.00 . A A . 16 CYS CA 1 1
11 3996 1 1 8 CYS CB C -8.831 4.961 -12.759 1.00 . A A . 16 CYS CB 1 1
11 3997 1 1 8 CYS H H -9.083 5.930 -10.092 1.00 . A A . 16 CYS H 1 1
11 3998 1 1 8 CYS HA H -10.534 6.248 -12.650 1.00 . A A . 16 CYS HA 1 1
11 3999 1 1 8 CYS HB2 H -9.208 4.539 -13.678 1.00 . A A . 16 CYS HB2 1 1
11 4000 1 1 8 CYS HB3 H -8.085 5.708 -12.983 1.00 . A A . 16 CYS HB3 1 1
11 4001 1 1 8 CYS N N -9.431 6.395 -10.878 1.00 . A A . 16 CYS N 1 1
11 4002 1 1 8 CYS O O -11.599 3.853 -12.219 1.00 . A A . 16 CYS O 1 1
11 4003 1 1 8 CYS SG S -8.090 3.655 -11.752 1.00 . A A . 16 CYS SG 1 1
11 4004 1 1 9 LYS C C -11.382 1.940 -10.000 1.00 . A A . 17 LYS C 1 1
11 4005 1 1 9 LYS CA C -11.761 3.332 -9.509 1.00 . A A . 17 LYS CA 1 1
11 4006 1 1 9 LYS CB C -13.229 3.612 -9.827 1.00 . A A . 17 LYS CB 1 1
11 4007 1 1 9 LYS CD C -13.124 5.544 -8.233 1.00 . A A . 17 LYS CD 1 1
11 4008 1 1 9 LYS CE C -13.786 6.885 -7.905 1.00 . A A . 17 LYS CE 1 1
11 4009 1 1 9 LYS CG C -13.528 5.105 -9.644 1.00 . A A . 17 LYS CG 1 1
11 4010 1 1 9 LYS H H -10.343 4.895 -9.562 1.00 . A A . 17 LYS H 1 1
11 4011 1 1 9 LYS HA H -11.624 3.372 -8.439 1.00 . A A . 17 LYS HA 1 1
11 4012 1 1 9 LYS HB2 H -13.439 3.324 -10.847 1.00 . A A . 17 LYS HB2 1 1
11 4013 1 1 9 LYS HB3 H -13.850 3.042 -9.158 1.00 . A A . 17 LYS HB3 1 1
11 4014 1 1 9 LYS HD2 H -13.442 4.800 -7.518 1.00 . A A . 17 LYS HD2 1 1
11 4015 1 1 9 LYS HD3 H -12.050 5.655 -8.184 1.00 . A A . 17 LYS HD3 1 1
11 4016 1 1 9 LYS HE2 H -13.418 7.643 -8.580 1.00 . A A . 17 LYS HE2 1 1
11 4017 1 1 9 LYS HE3 H -14.856 6.794 -8.013 1.00 . A A . 17 LYS HE3 1 1
11 4018 1 1 9 LYS HG2 H -12.971 5.676 -10.373 1.00 . A A . 17 LYS HG2 1 1
11 4019 1 1 9 LYS HG3 H -14.584 5.277 -9.784 1.00 . A A . 17 LYS HG3 1 1
11 4020 1 1 9 LYS HZ1 H -14.339 7.442 -5.976 1.00 . A A . 17 LYS HZ1 1 1
11 4021 1 1 9 LYS HZ2 H -12.881 8.134 -6.505 1.00 . A A . 17 LYS HZ2 1 1
11 4022 1 1 9 LYS HZ3 H -12.931 6.499 -6.045 1.00 . A A . 17 LYS HZ3 1 1
11 4023 1 1 9 LYS N N -10.915 4.341 -10.130 1.00 . A A . 17 LYS N 1 1
11 4024 1 1 9 LYS NZ N -13.459 7.269 -6.502 1.00 . A A . 17 LYS NZ 1 1
11 4025 1 1 9 LYS O O -12.246 1.094 -10.232 1.00 . A A . 17 LYS O 1 1
11 4026 1 1 10 GLY C C -9.391 -0.539 -9.437 1.00 . A A . 18 GLY C 1 1
11 4027 1 1 10 GLY CA C -9.587 0.413 -10.612 1.00 . A A . 18 GLY CA 1 1
11 4028 1 1 10 GLY H H -9.439 2.421 -9.948 1.00 . A A . 18 GLY H 1 1
11 4029 1 1 10 GLY HA2 H -10.297 -0.017 -11.306 1.00 . A A . 18 GLY HA2 1 1
11 4030 1 1 10 GLY HA3 H -8.641 0.551 -11.113 1.00 . A A . 18 GLY HA3 1 1
11 4031 1 1 10 GLY N N -10.081 1.708 -10.152 1.00 . A A . 18 GLY N 1 1
11 4032 1 1 10 GLY O O -9.896 -0.298 -8.340 1.00 . A A . 18 GLY O 1 1
11 4033 1 1 11 ASP C C -7.128 -2.256 -7.857 1.00 . A A . 19 ASP C 1 1
11 4034 1 1 11 ASP CA C -8.395 -2.611 -8.629 1.00 . A A . 19 ASP CA 1 1
11 4035 1 1 11 ASP CB C -8.236 -3.997 -9.256 1.00 . A A . 19 ASP CB 1 1
11 4036 1 1 11 ASP CG C -7.221 -3.943 -10.392 1.00 . A A . 19 ASP CG 1 1
11 4037 1 1 11 ASP H H -8.280 -1.759 -10.568 1.00 . A A . 19 ASP H 1 1
11 4038 1 1 11 ASP HA H -9.229 -2.634 -7.942 1.00 . A A . 19 ASP HA 1 1
11 4039 1 1 11 ASP HB2 H -7.896 -4.694 -8.504 1.00 . A A . 19 ASP HB2 1 1
11 4040 1 1 11 ASP HB3 H -9.189 -4.327 -9.644 1.00 . A A . 19 ASP HB3 1 1
11 4041 1 1 11 ASP N N -8.656 -1.622 -9.675 1.00 . A A . 19 ASP N 1 1
11 4042 1 1 11 ASP O O -6.155 -3.009 -7.866 1.00 . A A . 19 ASP O 1 1
11 4043 1 1 11 ASP OD1 O -6.418 -3.025 -10.400 1.00 . A A . 19 ASP OD1 1 1
11 4044 1 1 11 ASP OD2 O -7.261 -4.822 -11.238 1.00 . A A . 19 ASP OD2 1 1
11 4045 1 1 12 HIS C C -6.294 0.681 -5.753 1.00 . A A . 20 HIS C 1 1
11 4046 1 1 12 HIS CA C -6.000 -0.663 -6.412 1.00 . A A . 20 HIS CA 1 1
11 4047 1 1 12 HIS CB C -4.764 -0.538 -7.310 1.00 . A A . 20 HIS CB 1 1
11 4048 1 1 12 HIS CD2 C -5.531 1.419 -8.894 1.00 . A A . 20 HIS CD2 1 1
11 4049 1 1 12 HIS CE1 C -5.501 0.331 -10.768 1.00 . A A . 20 HIS CE1 1 1
11 4050 1 1 12 HIS CG C -5.141 0.133 -8.603 1.00 . A A . 20 HIS CG 1 1
11 4051 1 1 12 HIS H H -7.953 -0.549 -7.213 1.00 . A A . 20 HIS H 1 1
11 4052 1 1 12 HIS HA H -5.797 -1.391 -5.641 1.00 . A A . 20 HIS HA 1 1
11 4053 1 1 12 HIS HB2 H -4.010 0.049 -6.809 1.00 . A A . 20 HIS HB2 1 1
11 4054 1 1 12 HIS HB3 H -4.370 -1.521 -7.518 1.00 . A A . 20 HIS HB3 1 1
11 4055 1 1 12 HIS HD2 H -5.647 2.214 -8.173 1.00 . A A . 20 HIS HD2 1 1
11 4056 1 1 12 HIS HE1 H -5.583 0.084 -11.816 1.00 . A A . 20 HIS HE1 1 1
11 4057 1 1 12 HIS N N -7.149 -1.106 -7.187 1.00 . A A . 20 HIS N 1 1
11 4058 1 1 12 HIS ND1 N -5.131 -0.541 -9.814 1.00 . A A . 20 HIS ND1 1 1
11 4059 1 1 12 HIS NE2 N -5.756 1.540 -10.261 1.00 . A A . 20 HIS NE2 1 1
11 4060 1 1 12 HIS O O -6.945 1.545 -6.339 1.00 . A A . 20 HIS O 1 1
11 4061 1 1 13 TRP C C -5.406 3.264 -4.560 1.00 . A A . 21 TRP C 1 1
11 4062 1 1 13 TRP CA C -6.013 2.089 -3.798 1.00 . A A . 21 TRP CA 1 1
11 4063 1 1 13 TRP CB C -5.371 1.988 -2.412 1.00 . A A . 21 TRP CB 1 1
11 4064 1 1 13 TRP CD1 C -6.028 -0.246 -1.428 1.00 . A A . 21 TRP CD1 1 1
11 4065 1 1 13 TRP CD2 C -7.296 1.445 -0.656 1.00 . A A . 21 TRP CD2 1 1
11 4066 1 1 13 TRP CE2 C -7.767 0.267 -0.030 1.00 . A A . 21 TRP CE2 1 1
11 4067 1 1 13 TRP CE3 C -7.930 2.661 -0.340 1.00 . A A . 21 TRP CE3 1 1
11 4068 1 1 13 TRP CG C -6.192 1.093 -1.539 1.00 . A A . 21 TRP CG 1 1
11 4069 1 1 13 TRP CH2 C -9.445 1.509 1.178 1.00 . A A . 21 TRP CH2 1 1
11 4070 1 1 13 TRP CZ2 C -8.827 0.292 0.876 1.00 . A A . 21 TRP CZ2 1 1
11 4071 1 1 13 TRP CZ3 C -8.998 2.690 0.571 1.00 . A A . 21 TRP CZ3 1 1
11 4072 1 1 13 TRP H H -5.296 0.123 -4.120 1.00 . A A . 21 TRP H 1 1
11 4073 1 1 13 TRP HA H -7.075 2.256 -3.683 1.00 . A A . 21 TRP HA 1 1
11 4074 1 1 13 TRP HB2 H -4.376 1.582 -2.507 1.00 . A A . 21 TRP HB2 1 1
11 4075 1 1 13 TRP HB3 H -5.315 2.971 -1.968 1.00 . A A . 21 TRP HB3 1 1
11 4076 1 1 13 TRP HD1 H -5.290 -0.834 -1.951 1.00 . A A . 21 TRP HD1 1 1
11 4077 1 1 13 TRP HE1 H -7.056 -1.678 -0.275 1.00 . A A . 21 TRP HE1 1 1
11 4078 1 1 13 TRP HE3 H -7.593 3.577 -0.802 1.00 . A A . 21 TRP HE3 1 1
11 4079 1 1 13 TRP HH2 H -10.267 1.538 1.879 1.00 . A A . 21 TRP HH2 1 1
11 4080 1 1 13 TRP HZ2 H -9.168 -0.621 1.341 1.00 . A A . 21 TRP HZ2 1 1
11 4081 1 1 13 TRP HZ3 H -9.476 3.630 0.806 1.00 . A A . 21 TRP HZ3 1 1
11 4082 1 1 13 TRP N N -5.806 0.848 -4.533 1.00 . A A . 21 TRP N 1 1
11 4083 1 1 13 TRP NE1 N -6.962 -0.737 -0.533 1.00 . A A . 21 TRP NE1 1 1
11 4084 1 1 13 TRP O O -5.026 3.132 -5.724 1.00 . A A . 21 TRP O 1 1
11 4085 1 1 14 THR C C -3.225 5.544 -4.505 1.00 . A A . 22 THR C 1 1
11 4086 1 1 14 THR CA C -4.749 5.603 -4.520 1.00 . A A . 22 THR CA 1 1
11 4087 1 1 14 THR CB C -5.218 6.856 -3.777 1.00 . A A . 22 THR CB 1 1
11 4088 1 1 14 THR CG2 C -6.744 6.931 -3.812 1.00 . A A . 22 THR CG2 1 1
11 4089 1 1 14 THR H H -5.632 4.459 -2.969 1.00 . A A . 22 THR H 1 1
11 4090 1 1 14 THR HA H -5.087 5.659 -5.544 1.00 . A A . 22 THR HA 1 1
11 4091 1 1 14 THR HB H -4.808 7.733 -4.254 1.00 . A A . 22 THR HB 1 1
11 4092 1 1 14 THR HG1 H -4.654 5.874 -2.197 1.00 . A A . 22 THR HG1 1 1
11 4093 1 1 14 THR HG21 H -7.065 7.903 -3.473 1.00 . A A . 22 THR HG21 1 1
11 4094 1 1 14 THR HG22 H -7.156 6.169 -3.167 1.00 . A A . 22 THR HG22 1 1
11 4095 1 1 14 THR HG23 H -7.088 6.771 -4.824 1.00 . A A . 22 THR HG23 1 1
11 4096 1 1 14 THR N N -5.314 4.412 -3.896 1.00 . A A . 22 THR N 1 1
11 4097 1 1 14 THR O O -2.575 5.747 -5.531 1.00 . A A . 22 THR O 1 1
11 4098 1 1 14 THR OG1 O -4.774 6.797 -2.428 1.00 . A A . 22 THR OG1 1 1
11 4099 1 1 15 THR C C -0.628 4.201 -4.207 1.00 . A A . 23 THR C 1 1
11 4100 1 1 15 THR CA C -1.210 5.186 -3.196 1.00 . A A . 23 THR CA 1 1
11 4101 1 1 15 THR CB C -0.833 4.750 -1.772 1.00 . A A . 23 THR CB 1 1
11 4102 1 1 15 THR CG2 C -1.933 3.859 -1.194 1.00 . A A . 23 THR CG2 1 1
11 4103 1 1 15 THR H H -3.228 5.117 -2.550 1.00 . A A . 23 THR H 1 1
11 4104 1 1 15 THR HA H -0.791 6.162 -3.383 1.00 . A A . 23 THR HA 1 1
11 4105 1 1 15 THR HB H -0.719 5.622 -1.143 1.00 . A A . 23 THR HB 1 1
11 4106 1 1 15 THR HG1 H 0.712 3.948 -0.904 1.00 . A A . 23 THR HG1 1 1
11 4107 1 1 15 THR HG21 H -2.272 3.168 -1.950 1.00 . A A . 23 THR HG21 1 1
11 4108 1 1 15 THR HG22 H -2.759 4.473 -0.871 1.00 . A A . 23 THR HG22 1 1
11 4109 1 1 15 THR HG23 H -1.542 3.307 -0.352 1.00 . A A . 23 THR HG23 1 1
11 4110 1 1 15 THR N N -2.661 5.267 -3.334 1.00 . A A . 23 THR N 1 1
11 4111 1 1 15 THR O O 0.590 4.086 -4.341 1.00 . A A . 23 THR O 1 1
11 4112 1 1 15 THR OG1 O 0.391 4.030 -1.805 1.00 . A A . 23 THR OG1 1 1
11 4113 1 1 16 ARG C C -1.938 2.613 -7.177 1.00 . A A . 24 ARG C 1 1
11 4114 1 1 16 ARG CA C -1.069 2.517 -5.923 1.00 . A A . 24 ARG CA 1 1
11 4115 1 1 16 ARG CB C -1.146 1.100 -5.341 1.00 . A A . 24 ARG CB 1 1
11 4116 1 1 16 ARG CD C -2.695 -0.521 -4.234 1.00 . A A . 24 ARG CD 1 1
11 4117 1 1 16 ARG CG C -2.420 0.959 -4.506 1.00 . A A . 24 ARG CG 1 1
11 4118 1 1 16 ARG CZ C -1.755 -2.299 -2.871 1.00 . A A . 24 ARG CZ 1 1
11 4119 1 1 16 ARG H H -2.466 3.629 -4.768 1.00 . A A . 24 ARG H 1 1
11 4120 1 1 16 ARG HA H -0.043 2.723 -6.200 1.00 . A A . 24 ARG HA 1 1
11 4121 1 1 16 ARG HB2 H -1.156 0.375 -6.144 1.00 . A A . 24 ARG HB2 1 1
11 4122 1 1 16 ARG HB3 H -0.286 0.925 -4.710 1.00 . A A . 24 ARG HB3 1 1
11 4123 1 1 16 ARG HD2 H -3.640 -0.622 -3.722 1.00 . A A . 24 ARG HD2 1 1
11 4124 1 1 16 ARG HD3 H -2.740 -1.055 -5.173 1.00 . A A . 24 ARG HD3 1 1
11 4125 1 1 16 ARG HE H -0.826 -0.564 -3.236 1.00 . A A . 24 ARG HE 1 1
11 4126 1 1 16 ARG HG2 H -2.292 1.479 -3.568 1.00 . A A . 24 ARG HG2 1 1
11 4127 1 1 16 ARG HG3 H -3.254 1.386 -5.042 1.00 . A A . 24 ARG HG3 1 1
11 4128 1 1 16 ARG HH11 H -3.565 -2.636 -3.657 1.00 . A A . 24 ARG HH11 1 1
11 4129 1 1 16 ARG HH12 H -2.918 -3.918 -2.689 1.00 . A A . 24 ARG HH12 1 1
11 4130 1 1 16 ARG HH21 H 0.029 -2.241 -1.965 1.00 . A A . 24 ARG HH21 1 1
11 4131 1 1 16 ARG HH22 H -0.883 -3.695 -1.731 1.00 . A A . 24 ARG HH22 1 1
11 4132 1 1 16 ARG N N -1.506 3.493 -4.919 1.00 . A A . 24 ARG N 1 1
11 4133 1 1 16 ARG NE N -1.637 -1.087 -3.404 1.00 . A A . 24 ARG NE 1 1
11 4134 1 1 16 ARG NH1 N -2.830 -3.007 -3.089 1.00 . A A . 24 ARG NH1 1 1
11 4135 1 1 16 ARG NH2 N -0.795 -2.783 -2.132 1.00 . A A . 24 ARG NH2 1 1
11 4136 1 1 16 ARG O O -2.460 1.609 -7.660 1.00 . A A . 24 ARG O 1 1
11 4137 1 1 17 CYS C C -1.973 4.284 -10.120 1.00 . A A . 25 CYS C 1 1
11 4138 1 1 17 CYS CA C -2.885 4.057 -8.906 1.00 . A A . 25 CYS CA 1 1
11 4139 1 1 17 CYS CB C -3.764 5.295 -8.717 1.00 . A A . 25 CYS CB 1 1
11 4140 1 1 17 CYS H H -1.638 4.592 -7.272 1.00 . A A . 25 CYS H 1 1
11 4141 1 1 17 CYS HA H -3.527 3.210 -9.075 1.00 . A A . 25 CYS HA 1 1
11 4142 1 1 17 CYS HB2 H -4.454 5.128 -7.905 1.00 . A A . 25 CYS HB2 1 1
11 4143 1 1 17 CYS HB3 H -3.143 6.149 -8.492 1.00 . A A . 25 CYS HB3 1 1
11 4144 1 1 17 CYS N N -2.083 3.831 -7.702 1.00 . A A . 25 CYS N 1 1
11 4145 1 1 17 CYS O O -1.374 5.352 -10.242 1.00 . A A . 25 CYS O 1 1
11 4146 1 1 17 CYS SG S -4.688 5.608 -10.243 1.00 . A A . 25 CYS SG 1 1
11 4147 1 1 18 PRO C C -1.662 4.298 -13.316 1.00 . A A . 26 PRO C 1 1
11 4148 1 1 18 PRO CA C -0.970 3.493 -12.216 1.00 . A A . 26 PRO CA 1 1
11 4149 1 1 18 PRO CB C -0.697 2.051 -12.654 1.00 . A A . 26 PRO CB 1 1
11 4150 1 1 18 PRO CD C -2.492 2.001 -11.008 1.00 . A A . 26 PRO CD 1 1
11 4151 1 1 18 PRO CG C -1.921 1.288 -12.247 1.00 . A A . 26 PRO CG 1 1
11 4152 1 1 18 PRO HA H -0.043 3.969 -11.937 1.00 . A A . 26 PRO HA 1 1
11 4153 1 1 18 PRO HB2 H -0.551 2.001 -13.727 1.00 . A A . 26 PRO HB2 1 1
11 4154 1 1 18 PRO HB3 H 0.170 1.662 -12.140 1.00 . A A . 26 PRO HB3 1 1
11 4155 1 1 18 PRO HD2 H -3.567 2.101 -11.096 1.00 . A A . 26 PRO HD2 1 1
11 4156 1 1 18 PRO HD3 H -2.233 1.468 -10.105 1.00 . A A . 26 PRO HD3 1 1
11 4157 1 1 18 PRO HG2 H -2.645 1.297 -13.053 1.00 . A A . 26 PRO HG2 1 1
11 4158 1 1 18 PRO HG3 H -1.662 0.270 -11.997 1.00 . A A . 26 PRO HG3 1 1
11 4159 1 1 18 PRO N N -1.842 3.329 -11.019 1.00 . A A . 26 PRO N 1 1
11 4160 1 1 18 PRO O O -1.490 4.023 -14.504 1.00 . A A . 26 PRO O 1 1
11 4161 1 1 19 TYR C C -3.337 7.549 -13.278 1.00 . A A . 27 TYR C 1 1
11 4162 1 1 19 TYR CA C -3.158 6.149 -13.855 1.00 . A A . 27 TYR CA 1 1
11 4163 1 1 19 TYR CB C -4.532 5.555 -14.172 1.00 . A A . 27 TYR CB 1 1
11 4164 1 1 19 TYR CD1 C -3.698 3.936 -15.920 1.00 . A A . 27 TYR CD1 1 1
11 4165 1 1 19 TYR CD2 C -4.906 3.060 -14.007 1.00 . A A . 27 TYR CD2 1 1
11 4166 1 1 19 TYR CE1 C -3.554 2.638 -16.422 1.00 . A A . 27 TYR CE1 1 1
11 4167 1 1 19 TYR CE2 C -4.761 1.763 -14.511 1.00 . A A . 27 TYR CE2 1 1
11 4168 1 1 19 TYR CG C -4.374 4.149 -14.711 1.00 . A A . 27 TYR CG 1 1
11 4169 1 1 19 TYR CZ C -4.086 1.551 -15.718 1.00 . A A . 27 TYR CZ 1 1
11 4170 1 1 19 TYR H H -2.536 5.467 -11.947 1.00 . A A . 27 TYR H 1 1
11 4171 1 1 19 TYR HA H -2.588 6.220 -14.771 1.00 . A A . 27 TYR HA 1 1
11 4172 1 1 19 TYR HB2 H -5.129 5.534 -13.271 1.00 . A A . 27 TYR HB2 1 1
11 4173 1 1 19 TYR HB3 H -5.023 6.169 -14.911 1.00 . A A . 27 TYR HB3 1 1
11 4174 1 1 19 TYR HD1 H -3.289 4.773 -16.465 1.00 . A A . 27 TYR HD1 1 1
11 4175 1 1 19 TYR HD2 H -5.428 3.221 -13.075 1.00 . A A . 27 TYR HD2 1 1
11 4176 1 1 19 TYR HE1 H -3.032 2.474 -17.354 1.00 . A A . 27 TYR HE1 1 1
11 4177 1 1 19 TYR HE2 H -5.172 0.924 -13.968 1.00 . A A . 27 TYR HE2 1 1
11 4178 1 1 19 TYR HH H -3.097 -0.070 -15.916 1.00 . A A . 27 TYR HH 1 1
11 4179 1 1 19 TYR N N -2.443 5.296 -12.906 1.00 . A A . 27 TYR N 1 1
11 4180 1 1 19 TYR O O -4.260 8.272 -13.653 1.00 . A A . 27 TYR O 1 1
11 4181 1 1 19 TYR OH O -3.943 0.271 -16.214 1.00 . A A . 27 TYR OH 1 1
11 4182 1 1 20 LYS C C -2.139 10.335 -12.738 1.00 . A A . 28 LYS C 1 1
11 4183 1 1 20 LYS CA C -2.520 9.243 -11.741 1.00 . A A . 28 LYS CA 1 1
11 4184 1 1 20 LYS CB C -1.596 9.304 -10.510 1.00 . A A . 28 LYS CB 1 1
11 4185 1 1 20 LYS CD C 0.348 8.987 -12.075 1.00 . A A . 28 LYS CD 1 1
11 4186 1 1 20 LYS CE C 1.784 8.462 -12.142 1.00 . A A . 28 LYS CE 1 1
11 4187 1 1 20 LYS CG C -0.302 8.521 -10.768 1.00 . A A . 28 LYS CG 1 1
11 4188 1 1 20 LYS H H -1.738 7.306 -12.105 1.00 . A A . 28 LYS H 1 1
11 4189 1 1 20 LYS HA H -3.535 9.415 -11.421 1.00 . A A . 28 LYS HA 1 1
11 4190 1 1 20 LYS HB2 H -1.353 10.333 -10.288 1.00 . A A . 28 LYS HB2 1 1
11 4191 1 1 20 LYS HB3 H -2.106 8.871 -9.661 1.00 . A A . 28 LYS HB3 1 1
11 4192 1 1 20 LYS HD2 H -0.212 8.605 -12.915 1.00 . A A . 28 LYS HD2 1 1
11 4193 1 1 20 LYS HD3 H 0.362 10.065 -12.107 1.00 . A A . 28 LYS HD3 1 1
11 4194 1 1 20 LYS HE2 H 1.799 7.416 -11.878 1.00 . A A . 28 LYS HE2 1 1
11 4195 1 1 20 LYS HE3 H 2.165 8.584 -13.146 1.00 . A A . 28 LYS HE3 1 1
11 4196 1 1 20 LYS HG2 H 0.383 8.687 -9.950 1.00 . A A . 28 LYS HG2 1 1
11 4197 1 1 20 LYS HG3 H -0.525 7.468 -10.835 1.00 . A A . 28 LYS HG3 1 1
11 4198 1 1 20 LYS HZ1 H 2.042 9.646 -10.448 1.00 . A A . 28 LYS HZ1 1 1
11 4199 1 1 20 LYS HZ2 H 3.137 9.984 -11.703 1.00 . A A . 28 LYS HZ2 1 1
11 4200 1 1 20 LYS HZ3 H 3.331 8.588 -10.754 1.00 . A A . 28 LYS HZ3 1 1
11 4201 1 1 20 LYS N N -2.449 7.925 -12.365 1.00 . A A . 28 LYS N 1 1
11 4202 1 1 20 LYS NZ N 2.638 9.228 -11.190 1.00 . A A . 28 LYS NZ 1 1
11 4203 1 1 20 LYS O O -1.832 11.463 -12.351 1.00 . A A . 28 LYS O 1 1
11 4204 1 1 21 ASP C C -2.707 12.165 -15.001 1.00 . A A . 29 ASP C 1 1
11 4205 1 1 21 ASP CA C -1.815 10.929 -15.063 1.00 . A A . 29 ASP CA 1 1
11 4206 1 1 21 ASP CB C -1.953 10.218 -16.412 1.00 . A A . 29 ASP CB 1 1
11 4207 1 1 21 ASP CG C -3.407 10.204 -16.883 1.00 . A A . 29 ASP CG 1 1
11 4208 1 1 21 ASP H H -2.403 9.083 -14.271 1.00 . A A . 29 ASP H 1 1
11 4209 1 1 21 ASP HA H -0.795 11.236 -14.929 1.00 . A A . 29 ASP HA 1 1
11 4210 1 1 21 ASP HB2 H -1.347 10.718 -17.135 1.00 . A A . 29 ASP HB2 1 1
11 4211 1 1 21 ASP HB3 H -1.609 9.202 -16.304 1.00 . A A . 29 ASP HB3 1 1
11 4212 1 1 21 ASP N N -2.158 9.990 -14.018 1.00 . A A . 29 ASP N 1 1
11 4213 1 1 21 ASP O O -2.525 13.121 -15.753 1.00 . A A . 29 ASP O 1 1
11 4214 1 1 21 ASP OD1 O -4.261 9.836 -16.093 1.00 . A A . 29 ASP OD1 1 1
11 4215 1 1 21 ASP OD2 O -3.643 10.559 -18.026 1.00 . A A . 29 ASP OD2 1 1
11 4216 1 1 22 THR C C -3.963 14.336 -13.075 1.00 . A A . 30 THR C 1 1
11 4217 1 1 22 THR CA C -4.598 13.235 -13.919 1.00 . A A . 30 THR CA 1 1
11 4218 1 1 22 THR CB C -5.875 12.740 -13.237 1.00 . A A . 30 THR CB 1 1
11 4219 1 1 22 THR CG2 C -6.385 11.488 -13.952 1.00 . A A . 30 THR CG2 1 1
11 4220 1 1 22 THR H H -3.749 11.330 -13.533 1.00 . A A . 30 THR H 1 1
11 4221 1 1 22 THR HA H -4.854 13.637 -14.887 1.00 . A A . 30 THR HA 1 1
11 4222 1 1 22 THR HB H -6.630 13.509 -13.285 1.00 . A A . 30 THR HB 1 1
11 4223 1 1 22 THR HG1 H -5.165 11.576 -11.850 1.00 . A A . 30 THR HG1 1 1
11 4224 1 1 22 THR HG21 H -7.286 11.139 -13.468 1.00 . A A . 30 THR HG21 1 1
11 4225 1 1 22 THR HG22 H -5.631 10.716 -13.909 1.00 . A A . 30 THR HG22 1 1
11 4226 1 1 22 THR HG23 H -6.601 11.724 -14.983 1.00 . A A . 30 THR HG23 1 1
11 4227 1 1 22 THR N N -3.667 12.125 -14.095 1.00 . A A . 30 THR N 1 1
11 4228 1 1 22 THR O O -3.652 15.414 -13.580 1.00 . A A . 30 THR O 1 1
11 4229 1 1 22 THR OG1 O -5.597 12.433 -11.879 1.00 . A A . 30 THR OG1 1 1
11 4230 1 1 23 LEU C C -4.012 16.302 -10.834 1.00 . A A . 31 LEU C 1 1
11 4231 1 1 23 LEU CA C -3.176 15.025 -10.881 1.00 . A A . 31 LEU CA 1 1
11 4232 1 1 23 LEU CB C -1.749 15.359 -11.336 1.00 . A A . 31 LEU CB 1 1
11 4233 1 1 23 LEU CD1 C -0.411 15.190 -9.195 1.00 . A A . 31 LEU CD1 1 1
11 4234 1 1 23 LEU CD2 C 0.129 16.963 -10.865 1.00 . A A . 31 LEU CD2 1 1
11 4235 1 1 23 LEU CG C -1.007 16.149 -10.235 1.00 . A A . 31 LEU CG 1 1
11 4236 1 1 23 LEU H H -4.043 13.176 -11.446 1.00 . A A . 31 LEU H 1 1
11 4237 1 1 23 LEU HA H -3.137 14.598 -9.892 1.00 . A A . 31 LEU HA 1 1
11 4238 1 1 23 LEU HB2 H -1.219 14.441 -11.548 1.00 . A A . 31 LEU HB2 1 1
11 4239 1 1 23 LEU HB3 H -1.798 15.956 -12.235 1.00 . A A . 31 LEU HB3 1 1
11 4240 1 1 23 LEU HD11 H 0.173 14.431 -9.694 1.00 . A A . 31 LEU HD11 1 1
11 4241 1 1 23 LEU HD12 H -1.205 14.722 -8.634 1.00 . A A . 31 LEU HD12 1 1
11 4242 1 1 23 LEU HD13 H 0.223 15.745 -8.521 1.00 . A A . 31 LEU HD13 1 1
11 4243 1 1 23 LEU HD21 H -0.285 17.706 -11.530 1.00 . A A . 31 LEU HD21 1 1
11 4244 1 1 23 LEU HD22 H 0.778 16.304 -11.422 1.00 . A A . 31 LEU HD22 1 1
11 4245 1 1 23 LEU HD23 H 0.695 17.452 -10.086 1.00 . A A . 31 LEU HD23 1 1
11 4246 1 1 23 LEU HG H -1.698 16.821 -9.745 1.00 . A A . 31 LEU HG 1 1
11 4247 1 1 23 LEU N N -3.775 14.054 -11.790 1.00 . A A . 31 LEU N 1 1
11 4248 1 1 23 LEU O O -4.739 16.542 -9.870 1.00 . A A . 31 LEU O 1 1
11 4249 1 1 24 GLY C C -4.172 19.232 -13.098 1.00 . A A . 32 GLY C 1 1
11 4250 1 1 24 GLY CA C -4.656 18.363 -11.943 1.00 . A A . 32 GLY CA 1 1
11 4251 1 1 24 GLY H H -3.310 16.873 -12.619 1.00 . A A . 32 GLY H 1 1
11 4252 1 1 24 GLY HA2 H -5.704 18.138 -12.082 1.00 . A A . 32 GLY HA2 1 1
11 4253 1 1 24 GLY HA3 H -4.527 18.903 -11.018 1.00 . A A . 32 GLY HA3 1 1
11 4254 1 1 24 GLY N N -3.904 17.115 -11.879 1.00 . A A . 32 GLY N 1 1
11 4255 1 1 24 GLY O O -4.733 19.118 -14.176 1.00 . A A . 32 GLY O 1 1
11 4256 1 1 24 GLY OXT O -3.246 20.000 -12.890 1.00 . A A . 32 GLY OXT 1 1
11 4257 2 2 1 ZN ZN ZN -6.357 3.821 -10.108 1.00 . B A . 300 ZN ZN 1 1
12 4258 1 1 1 LYS C C -11.092 -4.204 0.868 1.00 . A A . 9 LYS C 1 1
12 4259 1 1 1 LYS CA C -10.238 -5.233 1.603 1.00 . A A . 9 LYS CA 1 1
12 4260 1 1 1 LYS CB C -10.102 -6.499 0.756 1.00 . A A . 9 LYS CB 1 1
12 4261 1 1 1 LYS CD C -8.968 -8.718 0.573 1.00 . A A . 9 LYS CD 1 1
12 4262 1 1 1 LYS CE C -8.189 -9.782 1.347 1.00 . A A . 9 LYS CE 1 1
12 4263 1 1 1 LYS CG C -9.163 -7.484 1.455 1.00 . A A . 9 LYS CG 1 1
12 4264 1 1 1 LYS H1 H -10.217 -6.109 3.491 1.00 . A A . 9 LYS H1 1 1
12 4265 1 1 1 LYS H2 H -11.732 -6.151 2.726 1.00 . A A . 9 LYS H2 1 1
12 4266 1 1 1 LYS H3 H -11.155 -4.700 3.396 1.00 . A A . 9 LYS H3 1 1
12 4267 1 1 1 LYS HA H -9.258 -4.818 1.789 1.00 . A A . 9 LYS HA 1 1
12 4268 1 1 1 LYS HB2 H -11.075 -6.955 0.631 1.00 . A A . 9 LYS HB2 1 1
12 4269 1 1 1 LYS HB3 H -9.697 -6.243 -0.211 1.00 . A A . 9 LYS HB3 1 1
12 4270 1 1 1 LYS HD2 H -9.932 -9.113 0.287 1.00 . A A . 9 LYS HD2 1 1
12 4271 1 1 1 LYS HD3 H -8.415 -8.444 -0.313 1.00 . A A . 9 LYS HD3 1 1
12 4272 1 1 1 LYS HE2 H -8.699 -9.997 2.275 1.00 . A A . 9 LYS HE2 1 1
12 4273 1 1 1 LYS HE3 H -8.125 -10.684 0.755 1.00 . A A . 9 LYS HE3 1 1
12 4274 1 1 1 LYS HG2 H -8.208 -7.009 1.628 1.00 . A A . 9 LYS HG2 1 1
12 4275 1 1 1 LYS HG3 H -9.593 -7.783 2.399 1.00 . A A . 9 LYS HG3 1 1
12 4276 1 1 1 LYS HZ1 H -6.147 -10.075 1.628 1.00 . A A . 9 LYS HZ1 1 1
12 4277 1 1 1 LYS HZ2 H -6.805 -8.829 2.575 1.00 . A A . 9 LYS HZ2 1 1
12 4278 1 1 1 LYS HZ3 H -6.540 -8.587 0.915 1.00 . A A . 9 LYS HZ3 1 1
12 4279 1 1 1 LYS N N -10.884 -5.574 2.902 1.00 . A A . 9 LYS N 1 1
12 4280 1 1 1 LYS NZ N -6.817 -9.281 1.638 1.00 . A A . 9 LYS NZ 1 1
12 4281 1 1 1 LYS O O -11.427 -4.384 -0.303 1.00 . A A . 9 LYS O 1 1
12 4282 1 1 2 ILE C C -11.413 -1.204 0.042 1.00 . A A . 10 ILE C 1 1
12 4283 1 1 2 ILE CA C -12.258 -2.077 0.965 1.00 . A A . 10 ILE CA 1 1
12 4284 1 1 2 ILE CB C -12.883 -1.211 2.065 1.00 . A A . 10 ILE CB 1 1
12 4285 1 1 2 ILE CD1 C -14.292 -3.214 2.625 1.00 . A A . 10 ILE CD1 1 1
12 4286 1 1 2 ILE CG1 C -13.400 -2.108 3.198 1.00 . A A . 10 ILE CG1 1 1
12 4287 1 1 2 ILE CG2 C -14.045 -0.399 1.488 1.00 . A A . 10 ILE CG2 1 1
12 4288 1 1 2 ILE H H -11.147 -3.038 2.494 1.00 . A A . 10 ILE H 1 1
12 4289 1 1 2 ILE HA H -13.048 -2.534 0.388 1.00 . A A . 10 ILE HA 1 1
12 4290 1 1 2 ILE HB H -12.136 -0.535 2.457 1.00 . A A . 10 ILE HB 1 1
12 4291 1 1 2 ILE HD11 H -13.678 -3.959 2.142 1.00 . A A . 10 ILE HD11 1 1
12 4292 1 1 2 ILE HD12 H -14.978 -2.791 1.906 1.00 . A A . 10 ILE HD12 1 1
12 4293 1 1 2 ILE HD13 H -14.852 -3.675 3.426 1.00 . A A . 10 ILE HD13 1 1
12 4294 1 1 2 ILE HG12 H -12.561 -2.555 3.711 1.00 . A A . 10 ILE HG12 1 1
12 4295 1 1 2 ILE HG13 H -13.971 -1.514 3.894 1.00 . A A . 10 ILE HG13 1 1
12 4296 1 1 2 ILE HG21 H -13.671 0.282 0.738 1.00 . A A . 10 ILE HG21 1 1
12 4297 1 1 2 ILE HG22 H -14.521 0.161 2.278 1.00 . A A . 10 ILE HG22 1 1
12 4298 1 1 2 ILE HG23 H -14.764 -1.069 1.038 1.00 . A A . 10 ILE HG23 1 1
12 4299 1 1 2 ILE N N -11.442 -3.127 1.564 1.00 . A A . 10 ILE N 1 1
12 4300 1 1 2 ILE O O -11.401 0.020 0.167 1.00 . A A . 10 ILE O 1 1
12 4301 1 1 3 VAL C C -10.687 -0.533 -2.954 1.00 . A A . 11 VAL C 1 1
12 4302 1 1 3 VAL CA C -9.861 -1.116 -1.827 1.00 . A A . 11 VAL CA 1 1
12 4303 1 1 3 VAL CB C -8.787 -2.039 -2.402 1.00 . A A . 11 VAL CB 1 1
12 4304 1 1 3 VAL CG1 C -9.445 -3.239 -3.084 1.00 . A A . 11 VAL CG1 1 1
12 4305 1 1 3 VAL CG2 C -7.949 -1.269 -3.427 1.00 . A A . 11 VAL CG2 1 1
12 4306 1 1 3 VAL H H -10.755 -2.820 -0.937 1.00 . A A . 11 VAL H 1 1
12 4307 1 1 3 VAL HA H -9.375 -0.302 -1.312 1.00 . A A . 11 VAL HA 1 1
12 4308 1 1 3 VAL HB H -8.149 -2.382 -1.603 1.00 . A A . 11 VAL HB 1 1
12 4309 1 1 3 VAL HG11 H -10.201 -3.655 -2.435 1.00 . A A . 11 VAL HG11 1 1
12 4310 1 1 3 VAL HG12 H -8.698 -3.990 -3.292 1.00 . A A . 11 VAL HG12 1 1
12 4311 1 1 3 VAL HG13 H -9.903 -2.921 -4.010 1.00 . A A . 11 VAL HG13 1 1
12 4312 1 1 3 VAL HG21 H -7.054 -1.828 -3.653 1.00 . A A . 11 VAL HG21 1 1
12 4313 1 1 3 VAL HG22 H -7.679 -0.305 -3.020 1.00 . A A . 11 VAL HG22 1 1
12 4314 1 1 3 VAL HG23 H -8.525 -1.130 -4.330 1.00 . A A . 11 VAL HG23 1 1
12 4315 1 1 3 VAL N N -10.706 -1.844 -0.885 1.00 . A A . 11 VAL N 1 1
12 4316 1 1 3 VAL O O -11.485 -1.224 -3.589 1.00 . A A . 11 VAL O 1 1
12 4317 1 1 4 SER C C -10.447 2.711 -4.649 1.00 . A A . 12 SER C 1 1
12 4318 1 1 4 SER CA C -11.188 1.446 -4.256 1.00 . A A . 12 SER CA 1 1
12 4319 1 1 4 SER CB C -12.600 1.806 -3.813 1.00 . A A . 12 SER CB 1 1
12 4320 1 1 4 SER H H -9.821 1.236 -2.658 1.00 . A A . 12 SER H 1 1
12 4321 1 1 4 SER HA H -11.250 0.799 -5.119 1.00 . A A . 12 SER HA 1 1
12 4322 1 1 4 SER HB2 H -12.560 2.587 -3.074 1.00 . A A . 12 SER HB2 1 1
12 4323 1 1 4 SER HB3 H -13.157 2.154 -4.673 1.00 . A A . 12 SER HB3 1 1
12 4324 1 1 4 SER HG H -13.039 -0.090 -3.825 1.00 . A A . 12 SER HG 1 1
12 4325 1 1 4 SER N N -10.477 0.751 -3.199 1.00 . A A . 12 SER N 1 1
12 4326 1 1 4 SER O O -10.216 3.600 -3.830 1.00 . A A . 12 SER O 1 1
12 4327 1 1 4 SER OG O -13.228 0.659 -3.255 1.00 . A A . 12 SER OG 1 1
12 4328 1 1 5 CYS C C -10.339 5.074 -6.709 1.00 . A A . 13 CYS C 1 1
12 4329 1 1 5 CYS CA C -9.368 3.925 -6.448 1.00 . A A . 13 CYS CA 1 1
12 4330 1 1 5 CYS CB C -8.660 3.527 -7.746 1.00 . A A . 13 CYS CB 1 1
12 4331 1 1 5 CYS H H -10.308 2.028 -6.503 1.00 . A A . 13 CYS H 1 1
12 4332 1 1 5 CYS HA H -8.628 4.244 -5.731 1.00 . A A . 13 CYS HA 1 1
12 4333 1 1 5 CYS HB2 H -7.893 2.802 -7.526 1.00 . A A . 13 CYS HB2 1 1
12 4334 1 1 5 CYS HB3 H -9.373 3.094 -8.428 1.00 . A A . 13 CYS HB3 1 1
12 4335 1 1 5 CYS N N -10.085 2.775 -5.914 1.00 . A A . 13 CYS N 1 1
12 4336 1 1 5 CYS O O -11.540 4.854 -6.866 1.00 . A A . 13 CYS O 1 1
12 4337 1 1 5 CYS SG S -7.905 4.982 -8.509 1.00 . A A . 13 CYS SG 1 1
12 4338 1 1 6 ARG C C -10.331 8.119 -8.332 1.00 . A A . 14 ARG C 1 1
12 4339 1 1 6 ARG CA C -10.662 7.487 -6.985 1.00 . A A . 14 ARG CA 1 1
12 4340 1 1 6 ARG CB C -10.456 8.515 -5.864 1.00 . A A . 14 ARG CB 1 1
12 4341 1 1 6 ARG CD C -8.783 9.995 -4.729 1.00 . A A . 14 ARG CD 1 1
12 4342 1 1 6 ARG CG C -9.067 9.156 -5.978 1.00 . A A . 14 ARG CG 1 1
12 4343 1 1 6 ARG CZ C -9.816 11.896 -3.626 1.00 . A A . 14 ARG CZ 1 1
12 4344 1 1 6 ARG H H -8.852 6.421 -6.613 1.00 . A A . 14 ARG H 1 1
12 4345 1 1 6 ARG HA H -11.703 7.192 -6.992 1.00 . A A . 14 ARG HA 1 1
12 4346 1 1 6 ARG HB2 H -11.212 9.283 -5.940 1.00 . A A . 14 ARG HB2 1 1
12 4347 1 1 6 ARG HB3 H -10.544 8.021 -4.908 1.00 . A A . 14 ARG HB3 1 1
12 4348 1 1 6 ARG HD2 H -9.016 9.420 -3.846 1.00 . A A . 14 ARG HD2 1 1
12 4349 1 1 6 ARG HD3 H -7.736 10.264 -4.711 1.00 . A A . 14 ARG HD3 1 1
12 4350 1 1 6 ARG HE H -9.980 11.520 -5.585 1.00 . A A . 14 ARG HE 1 1
12 4351 1 1 6 ARG HG2 H -8.320 8.383 -6.072 1.00 . A A . 14 ARG HG2 1 1
12 4352 1 1 6 ARG HG3 H -9.034 9.795 -6.847 1.00 . A A . 14 ARG HG3 1 1
12 4353 1 1 6 ARG HH11 H -8.749 10.662 -2.468 1.00 . A A . 14 ARG HH11 1 1
12 4354 1 1 6 ARG HH12 H -9.475 12.009 -1.656 1.00 . A A . 14 ARG HH12 1 1
12 4355 1 1 6 ARG HH21 H -10.938 13.288 -4.529 1.00 . A A . 14 ARG HH21 1 1
12 4356 1 1 6 ARG HH22 H -10.714 13.496 -2.823 1.00 . A A . 14 ARG HH22 1 1
12 4357 1 1 6 ARG N N -9.819 6.305 -6.748 1.00 . A A . 14 ARG N 1 1
12 4358 1 1 6 ARG NE N -9.594 11.208 -4.741 1.00 . A A . 14 ARG NE 1 1
12 4359 1 1 6 ARG NH1 N -9.308 11.491 -2.496 1.00 . A A . 14 ARG NH1 1 1
12 4360 1 1 6 ARG NH2 N -10.546 12.978 -3.663 1.00 . A A . 14 ARG NH2 1 1
12 4361 1 1 6 ARG O O -11.045 9.001 -8.809 1.00 . A A . 14 ARG O 1 1
12 4362 1 1 7 ILE C C -9.447 7.388 -11.362 1.00 . A A . 15 ILE C 1 1
12 4363 1 1 7 ILE CA C -8.810 8.184 -10.229 1.00 . A A . 15 ILE CA 1 1
12 4364 1 1 7 ILE CB C -7.286 8.094 -10.340 1.00 . A A . 15 ILE CB 1 1
12 4365 1 1 7 ILE CD1 C -5.170 8.431 -9.052 1.00 . A A . 15 ILE CD1 1 1
12 4366 1 1 7 ILE CG1 C -6.639 8.840 -9.166 1.00 . A A . 15 ILE CG1 1 1
12 4367 1 1 7 ILE CG2 C -6.831 8.725 -11.656 1.00 . A A . 15 ILE CG2 1 1
12 4368 1 1 7 ILE H H -8.713 6.961 -8.503 1.00 . A A . 15 ILE H 1 1
12 4369 1 1 7 ILE HA H -9.105 9.220 -10.316 1.00 . A A . 15 ILE HA 1 1
12 4370 1 1 7 ILE HB H -6.986 7.056 -10.317 1.00 . A A . 15 ILE HB 1 1
12 4371 1 1 7 ILE HD11 H -4.727 8.917 -8.195 1.00 . A A . 15 ILE HD11 1 1
12 4372 1 1 7 ILE HD12 H -4.643 8.728 -9.946 1.00 . A A . 15 ILE HD12 1 1
12 4373 1 1 7 ILE HD13 H -5.103 7.359 -8.934 1.00 . A A . 15 ILE HD13 1 1
12 4374 1 1 7 ILE HG12 H -6.706 9.905 -9.334 1.00 . A A . 15 ILE HG12 1 1
12 4375 1 1 7 ILE HG13 H -7.151 8.588 -8.249 1.00 . A A . 15 ILE HG13 1 1
12 4376 1 1 7 ILE HG21 H -7.343 9.666 -11.801 1.00 . A A . 15 ILE HG21 1 1
12 4377 1 1 7 ILE HG22 H -7.063 8.059 -12.473 1.00 . A A . 15 ILE HG22 1 1
12 4378 1 1 7 ILE HG23 H -5.766 8.897 -11.623 1.00 . A A . 15 ILE HG23 1 1
12 4379 1 1 7 ILE N N -9.241 7.662 -8.937 1.00 . A A . 15 ILE N 1 1
12 4380 1 1 7 ILE O O -9.780 7.940 -12.411 1.00 . A A . 15 ILE O 1 1
12 4381 1 1 8 CYS C C -11.146 4.183 -11.514 1.00 . A A . 16 CYS C 1 1
12 4382 1 1 8 CYS CA C -10.201 5.203 -12.154 1.00 . A A . 16 CYS CA 1 1
12 4383 1 1 8 CYS CB C -9.089 4.478 -12.911 1.00 . A A . 16 CYS CB 1 1
12 4384 1 1 8 CYS H H -9.316 5.703 -10.294 1.00 . A A . 16 CYS H 1 1
12 4385 1 1 8 CYS HA H -10.766 5.798 -12.859 1.00 . A A . 16 CYS HA 1 1
12 4386 1 1 8 CYS HB2 H -9.490 4.046 -13.816 1.00 . A A . 16 CYS HB2 1 1
12 4387 1 1 8 CYS HB3 H -8.312 5.183 -13.162 1.00 . A A . 16 CYS HB3 1 1
12 4388 1 1 8 CYS N N -9.608 6.083 -11.144 1.00 . A A . 16 CYS N 1 1
12 4389 1 1 8 CYS O O -11.945 3.555 -12.208 1.00 . A A . 16 CYS O 1 1
12 4390 1 1 8 CYS SG S -8.399 3.169 -11.871 1.00 . A A . 16 CYS SG 1 1
12 4391 1 1 9 LYS C C -11.686 1.656 -9.992 1.00 . A A . 17 LYS C 1 1
12 4392 1 1 9 LYS CA C -11.917 3.077 -9.490 1.00 . A A . 17 LYS CA 1 1
12 4393 1 1 9 LYS CB C -13.384 3.464 -9.684 1.00 . A A . 17 LYS CB 1 1
12 4394 1 1 9 LYS CD C -15.020 5.353 -9.658 1.00 . A A . 17 LYS CD 1 1
12 4395 1 1 9 LYS CE C -15.260 6.758 -9.099 1.00 . A A . 17 LYS CE 1 1
12 4396 1 1 9 LYS CG C -13.552 4.970 -9.467 1.00 . A A . 17 LYS CG 1 1
12 4397 1 1 9 LYS H H -10.407 4.544 -9.683 1.00 . A A . 17 LYS H 1 1
12 4398 1 1 9 LYS HA H -11.689 3.112 -8.436 1.00 . A A . 17 LYS HA 1 1
12 4399 1 1 9 LYS HB2 H -13.697 3.205 -10.685 1.00 . A A . 17 LYS HB2 1 1
12 4400 1 1 9 LYS HB3 H -13.990 2.932 -8.970 1.00 . A A . 17 LYS HB3 1 1
12 4401 1 1 9 LYS HD2 H -15.262 5.338 -10.710 1.00 . A A . 17 LYS HD2 1 1
12 4402 1 1 9 LYS HD3 H -15.647 4.647 -9.133 1.00 . A A . 17 LYS HD3 1 1
12 4403 1 1 9 LYS HE2 H -16.287 7.042 -9.269 1.00 . A A . 17 LYS HE2 1 1
12 4404 1 1 9 LYS HE3 H -15.055 6.763 -8.039 1.00 . A A . 17 LYS HE3 1 1
12 4405 1 1 9 LYS HG2 H -13.239 5.225 -8.465 1.00 . A A . 17 LYS HG2 1 1
12 4406 1 1 9 LYS HG3 H -12.948 5.508 -10.181 1.00 . A A . 17 LYS HG3 1 1
12 4407 1 1 9 LYS HZ1 H -14.895 8.570 -10.058 1.00 . A A . 17 LYS HZ1 1 1
12 4408 1 1 9 LYS HZ2 H -13.953 7.279 -10.634 1.00 . A A . 17 LYS HZ2 1 1
12 4409 1 1 9 LYS HZ3 H -13.589 8.000 -9.138 1.00 . A A . 17 LYS HZ3 1 1
12 4410 1 1 9 LYS N N -11.056 4.021 -10.193 1.00 . A A . 17 LYS N 1 1
12 4411 1 1 9 LYS NZ N -14.356 7.724 -9.784 1.00 . A A . 17 LYS NZ 1 1
12 4412 1 1 9 LYS O O -12.634 0.934 -10.300 1.00 . A A . 17 LYS O 1 1
12 4413 1 1 10 GLY C C -9.913 -1.032 -9.338 1.00 . A A . 18 GLY C 1 1
12 4414 1 1 10 GLY CA C -10.061 -0.082 -10.522 1.00 . A A . 18 GLY CA 1 1
12 4415 1 1 10 GLY H H -9.707 1.881 -9.799 1.00 . A A . 18 GLY H 1 1
12 4416 1 1 10 GLY HA2 H -10.828 -0.455 -11.187 1.00 . A A . 18 GLY HA2 1 1
12 4417 1 1 10 GLY HA3 H -9.122 -0.036 -11.054 1.00 . A A . 18 GLY HA3 1 1
12 4418 1 1 10 GLY N N -10.418 1.260 -10.064 1.00 . A A . 18 GLY N 1 1
12 4419 1 1 10 GLY O O -10.817 -1.154 -8.512 1.00 . A A . 18 GLY O 1 1
12 4420 1 1 11 ASP C C -7.150 -2.334 -7.521 1.00 . A A . 19 ASP C 1 1
12 4421 1 1 11 ASP CA C -8.491 -2.649 -8.177 1.00 . A A . 19 ASP CA 1 1
12 4422 1 1 11 ASP CB C -8.468 -4.072 -8.736 1.00 . A A . 19 ASP CB 1 1
12 4423 1 1 11 ASP CG C -7.296 -4.239 -9.699 1.00 . A A . 19 ASP CG 1 1
12 4424 1 1 11 ASP H H -8.084 -1.564 -9.953 1.00 . A A . 19 ASP H 1 1
12 4425 1 1 11 ASP HA H -9.270 -2.582 -7.430 1.00 . A A . 19 ASP HA 1 1
12 4426 1 1 11 ASP HB2 H -8.368 -4.776 -7.922 1.00 . A A . 19 ASP HB2 1 1
12 4427 1 1 11 ASP HB3 H -9.389 -4.261 -9.263 1.00 . A A . 19 ASP HB3 1 1
12 4428 1 1 11 ASP N N -8.764 -1.704 -9.263 1.00 . A A . 19 ASP N 1 1
12 4429 1 1 11 ASP O O -6.208 -3.123 -7.601 1.00 . A A . 19 ASP O 1 1
12 4430 1 1 11 ASP OD1 O -7.071 -3.337 -10.489 1.00 . A A . 19 ASP OD1 1 1
12 4431 1 1 11 ASP OD2 O -6.640 -5.265 -9.630 1.00 . A A . 19 ASP OD2 1 1
12 4432 1 1 12 HIS C C -6.040 0.583 -5.529 1.00 . A A . 20 HIS C 1 1
12 4433 1 1 12 HIS CA C -5.843 -0.767 -6.207 1.00 . A A . 20 HIS CA 1 1
12 4434 1 1 12 HIS CB C -4.704 -0.664 -7.226 1.00 . A A . 20 HIS CB 1 1
12 4435 1 1 12 HIS CD2 C -5.626 1.350 -8.634 1.00 . A A . 20 HIS CD2 1 1
12 4436 1 1 12 HIS CE1 C -5.751 0.362 -10.558 1.00 . A A . 20 HIS CE1 1 1
12 4437 1 1 12 HIS CG C -5.194 0.061 -8.448 1.00 . A A . 20 HIS CG 1 1
12 4438 1 1 12 HIS H H -7.849 -0.586 -6.836 1.00 . A A . 20 HIS H 1 1
12 4439 1 1 12 HIS HA H -5.582 -1.502 -5.462 1.00 . A A . 20 HIS HA 1 1
12 4440 1 1 12 HIS HB2 H -3.880 -0.119 -6.793 1.00 . A A . 20 HIS HB2 1 1
12 4441 1 1 12 HIS HB3 H -4.373 -1.654 -7.503 1.00 . A A . 20 HIS HB3 1 1
12 4442 1 1 12 HIS HD2 H -5.679 2.106 -7.865 1.00 . A A . 20 HIS HD2 1 1
12 4443 1 1 12 HIS HE1 H -5.923 0.168 -11.606 1.00 . A A . 20 HIS HE1 1 1
12 4444 1 1 12 HIS N N -7.070 -1.176 -6.871 1.00 . A A . 20 HIS N 1 1
12 4445 1 1 12 HIS ND1 N -5.282 -0.551 -9.688 1.00 . A A . 20 HIS ND1 1 1
12 4446 1 1 12 HIS NE2 N -5.978 1.540 -9.967 1.00 . A A . 20 HIS NE2 1 1
12 4447 1 1 12 HIS O O -6.856 1.395 -5.962 1.00 . A A . 20 HIS O 1 1
12 4448 1 1 13 TRP C C -4.887 3.225 -4.613 1.00 . A A . 21 TRP C 1 1
12 4449 1 1 13 TRP CA C -5.378 2.074 -3.739 1.00 . A A . 21 TRP CA 1 1
12 4450 1 1 13 TRP CB C -4.541 2.005 -2.460 1.00 . A A . 21 TRP CB 1 1
12 4451 1 1 13 TRP CD1 C -5.382 -0.243 -1.666 1.00 . A A . 21 TRP CD1 1 1
12 4452 1 1 13 TRP CD2 C -5.751 1.397 -0.170 1.00 . A A . 21 TRP CD2 1 1
12 4453 1 1 13 TRP CE2 C -6.266 0.206 0.396 1.00 . A A . 21 TRP CE2 1 1
12 4454 1 1 13 TRP CE3 C -5.858 2.585 0.575 1.00 . A A . 21 TRP CE3 1 1
12 4455 1 1 13 TRP CG C -5.196 1.084 -1.480 1.00 . A A . 21 TRP CG 1 1
12 4456 1 1 13 TRP CH2 C -6.962 1.385 2.384 1.00 . A A . 21 TRP CH2 1 1
12 4457 1 1 13 TRP CZ2 C -6.864 0.195 1.657 1.00 . A A . 21 TRP CZ2 1 1
12 4458 1 1 13 TRP CZ3 C -6.460 2.578 1.844 1.00 . A A . 21 TRP CZ3 1 1
12 4459 1 1 13 TRP H H -4.655 0.130 -4.173 1.00 . A A . 21 TRP H 1 1
12 4460 1 1 13 TRP HA H -6.410 2.251 -3.473 1.00 . A A . 21 TRP HA 1 1
12 4461 1 1 13 TRP HB2 H -3.555 1.636 -2.694 1.00 . A A . 21 TRP HB2 1 1
12 4462 1 1 13 TRP HB3 H -4.462 2.992 -2.027 1.00 . A A . 21 TRP HB3 1 1
12 4463 1 1 13 TRP HD1 H -5.085 -0.803 -2.540 1.00 . A A . 21 TRP HD1 1 1
12 4464 1 1 13 TRP HE1 H -6.268 -1.705 -0.434 1.00 . A A . 21 TRP HE1 1 1
12 4465 1 1 13 TRP HE3 H -5.474 3.509 0.168 1.00 . A A . 21 TRP HE3 1 1
12 4466 1 1 13 TRP HH2 H -7.423 1.386 3.359 1.00 . A A . 21 TRP HH2 1 1
12 4467 1 1 13 TRP HZ2 H -7.250 -0.726 2.069 1.00 . A A . 21 TRP HZ2 1 1
12 4468 1 1 13 TRP HZ3 H -6.536 3.496 2.407 1.00 . A A . 21 TRP HZ3 1 1
12 4469 1 1 13 TRP N N -5.286 0.815 -4.468 1.00 . A A . 21 TRP N 1 1
12 4470 1 1 13 TRP NE1 N -6.017 -0.765 -0.553 1.00 . A A . 21 TRP NE1 1 1
12 4471 1 1 13 TRP O O -4.017 3.043 -5.464 1.00 . A A . 21 TRP O 1 1
12 4472 1 1 14 THR C C -3.555 5.724 -5.243 1.00 . A A . 22 THR C 1 1
12 4473 1 1 14 THR CA C -5.072 5.581 -5.179 1.00 . A A . 22 THR CA 1 1
12 4474 1 1 14 THR CB C -5.677 6.838 -4.552 1.00 . A A . 22 THR CB 1 1
12 4475 1 1 14 THR CG2 C -7.172 6.624 -4.321 1.00 . A A . 22 THR CG2 1 1
12 4476 1 1 14 THR H H -6.146 4.491 -3.711 1.00 . A A . 22 THR H 1 1
12 4477 1 1 14 THR HA H -5.457 5.474 -6.182 1.00 . A A . 22 THR HA 1 1
12 4478 1 1 14 THR HB H -5.536 7.677 -5.217 1.00 . A A . 22 THR HB 1 1
12 4479 1 1 14 THR HG1 H -4.195 6.639 -3.308 1.00 . A A . 22 THR HG1 1 1
12 4480 1 1 14 THR HG21 H -7.636 6.306 -5.243 1.00 . A A . 22 THR HG21 1 1
12 4481 1 1 14 THR HG22 H -7.621 7.549 -3.992 1.00 . A A . 22 THR HG22 1 1
12 4482 1 1 14 THR HG23 H -7.315 5.866 -3.566 1.00 . A A . 22 THR HG23 1 1
12 4483 1 1 14 THR N N -5.455 4.407 -4.400 1.00 . A A . 22 THR N 1 1
12 4484 1 1 14 THR O O -3.018 6.300 -6.189 1.00 . A A . 22 THR O 1 1
12 4485 1 1 14 THR OG1 O -5.036 7.102 -3.312 1.00 . A A . 22 THR OG1 1 1
12 4486 1 1 15 THR C C -0.786 4.413 -5.276 1.00 . A A . 23 THR C 1 1
12 4487 1 1 15 THR CA C -1.413 5.283 -4.190 1.00 . A A . 23 THR CA 1 1
12 4488 1 1 15 THR CB C -0.907 4.832 -2.819 1.00 . A A . 23 THR CB 1 1
12 4489 1 1 15 THR CG2 C 0.623 4.863 -2.802 1.00 . A A . 23 THR CG2 1 1
12 4490 1 1 15 THR H H -3.348 4.754 -3.505 1.00 . A A . 23 THR H 1 1
12 4491 1 1 15 THR HA H -1.116 6.307 -4.349 1.00 . A A . 23 THR HA 1 1
12 4492 1 1 15 THR HB H -1.243 3.828 -2.624 1.00 . A A . 23 THR HB 1 1
12 4493 1 1 15 THR HG1 H -0.845 6.480 -1.787 1.00 . A A . 23 THR HG1 1 1
12 4494 1 1 15 THR HG21 H 1.006 4.048 -3.400 1.00 . A A . 23 THR HG21 1 1
12 4495 1 1 15 THR HG22 H 0.974 4.760 -1.786 1.00 . A A . 23 THR HG22 1 1
12 4496 1 1 15 THR HG23 H 0.969 5.801 -3.209 1.00 . A A . 23 THR HG23 1 1
12 4497 1 1 15 THR N N -2.869 5.200 -4.234 1.00 . A A . 23 THR N 1 1
12 4498 1 1 15 THR O O 0.081 4.865 -6.023 1.00 . A A . 23 THR O 1 1
12 4499 1 1 15 THR OG1 O -1.411 5.706 -1.818 1.00 . A A . 23 THR OG1 1 1
12 4500 1 1 16 ARG C C -1.515 2.289 -7.639 1.00 . A A . 24 ARG C 1 1
12 4501 1 1 16 ARG CA C -0.699 2.221 -6.346 1.00 . A A . 24 ARG CA 1 1
12 4502 1 1 16 ARG CB C -0.721 0.785 -5.772 1.00 . A A . 24 ARG CB 1 1
12 4503 1 1 16 ARG CD C -2.072 -0.818 -4.405 1.00 . A A . 24 ARG CD 1 1
12 4504 1 1 16 ARG CG C -1.845 0.659 -4.739 1.00 . A A . 24 ARG CG 1 1
12 4505 1 1 16 ARG CZ C -2.592 -2.882 -5.573 1.00 . A A . 24 ARG CZ 1 1
12 4506 1 1 16 ARG H H -1.916 2.855 -4.725 1.00 . A A . 24 ARG H 1 1
12 4507 1 1 16 ARG HA H 0.325 2.488 -6.573 1.00 . A A . 24 ARG HA 1 1
12 4508 1 1 16 ARG HB2 H -0.881 0.068 -6.567 1.00 . A A . 24 ARG HB2 1 1
12 4509 1 1 16 ARG HB3 H 0.224 0.576 -5.290 1.00 . A A . 24 ARG HB3 1 1
12 4510 1 1 16 ARG HD2 H -1.183 -1.219 -3.941 1.00 . A A . 24 ARG HD2 1 1
12 4511 1 1 16 ARG HD3 H -2.902 -0.904 -3.719 1.00 . A A . 24 ARG HD3 1 1
12 4512 1 1 16 ARG HE H -2.389 -1.109 -6.480 1.00 . A A . 24 ARG HE 1 1
12 4513 1 1 16 ARG HG2 H -1.565 1.191 -3.842 1.00 . A A . 24 ARG HG2 1 1
12 4514 1 1 16 ARG HG3 H -2.753 1.080 -5.140 1.00 . A A . 24 ARG HG3 1 1
12 4515 1 1 16 ARG HH11 H -2.362 -3.010 -3.590 1.00 . A A . 24 ARG HH11 1 1
12 4516 1 1 16 ARG HH12 H -2.733 -4.496 -4.397 1.00 . A A . 24 ARG HH12 1 1
12 4517 1 1 16 ARG HH21 H -2.877 -3.053 -7.547 1.00 . A A . 24 ARG HH21 1 1
12 4518 1 1 16 ARG HH22 H -3.025 -4.520 -6.639 1.00 . A A . 24 ARG HH22 1 1
12 4519 1 1 16 ARG N N -1.226 3.159 -5.352 1.00 . A A . 24 ARG N 1 1
12 4520 1 1 16 ARG NE N -2.363 -1.574 -5.618 1.00 . A A . 24 ARG NE 1 1
12 4521 1 1 16 ARG NH1 N -2.560 -3.511 -4.431 1.00 . A A . 24 ARG NH1 1 1
12 4522 1 1 16 ARG NH2 N -2.851 -3.537 -6.673 1.00 . A A . 24 ARG NH2 1 1
12 4523 1 1 16 ARG O O -1.528 1.339 -8.423 1.00 . A A . 24 ARG O 1 1
12 4524 1 1 17 CYS C C -2.101 3.993 -10.255 1.00 . A A . 25 CYS C 1 1
12 4525 1 1 17 CYS CA C -2.992 3.575 -9.077 1.00 . A A . 25 CYS CA 1 1
12 4526 1 1 17 CYS CB C -4.075 4.636 -8.857 1.00 . A A . 25 CYS CB 1 1
12 4527 1 1 17 CYS H H -2.145 4.145 -7.215 1.00 . A A . 25 CYS H 1 1
12 4528 1 1 17 CYS HA H -3.471 2.637 -9.293 1.00 . A A . 25 CYS HA 1 1
12 4529 1 1 17 CYS HB2 H -4.806 4.263 -8.156 1.00 . A A . 25 CYS HB2 1 1
12 4530 1 1 17 CYS HB3 H -3.627 5.537 -8.465 1.00 . A A . 25 CYS HB3 1 1
12 4531 1 1 17 CYS N N -2.190 3.414 -7.866 1.00 . A A . 25 CYS N 1 1
12 4532 1 1 17 CYS O O -1.260 4.879 -10.103 1.00 . A A . 25 CYS O 1 1
12 4533 1 1 17 CYS SG S -4.882 5.000 -10.436 1.00 . A A . 25 CYS SG 1 1
12 4534 1 1 18 PRO C C -1.861 5.065 -13.246 1.00 . A A . 26 PRO C 1 1
12 4535 1 1 18 PRO CA C -1.418 3.748 -12.610 1.00 . A A . 26 PRO CA 1 1
12 4536 1 1 18 PRO CB C -1.644 2.568 -13.563 1.00 . A A . 26 PRO CB 1 1
12 4537 1 1 18 PRO CD C -3.214 2.316 -11.746 1.00 . A A . 26 PRO CD 1 1
12 4538 1 1 18 PRO CG C -3.028 2.100 -13.252 1.00 . A A . 26 PRO CG 1 1
12 4539 1 1 18 PRO HA H -0.376 3.797 -12.336 1.00 . A A . 26 PRO HA 1 1
12 4540 1 1 18 PRO HB2 H -1.571 2.891 -14.595 1.00 . A A . 26 PRO HB2 1 1
12 4541 1 1 18 PRO HB3 H -0.933 1.781 -13.363 1.00 . A A . 26 PRO HB3 1 1
12 4542 1 1 18 PRO HD2 H -4.227 2.628 -11.529 1.00 . A A . 26 PRO HD2 1 1
12 4543 1 1 18 PRO HD3 H -2.966 1.418 -11.201 1.00 . A A . 26 PRO HD3 1 1
12 4544 1 1 18 PRO HG2 H -3.751 2.683 -13.808 1.00 . A A . 26 PRO HG2 1 1
12 4545 1 1 18 PRO HG3 H -3.133 1.052 -13.488 1.00 . A A . 26 PRO HG3 1 1
12 4546 1 1 18 PRO N N -2.251 3.391 -11.420 1.00 . A A . 26 PRO N 1 1
12 4547 1 1 18 PRO O O -1.757 5.244 -14.460 1.00 . A A . 26 PRO O 1 1
12 4548 1 1 19 TYR C C -2.633 8.359 -11.849 1.00 . A A . 27 TYR C 1 1
12 4549 1 1 19 TYR CA C -2.813 7.283 -12.914 1.00 . A A . 27 TYR CA 1 1
12 4550 1 1 19 TYR CB C -4.286 7.201 -13.307 1.00 . A A . 27 TYR CB 1 1
12 4551 1 1 19 TYR CD1 C -3.900 6.678 -15.743 1.00 . A A . 27 TYR CD1 1 1
12 4552 1 1 19 TYR CD2 C -5.127 5.079 -14.393 1.00 . A A . 27 TYR CD2 1 1
12 4553 1 1 19 TYR CE1 C -4.043 5.843 -16.858 1.00 . A A . 27 TYR CE1 1 1
12 4554 1 1 19 TYR CE2 C -5.269 4.246 -15.509 1.00 . A A . 27 TYR CE2 1 1
12 4555 1 1 19 TYR CG C -4.442 6.297 -14.509 1.00 . A A . 27 TYR CG 1 1
12 4556 1 1 19 TYR CZ C -4.727 4.628 -16.742 1.00 . A A . 27 TYR CZ 1 1
12 4557 1 1 19 TYR H H -2.415 5.787 -11.461 1.00 . A A . 27 TYR H 1 1
12 4558 1 1 19 TYR HA H -2.234 7.556 -13.785 1.00 . A A . 27 TYR HA 1 1
12 4559 1 1 19 TYR HB2 H -4.859 6.809 -12.478 1.00 . A A . 27 TYR HB2 1 1
12 4560 1 1 19 TYR HB3 H -4.642 8.188 -13.552 1.00 . A A . 27 TYR HB3 1 1
12 4561 1 1 19 TYR HD1 H -3.372 7.615 -15.834 1.00 . A A . 27 TYR HD1 1 1
12 4562 1 1 19 TYR HD2 H -5.546 4.785 -13.442 1.00 . A A . 27 TYR HD2 1 1
12 4563 1 1 19 TYR HE1 H -3.624 6.138 -17.809 1.00 . A A . 27 TYR HE1 1 1
12 4564 1 1 19 TYR HE2 H -5.798 3.309 -15.419 1.00 . A A . 27 TYR HE2 1 1
12 4565 1 1 19 TYR HH H -4.072 3.884 -18.373 1.00 . A A . 27 TYR HH 1 1
12 4566 1 1 19 TYR N N -2.355 5.985 -12.419 1.00 . A A . 27 TYR N 1 1
12 4567 1 1 19 TYR O O -3.361 9.350 -11.825 1.00 . A A . 27 TYR O 1 1
12 4568 1 1 19 TYR OH O -4.867 3.806 -17.841 1.00 . A A . 27 TYR OH 1 1
12 4569 1 1 20 LYS C C -0.835 10.418 -10.461 1.00 . A A . 28 LYS C 1 1
12 4570 1 1 20 LYS CA C -1.389 9.110 -9.902 1.00 . A A . 28 LYS CA 1 1
12 4571 1 1 20 LYS CB C -0.398 8.513 -8.888 1.00 . A A . 28 LYS CB 1 1
12 4572 1 1 20 LYS CD C 0.943 6.650 -10.005 1.00 . A A . 28 LYS CD 1 1
12 4573 1 1 20 LYS CE C 2.369 6.229 -10.366 1.00 . A A . 28 LYS CE 1 1
12 4574 1 1 20 LYS CG C 0.943 8.126 -9.572 1.00 . A A . 28 LYS CG 1 1
12 4575 1 1 20 LYS H H -1.120 7.347 -11.039 1.00 . A A . 28 LYS H 1 1
12 4576 1 1 20 LYS HA H -2.314 9.322 -9.394 1.00 . A A . 28 LYS HA 1 1
12 4577 1 1 20 LYS HB2 H -0.204 9.250 -8.119 1.00 . A A . 28 LYS HB2 1 1
12 4578 1 1 20 LYS HB3 H -0.841 7.641 -8.432 1.00 . A A . 28 LYS HB3 1 1
12 4579 1 1 20 LYS HD2 H 0.583 6.031 -9.197 1.00 . A A . 28 LYS HD2 1 1
12 4580 1 1 20 LYS HD3 H 0.309 6.524 -10.867 1.00 . A A . 28 LYS HD3 1 1
12 4581 1 1 20 LYS HE2 H 2.372 5.193 -10.669 1.00 . A A . 28 LYS HE2 1 1
12 4582 1 1 20 LYS HE3 H 2.730 6.842 -11.178 1.00 . A A . 28 LYS HE3 1 1
12 4583 1 1 20 LYS HG2 H 1.106 8.745 -10.441 1.00 . A A . 28 LYS HG2 1 1
12 4584 1 1 20 LYS HG3 H 1.754 8.285 -8.876 1.00 . A A . 28 LYS HG3 1 1
12 4585 1 1 20 LYS HZ1 H 3.848 7.247 -9.311 1.00 . A A . 28 LYS HZ1 1 1
12 4586 1 1 20 LYS HZ2 H 3.861 5.565 -9.075 1.00 . A A . 28 LYS HZ2 1 1
12 4587 1 1 20 LYS HZ3 H 2.673 6.522 -8.326 1.00 . A A . 28 LYS HZ3 1 1
12 4588 1 1 20 LYS N N -1.659 8.154 -10.971 1.00 . A A . 28 LYS N 1 1
12 4589 1 1 20 LYS NZ N 3.255 6.404 -9.180 1.00 . A A . 28 LYS NZ 1 1
12 4590 1 1 20 LYS O O -0.296 11.241 -9.720 1.00 . A A . 28 LYS O 1 1
12 4591 1 1 21 ASP C C -1.173 13.036 -11.854 1.00 . A A . 29 ASP C 1 1
12 4592 1 1 21 ASP CA C -0.487 11.799 -12.419 1.00 . A A . 29 ASP CA 1 1
12 4593 1 1 21 ASP CB C -0.743 11.663 -13.922 1.00 . A A . 29 ASP CB 1 1
12 4594 1 1 21 ASP CG C -2.183 12.041 -14.274 1.00 . A A . 29 ASP CG 1 1
12 4595 1 1 21 ASP H H -1.401 9.920 -12.310 1.00 . A A . 29 ASP H 1 1
12 4596 1 1 21 ASP HA H 0.569 11.882 -12.249 1.00 . A A . 29 ASP HA 1 1
12 4597 1 1 21 ASP HB2 H -0.068 12.297 -14.452 1.00 . A A . 29 ASP HB2 1 1
12 4598 1 1 21 ASP HB3 H -0.570 10.640 -14.212 1.00 . A A . 29 ASP HB3 1 1
12 4599 1 1 21 ASP N N -0.971 10.603 -11.767 1.00 . A A . 29 ASP N 1 1
12 4600 1 1 21 ASP O O -0.875 14.166 -12.242 1.00 . A A . 29 ASP O 1 1
12 4601 1 1 21 ASP OD1 O -2.471 13.226 -14.312 1.00 . A A . 29 ASP OD1 1 1
12 4602 1 1 21 ASP OD2 O -2.974 11.139 -14.499 1.00 . A A . 29 ASP OD2 1 1
12 4603 1 1 22 THR C C -2.411 14.033 -8.834 1.00 . A A . 30 THR C 1 1
12 4604 1 1 22 THR CA C -2.847 13.879 -10.287 1.00 . A A . 30 THR CA 1 1
12 4605 1 1 22 THR CB C -4.353 13.573 -10.343 1.00 . A A . 30 THR CB 1 1
12 4606 1 1 22 THR CG2 C -4.578 12.058 -10.326 1.00 . A A . 30 THR CG2 1 1
12 4607 1 1 22 THR H H -2.271 11.871 -10.680 1.00 . A A . 30 THR H 1 1
12 4608 1 1 22 THR HA H -2.661 14.812 -10.805 1.00 . A A . 30 THR HA 1 1
12 4609 1 1 22 THR HB H -4.773 13.982 -11.252 1.00 . A A . 30 THR HB 1 1
12 4610 1 1 22 THR HG1 H -5.926 13.927 -9.257 1.00 . A A . 30 THR HG1 1 1
12 4611 1 1 22 THR HG21 H -4.395 11.655 -11.311 1.00 . A A . 30 THR HG21 1 1
12 4612 1 1 22 THR HG22 H -5.597 11.850 -10.037 1.00 . A A . 30 THR HG22 1 1
12 4613 1 1 22 THR HG23 H -3.904 11.599 -9.619 1.00 . A A . 30 THR HG23 1 1
12 4614 1 1 22 THR N N -2.095 12.799 -10.933 1.00 . A A . 30 THR N 1 1
12 4615 1 1 22 THR O O -1.479 14.778 -8.531 1.00 . A A . 30 THR O 1 1
12 4616 1 1 22 THR OG1 O -4.996 14.160 -9.221 1.00 . A A . 30 THR OG1 1 1
12 4617 1 1 23 LEU C C -3.333 12.177 -5.785 1.00 . A A . 31 LEU C 1 1
12 4618 1 1 23 LEU CA C -2.764 13.388 -6.518 1.00 . A A . 31 LEU CA 1 1
12 4619 1 1 23 LEU CB C -3.338 14.674 -5.910 1.00 . A A . 31 LEU CB 1 1
12 4620 1 1 23 LEU CD1 C -1.394 15.582 -4.573 1.00 . A A . 31 LEU CD1 1 1
12 4621 1 1 23 LEU CD2 C -3.718 15.791 -3.691 1.00 . A A . 31 LEU CD2 1 1
12 4622 1 1 23 LEU CG C -2.765 14.898 -4.494 1.00 . A A . 31 LEU CG 1 1
12 4623 1 1 23 LEU H H -3.824 12.746 -8.238 1.00 . A A . 31 LEU H 1 1
12 4624 1 1 23 LEU HA H -1.693 13.393 -6.406 1.00 . A A . 31 LEU HA 1 1
12 4625 1 1 23 LEU HB2 H -3.086 15.511 -6.544 1.00 . A A . 31 LEU HB2 1 1
12 4626 1 1 23 LEU HB3 H -4.414 14.584 -5.852 1.00 . A A . 31 LEU HB3 1 1
12 4627 1 1 23 LEU HD11 H -1.085 15.875 -3.580 1.00 . A A . 31 LEU HD11 1 1
12 4628 1 1 23 LEU HD12 H -1.459 16.458 -5.199 1.00 . A A . 31 LEU HD12 1 1
12 4629 1 1 23 LEU HD13 H -0.668 14.898 -4.984 1.00 . A A . 31 LEU HD13 1 1
12 4630 1 1 23 LEU HD21 H -3.922 16.693 -4.249 1.00 . A A . 31 LEU HD21 1 1
12 4631 1 1 23 LEU HD22 H -3.261 16.047 -2.747 1.00 . A A . 31 LEU HD22 1 1
12 4632 1 1 23 LEU HD23 H -4.643 15.262 -3.512 1.00 . A A . 31 LEU HD23 1 1
12 4633 1 1 23 LEU HG H -2.661 13.946 -3.992 1.00 . A A . 31 LEU HG 1 1
12 4634 1 1 23 LEU N N -3.091 13.323 -7.939 1.00 . A A . 31 LEU N 1 1
12 4635 1 1 23 LEU O O -4.523 12.128 -5.477 1.00 . A A . 31 LEU O 1 1
12 4636 1 1 24 GLY C C -3.413 10.322 -3.417 1.00 . A A . 32 GLY C 1 1
12 4637 1 1 24 GLY CA C -2.901 9.992 -4.814 1.00 . A A . 32 GLY CA 1 1
12 4638 1 1 24 GLY H H -1.536 11.294 -5.781 1.00 . A A . 32 GLY H 1 1
12 4639 1 1 24 GLY HA2 H -3.689 9.517 -5.381 1.00 . A A . 32 GLY HA2 1 1
12 4640 1 1 24 GLY HA3 H -2.064 9.316 -4.732 1.00 . A A . 32 GLY HA3 1 1
12 4641 1 1 24 GLY N N -2.473 11.201 -5.511 1.00 . A A . 32 GLY N 1 1
12 4642 1 1 24 GLY O O -2.796 11.143 -2.759 1.00 . A A . 32 GLY O 1 1
12 4643 1 1 24 GLY OXT O -4.417 9.749 -3.026 1.00 . A A . 32 GLY OXT 1 1
12 4644 2 2 1 ZN ZN ZN -6.799 3.709 -10.445 1.00 . B A . 300 ZN ZN 1 1
13 4645 1 1 1 LYS C C -11.020 -4.104 1.020 1.00 . A A . 9 LYS C 1 1
13 4646 1 1 1 LYS CA C -10.372 -4.610 2.306 1.00 . A A . 9 LYS CA 1 1
13 4647 1 1 1 LYS CB C -10.868 -6.022 2.621 1.00 . A A . 9 LYS CB 1 1
13 4648 1 1 1 LYS CD C -10.830 -7.851 4.324 1.00 . A A . 9 LYS CD 1 1
13 4649 1 1 1 LYS CE C -10.759 -8.136 5.825 1.00 . A A . 9 LYS CE 1 1
13 4650 1 1 1 LYS CG C -10.524 -6.373 4.069 1.00 . A A . 9 LYS CG 1 1
13 4651 1 1 1 LYS H1 H -10.132 -3.914 4.253 1.00 . A A . 9 LYS H1 1 1
13 4652 1 1 1 LYS H2 H -11.730 -3.833 3.680 1.00 . A A . 9 LYS H2 1 1
13 4653 1 1 1 LYS H3 H -10.572 -2.713 3.140 1.00 . A A . 9 LYS H3 1 1
13 4654 1 1 1 LYS HA H -9.299 -4.625 2.183 1.00 . A A . 9 LYS HA 1 1
13 4655 1 1 1 LYS HB2 H -11.939 -6.066 2.483 1.00 . A A . 9 LYS HB2 1 1
13 4656 1 1 1 LYS HB3 H -10.390 -6.728 1.957 1.00 . A A . 9 LYS HB3 1 1
13 4657 1 1 1 LYS HD2 H -11.820 -8.080 3.958 1.00 . A A . 9 LYS HD2 1 1
13 4658 1 1 1 LYS HD3 H -10.105 -8.462 3.809 1.00 . A A . 9 LYS HD3 1 1
13 4659 1 1 1 LYS HE2 H -9.872 -7.680 6.237 1.00 . A A . 9 LYS HE2 1 1
13 4660 1 1 1 LYS HE3 H -11.633 -7.727 6.311 1.00 . A A . 9 LYS HE3 1 1
13 4661 1 1 1 LYS HG2 H -9.474 -6.187 4.244 1.00 . A A . 9 LYS HG2 1 1
13 4662 1 1 1 LYS HG3 H -11.114 -5.765 4.738 1.00 . A A . 9 LYS HG3 1 1
13 4663 1 1 1 LYS HZ1 H -11.128 -9.834 6.974 1.00 . A A . 9 LYS HZ1 1 1
13 4664 1 1 1 LYS HZ2 H -9.720 -9.929 6.028 1.00 . A A . 9 LYS HZ2 1 1
13 4665 1 1 1 LYS HZ3 H -11.248 -10.091 5.302 1.00 . A A . 9 LYS HZ3 1 1
13 4666 1 1 1 LYS N N -10.729 -3.698 3.430 1.00 . A A . 9 LYS N 1 1
13 4667 1 1 1 LYS NZ N -10.710 -9.609 6.049 1.00 . A A . 9 LYS NZ 1 1
13 4668 1 1 1 LYS O O -10.670 -4.543 -0.076 1.00 . A A . 9 LYS O 1 1
13 4669 1 1 2 ILE C C -11.741 -1.650 -0.737 1.00 . A A . 10 ILE C 1 1
13 4670 1 1 2 ILE CA C -12.654 -2.624 0.005 1.00 . A A . 10 ILE CA 1 1
13 4671 1 1 2 ILE CB C -13.954 -1.925 0.448 1.00 . A A . 10 ILE CB 1 1
13 4672 1 1 2 ILE CD1 C -14.880 -2.280 -1.873 1.00 . A A . 10 ILE CD1 1 1
13 4673 1 1 2 ILE CG1 C -14.637 -1.253 -0.759 1.00 . A A . 10 ILE CG1 1 1
13 4674 1 1 2 ILE CG2 C -13.661 -0.864 1.528 1.00 . A A . 10 ILE CG2 1 1
13 4675 1 1 2 ILE H H -12.200 -2.870 2.059 1.00 . A A . 10 ILE H 1 1
13 4676 1 1 2 ILE HA H -12.905 -3.435 -0.661 1.00 . A A . 10 ILE HA 1 1
13 4677 1 1 2 ILE HB H -14.623 -2.668 0.861 1.00 . A A . 10 ILE HB 1 1
13 4678 1 1 2 ILE HD11 H -15.154 -3.231 -1.439 1.00 . A A . 10 ILE HD11 1 1
13 4679 1 1 2 ILE HD12 H -13.980 -2.397 -2.458 1.00 . A A . 10 ILE HD12 1 1
13 4680 1 1 2 ILE HD13 H -15.679 -1.934 -2.512 1.00 . A A . 10 ILE HD13 1 1
13 4681 1 1 2 ILE HG12 H -15.584 -0.838 -0.446 1.00 . A A . 10 ILE HG12 1 1
13 4682 1 1 2 ILE HG13 H -14.009 -0.459 -1.136 1.00 . A A . 10 ILE HG13 1 1
13 4683 1 1 2 ILE HG21 H -14.544 -0.717 2.135 1.00 . A A . 10 ILE HG21 1 1
13 4684 1 1 2 ILE HG22 H -13.391 0.073 1.063 1.00 . A A . 10 ILE HG22 1 1
13 4685 1 1 2 ILE HG23 H -12.850 -1.197 2.159 1.00 . A A . 10 ILE HG23 1 1
13 4686 1 1 2 ILE N N -11.964 -3.180 1.162 1.00 . A A . 10 ILE N 1 1
13 4687 1 1 2 ILE O O -11.755 -0.446 -0.490 1.00 . A A . 10 ILE O 1 1
13 4688 1 1 3 VAL C C -10.738 -0.674 -3.565 1.00 . A A . 11 VAL C 1 1
13 4689 1 1 3 VAL CA C -10.017 -1.369 -2.426 1.00 . A A . 11 VAL CA 1 1
13 4690 1 1 3 VAL CB C -8.881 -2.227 -2.984 1.00 . A A . 11 VAL CB 1 1
13 4691 1 1 3 VAL CG1 C -9.457 -3.357 -3.839 1.00 . A A . 11 VAL CG1 1 1
13 4692 1 1 3 VAL CG2 C -7.961 -1.357 -3.843 1.00 . A A . 11 VAL CG2 1 1
13 4693 1 1 3 VAL H H -10.969 -3.156 -1.799 1.00 . A A . 11 VAL H 1 1
13 4694 1 1 3 VAL HA H -9.592 -0.610 -1.787 1.00 . A A . 11 VAL HA 1 1
13 4695 1 1 3 VAL HB H -8.318 -2.645 -2.165 1.00 . A A . 11 VAL HB 1 1
13 4696 1 1 3 VAL HG11 H -8.681 -4.078 -4.052 1.00 . A A . 11 VAL HG11 1 1
13 4697 1 1 3 VAL HG12 H -9.833 -2.951 -4.767 1.00 . A A . 11 VAL HG12 1 1
13 4698 1 1 3 VAL HG13 H -10.261 -3.841 -3.307 1.00 . A A . 11 VAL HG13 1 1
13 4699 1 1 3 VAL HG21 H -7.737 -0.441 -3.318 1.00 . A A . 11 VAL HG21 1 1
13 4700 1 1 3 VAL HG22 H -8.452 -1.126 -4.777 1.00 . A A . 11 VAL HG22 1 1
13 4701 1 1 3 VAL HG23 H -7.043 -1.891 -4.042 1.00 . A A . 11 VAL HG23 1 1
13 4702 1 1 3 VAL N N -10.940 -2.190 -1.650 1.00 . A A . 11 VAL N 1 1
13 4703 1 1 3 VAL O O -11.461 -1.299 -4.341 1.00 . A A . 11 VAL O 1 1
13 4704 1 1 4 SER C C -10.372 2.725 -4.888 1.00 . A A . 12 SER C 1 1
13 4705 1 1 4 SER CA C -11.134 1.426 -4.700 1.00 . A A . 12 SER CA 1 1
13 4706 1 1 4 SER CB C -12.586 1.738 -4.361 1.00 . A A . 12 SER CB 1 1
13 4707 1 1 4 SER H H -9.927 1.057 -3.005 1.00 . A A . 12 SER H 1 1
13 4708 1 1 4 SER HA H -11.107 0.871 -5.626 1.00 . A A . 12 SER HA 1 1
13 4709 1 1 4 SER HB2 H -12.625 2.442 -3.548 1.00 . A A . 12 SER HB2 1 1
13 4710 1 1 4 SER HB3 H -13.063 2.167 -5.232 1.00 . A A . 12 SER HB3 1 1
13 4711 1 1 4 SER HG H -13.176 -0.083 -4.706 1.00 . A A . 12 SER HG 1 1
13 4712 1 1 4 SER N N -10.521 0.627 -3.655 1.00 . A A . 12 SER N 1 1
13 4713 1 1 4 SER O O -10.232 3.526 -3.964 1.00 . A A . 12 SER O 1 1
13 4714 1 1 4 SER OG O -13.251 0.541 -3.980 1.00 . A A . 12 SER OG 1 1
13 4715 1 1 5 CYS C C -9.993 5.359 -6.247 1.00 . A A . 13 CYS C 1 1
13 4716 1 1 5 CYS CA C -9.131 4.116 -6.438 1.00 . A A . 13 CYS CA 1 1
13 4717 1 1 5 CYS CB C -8.659 4.031 -7.892 1.00 . A A . 13 CYS CB 1 1
13 4718 1 1 5 CYS H H -10.042 2.232 -6.777 1.00 . A A . 13 CYS H 1 1
13 4719 1 1 5 CYS HA H -8.268 4.183 -5.795 1.00 . A A . 13 CYS HA 1 1
13 4720 1 1 5 CYS HB2 H -8.312 3.030 -8.098 1.00 . A A . 13 CYS HB2 1 1
13 4721 1 1 5 CYS HB3 H -9.478 4.268 -8.551 1.00 . A A . 13 CYS HB3 1 1
13 4722 1 1 5 CYS N N -9.886 2.916 -6.098 1.00 . A A . 13 CYS N 1 1
13 4723 1 1 5 CYS O O -11.123 5.275 -5.764 1.00 . A A . 13 CYS O 1 1
13 4724 1 1 5 CYS SG S -7.310 5.205 -8.170 1.00 . A A . 13 CYS SG 1 1
13 4725 1 1 6 ARG C C -10.004 8.610 -7.773 1.00 . A A . 14 ARG C 1 1
13 4726 1 1 6 ARG CA C -10.176 7.781 -6.506 1.00 . A A . 14 ARG CA 1 1
13 4727 1 1 6 ARG CB C -9.646 8.568 -5.305 1.00 . A A . 14 ARG CB 1 1
13 4728 1 1 6 ARG CD C -9.602 8.694 -2.810 1.00 . A A . 14 ARG CD 1 1
13 4729 1 1 6 ARG CG C -10.090 7.884 -4.011 1.00 . A A . 14 ARG CG 1 1
13 4730 1 1 6 ARG CZ C -10.151 10.825 -1.783 1.00 . A A . 14 ARG CZ 1 1
13 4731 1 1 6 ARG H H -8.551 6.517 -7.010 1.00 . A A . 14 ARG H 1 1
13 4732 1 1 6 ARG HA H -11.230 7.586 -6.358 1.00 . A A . 14 ARG HA 1 1
13 4733 1 1 6 ARG HB2 H -8.566 8.599 -5.345 1.00 . A A . 14 ARG HB2 1 1
13 4734 1 1 6 ARG HB3 H -10.038 9.573 -5.332 1.00 . A A . 14 ARG HB3 1 1
13 4735 1 1 6 ARG HD2 H -9.925 8.215 -1.899 1.00 . A A . 14 ARG HD2 1 1
13 4736 1 1 6 ARG HD3 H -8.522 8.740 -2.826 1.00 . A A . 14 ARG HD3 1 1
13 4737 1 1 6 ARG HE H -10.511 10.388 -3.703 1.00 . A A . 14 ARG HE 1 1
13 4738 1 1 6 ARG HG2 H -11.169 7.820 -3.990 1.00 . A A . 14 ARG HG2 1 1
13 4739 1 1 6 ARG HG3 H -9.670 6.890 -3.966 1.00 . A A . 14 ARG HG3 1 1
13 4740 1 1 6 ARG HH11 H -9.292 9.457 -0.602 1.00 . A A . 14 ARG HH11 1 1
13 4741 1 1 6 ARG HH12 H -9.671 10.967 0.155 1.00 . A A . 14 ARG HH12 1 1
13 4742 1 1 6 ARG HH21 H -11.012 12.373 -2.717 1.00 . A A . 14 ARG HH21 1 1
13 4743 1 1 6 ARG HH22 H -10.646 12.618 -1.043 1.00 . A A . 14 ARG HH22 1 1
13 4744 1 1 6 ARG N N -9.455 6.514 -6.631 1.00 . A A . 14 ARG N 1 1
13 4745 1 1 6 ARG NE N -10.144 10.047 -2.861 1.00 . A A . 14 ARG NE 1 1
13 4746 1 1 6 ARG NH1 N -9.667 10.382 -0.656 1.00 . A A . 14 ARG NH1 1 1
13 4747 1 1 6 ARG NH2 N -10.641 12.033 -1.854 1.00 . A A . 14 ARG NH2 1 1
13 4748 1 1 6 ARG O O -10.115 9.835 -7.748 1.00 . A A . 14 ARG O 1 1
13 4749 1 1 7 ILE C C -10.133 7.762 -11.302 1.00 . A A . 15 ILE C 1 1
13 4750 1 1 7 ILE CA C -9.539 8.597 -10.171 1.00 . A A . 15 ILE CA 1 1
13 4751 1 1 7 ILE CB C -8.043 8.814 -10.438 1.00 . A A . 15 ILE CB 1 1
13 4752 1 1 7 ILE CD1 C -6.891 8.871 -8.176 1.00 . A A . 15 ILE CD1 1 1
13 4753 1 1 7 ILE CG1 C -7.428 9.721 -9.340 1.00 . A A . 15 ILE CG1 1 1
13 4754 1 1 7 ILE CG2 C -7.876 9.476 -11.811 1.00 . A A . 15 ILE CG2 1 1
13 4755 1 1 7 ILE H H -9.654 6.951 -8.838 1.00 . A A . 15 ILE H 1 1
13 4756 1 1 7 ILE HA H -10.032 9.558 -10.152 1.00 . A A . 15 ILE HA 1 1
13 4757 1 1 7 ILE HB H -7.540 7.857 -10.446 1.00 . A A . 15 ILE HB 1 1
13 4758 1 1 7 ILE HD11 H -6.930 9.448 -7.264 1.00 . A A . 15 ILE HD11 1 1
13 4759 1 1 7 ILE HD12 H -5.867 8.593 -8.380 1.00 . A A . 15 ILE HD12 1 1
13 4760 1 1 7 ILE HD13 H -7.488 7.979 -8.063 1.00 . A A . 15 ILE HD13 1 1
13 4761 1 1 7 ILE HG12 H -6.611 10.294 -9.757 1.00 . A A . 15 ILE HG12 1 1
13 4762 1 1 7 ILE HG13 H -8.180 10.401 -8.964 1.00 . A A . 15 ILE HG13 1 1
13 4763 1 1 7 ILE HG21 H -6.863 9.835 -11.916 1.00 . A A . 15 ILE HG21 1 1
13 4764 1 1 7 ILE HG22 H -8.563 10.305 -11.898 1.00 . A A . 15 ILE HG22 1 1
13 4765 1 1 7 ILE HG23 H -8.084 8.753 -12.586 1.00 . A A . 15 ILE HG23 1 1
13 4766 1 1 7 ILE N N -9.731 7.926 -8.884 1.00 . A A . 15 ILE N 1 1
13 4767 1 1 7 ILE O O -10.667 8.303 -12.270 1.00 . A A . 15 ILE O 1 1
13 4768 1 1 8 CYS C C -11.282 4.351 -11.558 1.00 . A A . 16 CYS C 1 1
13 4769 1 1 8 CYS CA C -10.541 5.524 -12.200 1.00 . A A . 16 CYS CA 1 1
13 4770 1 1 8 CYS CB C -9.378 5.001 -13.042 1.00 . A A . 16 CYS CB 1 1
13 4771 1 1 8 CYS H H -9.580 6.068 -10.393 1.00 . A A . 16 CYS H 1 1
13 4772 1 1 8 CYS HA H -11.226 6.055 -12.847 1.00 . A A . 16 CYS HA 1 1
13 4773 1 1 8 CYS HB2 H -9.761 4.452 -13.888 1.00 . A A . 16 CYS HB2 1 1
13 4774 1 1 8 CYS HB3 H -8.789 5.836 -13.388 1.00 . A A . 16 CYS HB3 1 1
13 4775 1 1 8 CYS N N -10.025 6.438 -11.180 1.00 . A A . 16 CYS N 1 1
13 4776 1 1 8 CYS O O -11.928 3.564 -12.248 1.00 . A A . 16 CYS O 1 1
13 4777 1 1 8 CYS SG S -8.342 3.915 -12.033 1.00 . A A . 16 CYS SG 1 1
13 4778 1 1 9 LYS C C -11.570 1.817 -10.153 1.00 . A A . 17 LYS C 1 1
13 4779 1 1 9 LYS CA C -11.867 3.171 -9.516 1.00 . A A . 17 LYS CA 1 1
13 4780 1 1 9 LYS CB C -13.375 3.427 -9.513 1.00 . A A . 17 LYS CB 1 1
13 4781 1 1 9 LYS CD C -15.146 5.164 -9.196 1.00 . A A . 17 LYS CD 1 1
13 4782 1 1 9 LYS CE C -15.405 6.552 -8.609 1.00 . A A . 17 LYS CE 1 1
13 4783 1 1 9 LYS CG C -13.639 4.918 -9.284 1.00 . A A . 17 LYS CG 1 1
13 4784 1 1 9 LYS H H -10.673 4.902 -9.731 1.00 . A A . 17 LYS H 1 1
13 4785 1 1 9 LYS HA H -11.517 3.157 -8.494 1.00 . A A . 17 LYS HA 1 1
13 4786 1 1 9 LYS HB2 H -13.796 3.128 -10.463 1.00 . A A . 17 LYS HB2 1 1
13 4787 1 1 9 LYS HB3 H -13.833 2.859 -8.721 1.00 . A A . 17 LYS HB3 1 1
13 4788 1 1 9 LYS HD2 H -15.575 5.104 -10.186 1.00 . A A . 17 LYS HD2 1 1
13 4789 1 1 9 LYS HD3 H -15.596 4.416 -8.562 1.00 . A A . 17 LYS HD3 1 1
13 4790 1 1 9 LYS HE2 H -16.452 6.797 -8.711 1.00 . A A . 17 LYS HE2 1 1
13 4791 1 1 9 LYS HE3 H -15.135 6.557 -7.564 1.00 . A A . 17 LYS HE3 1 1
13 4792 1 1 9 LYS HG2 H -13.168 5.229 -8.362 1.00 . A A . 17 LYS HG2 1 1
13 4793 1 1 9 LYS HG3 H -13.233 5.489 -10.106 1.00 . A A . 17 LYS HG3 1 1
13 4794 1 1 9 LYS HZ1 H -13.626 7.582 -8.942 1.00 . A A . 17 LYS HZ1 1 1
13 4795 1 1 9 LYS HZ2 H -15.024 8.500 -9.240 1.00 . A A . 17 LYS HZ2 1 1
13 4796 1 1 9 LYS HZ3 H -14.538 7.306 -10.346 1.00 . A A . 17 LYS HZ3 1 1
13 4797 1 1 9 LYS N N -11.193 4.245 -10.235 1.00 . A A . 17 LYS N 1 1
13 4798 1 1 9 LYS NZ N -14.587 7.561 -9.339 1.00 . A A . 17 LYS NZ 1 1
13 4799 1 1 9 LYS O O -12.481 1.039 -10.435 1.00 . A A . 17 LYS O 1 1
13 4800 1 1 10 GLY C C -9.711 -0.793 -9.880 1.00 . A A . 18 GLY C 1 1
13 4801 1 1 10 GLY CA C -9.874 0.272 -10.959 1.00 . A A . 18 GLY CA 1 1
13 4802 1 1 10 GLY H H -9.605 2.197 -10.112 1.00 . A A . 18 GLY H 1 1
13 4803 1 1 10 GLY HA2 H -10.619 -0.052 -11.673 1.00 . A A . 18 GLY HA2 1 1
13 4804 1 1 10 GLY HA3 H -8.930 0.407 -11.464 1.00 . A A . 18 GLY HA3 1 1
13 4805 1 1 10 GLY N N -10.288 1.540 -10.365 1.00 . A A . 18 GLY N 1 1
13 4806 1 1 10 GLY O O -10.695 -1.333 -9.374 1.00 . A A . 18 GLY O 1 1
13 4807 1 1 11 ASP C C -6.824 -1.803 -7.851 1.00 . A A . 19 ASP C 1 1
13 4808 1 1 11 ASP CA C -8.173 -2.092 -8.514 1.00 . A A . 19 ASP CA 1 1
13 4809 1 1 11 ASP CB C -8.168 -3.487 -9.160 1.00 . A A . 19 ASP CB 1 1
13 4810 1 1 11 ASP CG C -8.559 -4.556 -8.141 1.00 . A A . 19 ASP CG 1 1
13 4811 1 1 11 ASP H H -7.719 -0.631 -9.973 1.00 . A A . 19 ASP H 1 1
13 4812 1 1 11 ASP HA H -8.945 -2.054 -7.757 1.00 . A A . 19 ASP HA 1 1
13 4813 1 1 11 ASP HB2 H -8.881 -3.499 -9.972 1.00 . A A . 19 ASP HB2 1 1
13 4814 1 1 11 ASP HB3 H -7.186 -3.703 -9.551 1.00 . A A . 19 ASP HB3 1 1
13 4815 1 1 11 ASP N N -8.462 -1.091 -9.533 1.00 . A A . 19 ASP N 1 1
13 4816 1 1 11 ASP O O -5.804 -2.394 -8.208 1.00 . A A . 19 ASP O 1 1
13 4817 1 1 11 ASP OD1 O -9.733 -4.637 -7.818 1.00 . A A . 19 ASP OD1 1 1
13 4818 1 1 11 ASP OD2 O -7.678 -5.276 -7.700 1.00 . A A . 19 ASP OD2 1 1
13 4819 1 1 12 HIS C C -5.908 0.424 -5.039 1.00 . A A . 20 HIS C 1 1
13 4820 1 1 12 HIS CA C -5.600 -0.534 -6.188 1.00 . A A . 20 HIS CA 1 1
13 4821 1 1 12 HIS CB C -4.594 0.112 -7.167 1.00 . A A . 20 HIS CB 1 1
13 4822 1 1 12 HIS CD2 C -5.932 2.006 -8.398 1.00 . A A . 20 HIS CD2 1 1
13 4823 1 1 12 HIS CE1 C -6.234 0.999 -10.292 1.00 . A A . 20 HIS CE1 1 1
13 4824 1 1 12 HIS CG C -5.336 0.774 -8.293 1.00 . A A . 20 HIS CG 1 1
13 4825 1 1 12 HIS H H -7.659 -0.444 -6.637 1.00 . A A . 20 HIS H 1 1
13 4826 1 1 12 HIS HA H -5.161 -1.433 -5.777 1.00 . A A . 20 HIS HA 1 1
13 4827 1 1 12 HIS HB2 H -3.998 0.852 -6.651 1.00 . A A . 20 HIS HB2 1 1
13 4828 1 1 12 HIS HB3 H -3.940 -0.649 -7.571 1.00 . A A . 20 HIS HB3 1 1
13 4829 1 1 12 HIS HD2 H -5.961 2.751 -7.617 1.00 . A A . 20 HIS HD2 1 1
13 4830 1 1 12 HIS HE1 H -6.539 0.780 -11.304 1.00 . A A . 20 HIS HE1 1 1
13 4831 1 1 12 HIS N N -6.824 -0.889 -6.885 1.00 . A A . 20 HIS N 1 1
13 4832 1 1 12 HIS ND1 N -5.542 0.149 -9.512 1.00 . A A . 20 HIS ND1 1 1
13 4833 1 1 12 HIS NE2 N -6.499 2.145 -9.661 1.00 . A A . 20 HIS NE2 1 1
13 4834 1 1 12 HIS O O -6.963 1.056 -5.000 1.00 . A A . 20 HIS O 1 1
13 4835 1 1 13 TRP C C -4.989 2.856 -3.360 1.00 . A A . 21 TRP C 1 1
13 4836 1 1 13 TRP CA C -5.110 1.388 -2.954 1.00 . A A . 21 TRP CA 1 1
13 4837 1 1 13 TRP CB C -4.022 1.051 -1.924 1.00 . A A . 21 TRP CB 1 1
13 4838 1 1 13 TRP CD1 C -4.248 -1.456 -1.687 1.00 . A A . 21 TRP CD1 1 1
13 4839 1 1 13 TRP CD2 C -4.935 -0.350 0.147 1.00 . A A . 21 TRP CD2 1 1
13 4840 1 1 13 TRP CE2 C -5.114 -1.729 0.413 1.00 . A A . 21 TRP CE2 1 1
13 4841 1 1 13 TRP CE3 C -5.293 0.570 1.150 1.00 . A A . 21 TRP CE3 1 1
13 4842 1 1 13 TRP CG C -4.384 -0.204 -1.193 1.00 . A A . 21 TRP CG 1 1
13 4843 1 1 13 TRP CH2 C -5.981 -1.251 2.614 1.00 . A A . 21 TRP CH2 1 1
13 4844 1 1 13 TRP CZ2 C -5.630 -2.178 1.629 1.00 . A A . 21 TRP CZ2 1 1
13 4845 1 1 13 TRP CZ3 C -5.813 0.120 2.374 1.00 . A A . 21 TRP CZ3 1 1
13 4846 1 1 13 TRP H H -4.158 -0.019 -4.215 1.00 . A A . 21 TRP H 1 1
13 4847 1 1 13 TRP HA H -6.080 1.228 -2.507 1.00 . A A . 21 TRP HA 1 1
13 4848 1 1 13 TRP HB2 H -3.081 0.908 -2.434 1.00 . A A . 21 TRP HB2 1 1
13 4849 1 1 13 TRP HB3 H -3.926 1.863 -1.218 1.00 . A A . 21 TRP HB3 1 1
13 4850 1 1 13 TRP HD1 H -3.865 -1.708 -2.666 1.00 . A A . 21 TRP HD1 1 1
13 4851 1 1 13 TRP HE1 H -4.688 -3.336 -0.843 1.00 . A A . 21 TRP HE1 1 1
13 4852 1 1 13 TRP HE3 H -5.168 1.628 0.976 1.00 . A A . 21 TRP HE3 1 1
13 4853 1 1 13 TRP HH2 H -6.380 -1.590 3.558 1.00 . A A . 21 TRP HH2 1 1
13 4854 1 1 13 TRP HZ2 H -5.757 -3.236 1.808 1.00 . A A . 21 TRP HZ2 1 1
13 4855 1 1 13 TRP HZ3 H -6.085 0.835 3.137 1.00 . A A . 21 TRP HZ3 1 1
13 4856 1 1 13 TRP N N -4.968 0.515 -4.115 1.00 . A A . 21 TRP N 1 1
13 4857 1 1 13 TRP NE1 N -4.682 -2.362 -0.735 1.00 . A A . 21 TRP NE1 1 1
13 4858 1 1 13 TRP O O -4.518 3.684 -2.582 1.00 . A A . 21 TRP O 1 1
13 4859 1 1 14 THR C C -3.894 5.000 -5.175 1.00 . A A . 22 THR C 1 1
13 4860 1 1 14 THR CA C -5.346 4.543 -5.073 1.00 . A A . 22 THR CA 1 1
13 4861 1 1 14 THR CB C -6.121 5.481 -4.139 1.00 . A A . 22 THR CB 1 1
13 4862 1 1 14 THR CG2 C -6.438 6.790 -4.868 1.00 . A A . 22 THR CG2 1 1
13 4863 1 1 14 THR H H -5.781 2.471 -5.157 1.00 . A A . 22 THR H 1 1
13 4864 1 1 14 THR HA H -5.792 4.578 -6.055 1.00 . A A . 22 THR HA 1 1
13 4865 1 1 14 THR HB H -5.523 5.697 -3.267 1.00 . A A . 22 THR HB 1 1
13 4866 1 1 14 THR HG1 H -7.175 4.415 -2.901 1.00 . A A . 22 THR HG1 1 1
13 4867 1 1 14 THR HG21 H -6.848 7.502 -4.167 1.00 . A A . 22 THR HG21 1 1
13 4868 1 1 14 THR HG22 H -7.157 6.601 -5.651 1.00 . A A . 22 THR HG22 1 1
13 4869 1 1 14 THR HG23 H -5.534 7.191 -5.299 1.00 . A A . 22 THR HG23 1 1
13 4870 1 1 14 THR N N -5.415 3.171 -4.579 1.00 . A A . 22 THR N 1 1
13 4871 1 1 14 THR O O -3.371 5.197 -6.272 1.00 . A A . 22 THR O 1 1
13 4872 1 1 14 THR OG1 O -7.331 4.853 -3.741 1.00 . A A . 22 THR OG1 1 1
13 4873 1 1 15 THR C C -1.038 4.868 -5.060 1.00 . A A . 23 THR C 1 1
13 4874 1 1 15 THR CA C -1.853 5.599 -3.998 1.00 . A A . 23 THR CA 1 1
13 4875 1 1 15 THR CB C -1.253 5.330 -2.615 1.00 . A A . 23 THR CB 1 1
13 4876 1 1 15 THR CG2 C -2.081 6.048 -1.548 1.00 . A A . 23 THR CG2 1 1
13 4877 1 1 15 THR H H -3.713 4.995 -3.182 1.00 . A A . 23 THR H 1 1
13 4878 1 1 15 THR HA H -1.813 6.660 -4.194 1.00 . A A . 23 THR HA 1 1
13 4879 1 1 15 THR HB H -0.239 5.698 -2.585 1.00 . A A . 23 THR HB 1 1
13 4880 1 1 15 THR HG1 H -2.126 3.593 -2.597 1.00 . A A . 23 THR HG1 1 1
13 4881 1 1 15 THR HG21 H -3.112 5.737 -1.623 1.00 . A A . 23 THR HG21 1 1
13 4882 1 1 15 THR HG22 H -2.015 7.116 -1.700 1.00 . A A . 23 THR HG22 1 1
13 4883 1 1 15 THR HG23 H -1.699 5.800 -0.569 1.00 . A A . 23 THR HG23 1 1
13 4884 1 1 15 THR N N -3.247 5.166 -4.026 1.00 . A A . 23 THR N 1 1
13 4885 1 1 15 THR O O -0.277 5.485 -5.805 1.00 . A A . 23 THR O 1 1
13 4886 1 1 15 THR OG1 O -1.259 3.933 -2.362 1.00 . A A . 23 THR OG1 1 1
13 4887 1 1 16 ARG C C -1.262 2.625 -7.407 1.00 . A A . 24 ARG C 1 1
13 4888 1 1 16 ARG CA C -0.471 2.739 -6.106 1.00 . A A . 24 ARG CA 1 1
13 4889 1 1 16 ARG CB C -0.205 1.341 -5.536 1.00 . A A . 24 ARG CB 1 1
13 4890 1 1 16 ARG CD C -1.342 -0.621 -4.472 1.00 . A A . 24 ARG CD 1 1
13 4891 1 1 16 ARG CG C -1.517 0.555 -5.436 1.00 . A A . 24 ARG CG 1 1
13 4892 1 1 16 ARG CZ C -0.009 -2.644 -4.312 1.00 . A A . 24 ARG CZ 1 1
13 4893 1 1 16 ARG H H -1.822 3.106 -4.504 1.00 . A A . 24 ARG H 1 1
13 4894 1 1 16 ARG HA H 0.479 3.211 -6.316 1.00 . A A . 24 ARG HA 1 1
13 4895 1 1 16 ARG HB2 H 0.482 0.814 -6.185 1.00 . A A . 24 ARG HB2 1 1
13 4896 1 1 16 ARG HB3 H 0.231 1.435 -4.550 1.00 . A A . 24 ARG HB3 1 1
13 4897 1 1 16 ARG HD2 H -1.073 -0.246 -3.496 1.00 . A A . 24 ARG HD2 1 1
13 4898 1 1 16 ARG HD3 H -2.274 -1.165 -4.400 1.00 . A A . 24 ARG HD3 1 1
13 4899 1 1 16 ARG HE H 0.209 -1.278 -5.757 1.00 . A A . 24 ARG HE 1 1
13 4900 1 1 16 ARG HG2 H -2.301 1.204 -5.073 1.00 . A A . 24 ARG HG2 1 1
13 4901 1 1 16 ARG HG3 H -1.783 0.178 -6.411 1.00 . A A . 24 ARG HG3 1 1
13 4902 1 1 16 ARG HH11 H -1.394 -2.369 -2.892 1.00 . A A . 24 ARG HH11 1 1
13 4903 1 1 16 ARG HH12 H -0.456 -3.819 -2.753 1.00 . A A . 24 ARG HH12 1 1
13 4904 1 1 16 ARG HH21 H 1.441 -3.177 -5.583 1.00 . A A . 24 ARG HH21 1 1
13 4905 1 1 16 ARG HH22 H 1.148 -4.277 -4.277 1.00 . A A . 24 ARG HH22 1 1
13 4906 1 1 16 ARG N N -1.201 3.547 -5.126 1.00 . A A . 24 ARG N 1 1
13 4907 1 1 16 ARG NE N -0.294 -1.514 -4.951 1.00 . A A . 24 ARG NE 1 1
13 4908 1 1 16 ARG NH1 N -0.672 -2.969 -3.234 1.00 . A A . 24 ARG NH1 1 1
13 4909 1 1 16 ARG NH2 N 0.934 -3.427 -4.759 1.00 . A A . 24 ARG NH2 1 1
13 4910 1 1 16 ARG O O -1.142 1.639 -8.134 1.00 . A A . 24 ARG O 1 1
13 4911 1 1 17 CYS C C -1.971 3.777 -10.150 1.00 . A A . 25 CYS C 1 1
13 4912 1 1 17 CYS CA C -2.874 3.648 -8.914 1.00 . A A . 25 CYS CA 1 1
13 4913 1 1 17 CYS CB C -3.859 4.821 -8.874 1.00 . A A . 25 CYS CB 1 1
13 4914 1 1 17 CYS H H -2.123 4.404 -7.081 1.00 . A A . 25 CYS H 1 1
13 4915 1 1 17 CYS HA H -3.431 2.727 -8.956 1.00 . A A . 25 CYS HA 1 1
13 4916 1 1 17 CYS HB2 H -4.643 4.609 -8.163 1.00 . A A . 25 CYS HB2 1 1
13 4917 1 1 17 CYS HB3 H -3.336 5.717 -8.574 1.00 . A A . 25 CYS HB3 1 1
13 4918 1 1 17 CYS N N -2.069 3.643 -7.697 1.00 . A A . 25 CYS N 1 1
13 4919 1 1 17 CYS O O -1.032 4.572 -10.143 1.00 . A A . 25 CYS O 1 1
13 4920 1 1 17 CYS SG S -4.589 5.073 -10.514 1.00 . A A . 25 CYS SG 1 1
13 4921 1 1 18 PRO C C -1.675 4.392 -13.241 1.00 . A A . 26 PRO C 1 1
13 4922 1 1 18 PRO CA C -1.396 3.113 -12.450 1.00 . A A . 26 PRO CA 1 1
13 4923 1 1 18 PRO CB C -1.814 1.866 -13.238 1.00 . A A . 26 PRO CB 1 1
13 4924 1 1 18 PRO CD C -3.312 2.041 -11.352 1.00 . A A . 26 PRO CD 1 1
13 4925 1 1 18 PRO CG C -3.225 1.612 -12.820 1.00 . A A . 26 PRO CG 1 1
13 4926 1 1 18 PRO HA H -0.348 3.050 -12.201 1.00 . A A . 26 PRO HA 1 1
13 4927 1 1 18 PRO HB2 H -1.758 2.050 -14.305 1.00 . A A . 26 PRO HB2 1 1
13 4928 1 1 18 PRO HB3 H -1.192 1.025 -12.970 1.00 . A A . 26 PRO HB3 1 1
13 4929 1 1 18 PRO HD2 H -4.273 2.491 -11.144 1.00 . A A . 26 PRO HD2 1 1
13 4930 1 1 18 PRO HD3 H -3.135 1.200 -10.699 1.00 . A A . 26 PRO HD3 1 1
13 4931 1 1 18 PRO HG2 H -3.903 2.201 -13.425 1.00 . A A . 26 PRO HG2 1 1
13 4932 1 1 18 PRO HG3 H -3.463 0.562 -12.910 1.00 . A A . 26 PRO HG3 1 1
13 4933 1 1 18 PRO N N -2.226 3.034 -11.209 1.00 . A A . 26 PRO N 1 1
13 4934 1 1 18 PRO O O -1.182 4.564 -14.356 1.00 . A A . 26 PRO O 1 1
13 4935 1 1 19 TYR C C -2.896 7.678 -12.276 1.00 . A A . 27 TYR C 1 1
13 4936 1 1 19 TYR CA C -2.809 6.555 -13.305 1.00 . A A . 27 TYR CA 1 1
13 4937 1 1 19 TYR CB C -4.151 6.431 -14.032 1.00 . A A . 27 TYR CB 1 1
13 4938 1 1 19 TYR CD1 C -3.203 5.183 -16.012 1.00 . A A . 27 TYR CD1 1 1
13 4939 1 1 19 TYR CD2 C -5.023 4.173 -14.767 1.00 . A A . 27 TYR CD2 1 1
13 4940 1 1 19 TYR CE1 C -3.179 4.079 -16.871 1.00 . A A . 27 TYR CE1 1 1
13 4941 1 1 19 TYR CE2 C -4.998 3.070 -15.628 1.00 . A A . 27 TYR CE2 1 1
13 4942 1 1 19 TYR CG C -4.125 5.233 -14.958 1.00 . A A . 27 TYR CG 1 1
13 4943 1 1 19 TYR CZ C -4.076 3.022 -16.680 1.00 . A A . 27 TYR CZ 1 1
13 4944 1 1 19 TYR H H -2.829 5.097 -11.762 1.00 . A A . 27 TYR H 1 1
13 4945 1 1 19 TYR HA H -2.043 6.806 -14.025 1.00 . A A . 27 TYR HA 1 1
13 4946 1 1 19 TYR HB2 H -4.941 6.311 -13.305 1.00 . A A . 27 TYR HB2 1 1
13 4947 1 1 19 TYR HB3 H -4.329 7.326 -14.610 1.00 . A A . 27 TYR HB3 1 1
13 4948 1 1 19 TYR HD1 H -2.511 5.998 -16.163 1.00 . A A . 27 TYR HD1 1 1
13 4949 1 1 19 TYR HD2 H -5.737 4.208 -13.955 1.00 . A A . 27 TYR HD2 1 1
13 4950 1 1 19 TYR HE1 H -2.467 4.042 -17.683 1.00 . A A . 27 TYR HE1 1 1
13 4951 1 1 19 TYR HE2 H -5.691 2.254 -15.480 1.00 . A A . 27 TYR HE2 1 1
13 4952 1 1 19 TYR HH H -3.298 2.032 -18.115 1.00 . A A . 27 TYR HH 1 1
13 4953 1 1 19 TYR N N -2.467 5.289 -12.653 1.00 . A A . 27 TYR N 1 1
13 4954 1 1 19 TYR O O -3.883 8.412 -12.227 1.00 . A A . 27 TYR O 1 1
13 4955 1 1 19 TYR OH O -4.052 1.933 -17.527 1.00 . A A . 27 TYR OH 1 1
13 4956 1 1 20 LYS C C -1.326 10.165 -11.034 1.00 . A A . 28 LYS C 1 1
13 4957 1 1 20 LYS CA C -1.820 8.851 -10.434 1.00 . A A . 28 LYS CA 1 1
13 4958 1 1 20 LYS CB C -0.910 8.425 -9.267 1.00 . A A . 28 LYS CB 1 1
13 4959 1 1 20 LYS CD C 1.024 8.453 -10.871 1.00 . A A . 28 LYS CD 1 1
13 4960 1 1 20 LYS CE C 2.409 7.851 -11.119 1.00 . A A . 28 LYS CE 1 1
13 4961 1 1 20 LYS CG C 0.298 7.641 -9.794 1.00 . A A . 28 LYS CG 1 1
13 4962 1 1 20 LYS H H -1.096 7.198 -11.547 1.00 . A A . 28 LYS H 1 1
13 4963 1 1 20 LYS HA H -2.820 9.003 -10.056 1.00 . A A . 28 LYS HA 1 1
13 4964 1 1 20 LYS HB2 H -0.564 9.301 -8.735 1.00 . A A . 28 LYS HB2 1 1
13 4965 1 1 20 LYS HB3 H -1.469 7.797 -8.590 1.00 . A A . 28 LYS HB3 1 1
13 4966 1 1 20 LYS HD2 H 0.453 8.428 -11.788 1.00 . A A . 28 LYS HD2 1 1
13 4967 1 1 20 LYS HD3 H 1.133 9.475 -10.541 1.00 . A A . 28 LYS HD3 1 1
13 4968 1 1 20 LYS HE2 H 2.325 6.777 -11.203 1.00 . A A . 28 LYS HE2 1 1
13 4969 1 1 20 LYS HE3 H 2.817 8.253 -12.033 1.00 . A A . 28 LYS HE3 1 1
13 4970 1 1 20 LYS HG2 H 0.977 7.443 -8.977 1.00 . A A . 28 LYS HG2 1 1
13 4971 1 1 20 LYS HG3 H -0.035 6.705 -10.215 1.00 . A A . 28 LYS HG3 1 1
13 4972 1 1 20 LYS HZ1 H 2.747 8.291 -9.111 1.00 . A A . 28 LYS HZ1 1 1
13 4973 1 1 20 LYS HZ2 H 3.799 9.086 -10.182 1.00 . A A . 28 LYS HZ2 1 1
13 4974 1 1 20 LYS HZ3 H 4.009 7.433 -9.853 1.00 . A A . 28 LYS HZ3 1 1
13 4975 1 1 20 LYS N N -1.854 7.808 -11.458 1.00 . A A . 28 LYS N 1 1
13 4976 1 1 20 LYS NZ N 3.309 8.190 -9.980 1.00 . A A . 28 LYS NZ 1 1
13 4977 1 1 20 LYS O O -0.891 11.065 -10.316 1.00 . A A . 28 LYS O 1 1
13 4978 1 1 21 ASP C C -1.708 12.678 -12.576 1.00 . A A . 29 ASP C 1 1
13 4979 1 1 21 ASP CA C -0.954 11.444 -13.058 1.00 . A A . 29 ASP CA 1 1
13 4980 1 1 21 ASP CB C -1.166 11.218 -14.558 1.00 . A A . 29 ASP CB 1 1
13 4981 1 1 21 ASP CG C -2.609 11.521 -14.965 1.00 . A A . 29 ASP CG 1 1
13 4982 1 1 21 ASP H H -1.741 9.511 -12.876 1.00 . A A . 29 ASP H 1 1
13 4983 1 1 21 ASP HA H 0.093 11.586 -12.870 1.00 . A A . 29 ASP HA 1 1
13 4984 1 1 21 ASP HB2 H -0.501 11.847 -15.106 1.00 . A A . 29 ASP HB2 1 1
13 4985 1 1 21 ASP HB3 H -0.948 10.187 -14.788 1.00 . A A . 29 ASP HB3 1 1
13 4986 1 1 21 ASP N N -1.393 10.259 -12.356 1.00 . A A . 29 ASP N 1 1
13 4987 1 1 21 ASP O O -1.434 13.801 -13.003 1.00 . A A . 29 ASP O 1 1
13 4988 1 1 21 ASP OD1 O -2.940 12.690 -15.071 1.00 . A A . 29 ASP OD1 1 1
13 4989 1 1 21 ASP OD2 O -3.358 10.580 -15.164 1.00 . A A . 29 ASP OD2 1 1
13 4990 1 1 22 THR C C -2.692 14.262 -10.030 1.00 . A A . 30 THR C 1 1
13 4991 1 1 22 THR CA C -3.457 13.537 -11.132 1.00 . A A . 30 THR CA 1 1
13 4992 1 1 22 THR CB C -4.767 12.982 -10.566 1.00 . A A . 30 THR CB 1 1
13 4993 1 1 22 THR CG2 C -5.553 12.291 -11.680 1.00 . A A . 30 THR CG2 1 1
13 4994 1 1 22 THR H H -2.814 11.533 -11.392 1.00 . A A . 30 THR H 1 1
13 4995 1 1 22 THR HA H -3.689 14.240 -11.918 1.00 . A A . 30 THR HA 1 1
13 4996 1 1 22 THR HB H -5.357 13.789 -10.162 1.00 . A A . 30 THR HB 1 1
13 4997 1 1 22 THR HG1 H -4.406 11.176 -9.940 1.00 . A A . 30 THR HG1 1 1
13 4998 1 1 22 THR HG21 H -5.074 11.357 -11.935 1.00 . A A . 30 THR HG21 1 1
13 4999 1 1 22 THR HG22 H -5.582 12.931 -12.550 1.00 . A A . 30 THR HG22 1 1
13 5000 1 1 22 THR HG23 H -6.561 12.097 -11.342 1.00 . A A . 30 THR HG23 1 1
13 5001 1 1 22 THR N N -2.655 12.452 -11.685 1.00 . A A . 30 THR N 1 1
13 5002 1 1 22 THR O O -2.823 15.475 -9.863 1.00 . A A . 30 THR O 1 1
13 5003 1 1 22 THR OG1 O -4.475 12.045 -9.537 1.00 . A A . 30 THR OG1 1 1
13 5004 1 1 23 LEU C C 0.093 14.846 -8.754 1.00 . A A . 31 LEU C 1 1
13 5005 1 1 23 LEU CA C -1.110 14.091 -8.194 1.00 . A A . 31 LEU CA 1 1
13 5006 1 1 23 LEU CB C -0.632 12.986 -7.244 1.00 . A A . 31 LEU CB 1 1
13 5007 1 1 23 LEU CD1 C -3.000 12.161 -7.203 1.00 . A A . 31 LEU CD1 1 1
13 5008 1 1 23 LEU CD2 C -1.346 11.319 -5.525 1.00 . A A . 31 LEU CD2 1 1
13 5009 1 1 23 LEU CG C -1.788 12.536 -6.344 1.00 . A A . 31 LEU CG 1 1
13 5010 1 1 23 LEU H H -1.828 12.549 -9.458 1.00 . A A . 31 LEU H 1 1
13 5011 1 1 23 LEU HA H -1.731 14.782 -7.645 1.00 . A A . 31 LEU HA 1 1
13 5012 1 1 23 LEU HB2 H -0.278 12.144 -7.821 1.00 . A A . 31 LEU HB2 1 1
13 5013 1 1 23 LEU HB3 H 0.173 13.361 -6.628 1.00 . A A . 31 LEU HB3 1 1
13 5014 1 1 23 LEU HD11 H -3.692 11.575 -6.615 1.00 . A A . 31 LEU HD11 1 1
13 5015 1 1 23 LEU HD12 H -2.674 11.584 -8.056 1.00 . A A . 31 LEU HD12 1 1
13 5016 1 1 23 LEU HD13 H -3.491 13.061 -7.542 1.00 . A A . 31 LEU HD13 1 1
13 5017 1 1 23 LEU HD21 H -0.555 11.608 -4.850 1.00 . A A . 31 LEU HD21 1 1
13 5018 1 1 23 LEU HD22 H -0.988 10.547 -6.191 1.00 . A A . 31 LEU HD22 1 1
13 5019 1 1 23 LEU HD23 H -2.185 10.943 -4.957 1.00 . A A . 31 LEU HD23 1 1
13 5020 1 1 23 LEU HG H -2.056 13.341 -5.676 1.00 . A A . 31 LEU HG 1 1
13 5021 1 1 23 LEU N N -1.893 13.510 -9.279 1.00 . A A . 31 LEU N 1 1
13 5022 1 1 23 LEU O O 0.547 14.575 -9.864 1.00 . A A . 31 LEU O 1 1
13 5023 1 1 24 GLY C C 1.862 17.871 -7.594 1.00 . A A . 32 GLY C 1 1
13 5024 1 1 24 GLY CA C 1.753 16.583 -8.402 1.00 . A A . 32 GLY CA 1 1
13 5025 1 1 24 GLY H H 0.199 15.968 -7.099 1.00 . A A . 32 GLY H 1 1
13 5026 1 1 24 GLY HA2 H 2.653 16.000 -8.266 1.00 . A A . 32 GLY HA2 1 1
13 5027 1 1 24 GLY HA3 H 1.645 16.833 -9.447 1.00 . A A . 32 GLY HA3 1 1
13 5028 1 1 24 GLY N N 0.603 15.795 -7.975 1.00 . A A . 32 GLY N 1 1
13 5029 1 1 24 GLY O O 0.926 18.653 -7.633 1.00 . A A . 32 GLY O 1 1
13 5030 1 1 24 GLY OXT O 2.880 18.058 -6.947 1.00 . A A . 32 GLY OXT 1 1
13 5031 2 2 1 ZN ZN ZN -6.687 4.347 -10.502 1.00 . B A . 300 ZN ZN 1 1
14 5032 1 1 1 LYS C C -10.370 -7.688 -3.253 1.00 . A A . 9 LYS C 1 1
14 5033 1 1 1 LYS CA C -10.351 -8.658 -2.075 1.00 . A A . 9 LYS CA 1 1
14 5034 1 1 1 LYS CB C -11.680 -9.412 -1.996 1.00 . A A . 9 LYS CB 1 1
14 5035 1 1 1 LYS CD C -12.970 -11.316 -2.974 1.00 . A A . 9 LYS CD 1 1
14 5036 1 1 1 LYS CE C -13.283 -12.059 -4.275 1.00 . A A . 9 LYS CE 1 1
14 5037 1 1 1 LYS CG C -11.821 -10.333 -3.210 1.00 . A A . 9 LYS CG 1 1
14 5038 1 1 1 LYS H1 H -10.635 -6.982 -0.871 1.00 . A A . 9 LYS H1 1 1
14 5039 1 1 1 LYS H2 H -9.123 -7.730 -0.673 1.00 . A A . 9 LYS H2 1 1
14 5040 1 1 1 LYS H3 H -10.517 -8.440 -0.011 1.00 . A A . 9 LYS H3 1 1
14 5041 1 1 1 LYS HA H -9.543 -9.363 -2.205 1.00 . A A . 9 LYS HA 1 1
14 5042 1 1 1 LYS HB2 H -11.705 -10.003 -1.090 1.00 . A A . 9 LYS HB2 1 1
14 5043 1 1 1 LYS HB3 H -12.495 -8.706 -1.987 1.00 . A A . 9 LYS HB3 1 1
14 5044 1 1 1 LYS HD2 H -12.684 -12.027 -2.212 1.00 . A A . 9 LYS HD2 1 1
14 5045 1 1 1 LYS HD3 H -13.847 -10.775 -2.652 1.00 . A A . 9 LYS HD3 1 1
14 5046 1 1 1 LYS HE2 H -12.374 -12.486 -4.673 1.00 . A A . 9 LYS HE2 1 1
14 5047 1 1 1 LYS HE3 H -13.994 -12.847 -4.078 1.00 . A A . 9 LYS HE3 1 1
14 5048 1 1 1 LYS HG2 H -12.028 -9.740 -4.089 1.00 . A A . 9 LYS HG2 1 1
14 5049 1 1 1 LYS HG3 H -10.904 -10.884 -3.354 1.00 . A A . 9 LYS HG3 1 1
14 5050 1 1 1 LYS HZ1 H -13.184 -10.961 -6.041 1.00 . A A . 9 LYS HZ1 1 1
14 5051 1 1 1 LYS HZ2 H -14.052 -10.196 -4.797 1.00 . A A . 9 LYS HZ2 1 1
14 5052 1 1 1 LYS HZ3 H -14.744 -11.495 -5.646 1.00 . A A . 9 LYS HZ3 1 1
14 5053 1 1 1 LYS N N -10.140 -7.895 -0.812 1.00 . A A . 9 LYS N 1 1
14 5054 1 1 1 LYS NZ N -13.859 -11.106 -5.265 1.00 . A A . 9 LYS NZ 1 1
14 5055 1 1 1 LYS O O -9.613 -7.846 -4.211 1.00 . A A . 9 LYS O 1 1
14 5056 1 1 2 ILE C C -11.614 -4.304 -3.637 1.00 . A A . 10 ILE C 1 1
14 5057 1 1 2 ILE CA C -11.364 -5.688 -4.234 1.00 . A A . 10 ILE CA 1 1
14 5058 1 1 2 ILE CB C -12.510 -6.079 -5.175 1.00 . A A . 10 ILE CB 1 1
14 5059 1 1 2 ILE CD1 C -13.564 -5.641 -7.401 1.00 . A A . 10 ILE CD1 1 1
14 5060 1 1 2 ILE CG1 C -12.406 -5.269 -6.472 1.00 . A A . 10 ILE CG1 1 1
14 5061 1 1 2 ILE CG2 C -13.870 -5.819 -4.507 1.00 . A A . 10 ILE CG2 1 1
14 5062 1 1 2 ILE H H -11.820 -6.613 -2.389 1.00 . A A . 10 ILE H 1 1
14 5063 1 1 2 ILE HA H -10.443 -5.657 -4.803 1.00 . A A . 10 ILE HA 1 1
14 5064 1 1 2 ILE HB H -12.427 -7.132 -5.404 1.00 . A A . 10 ILE HB 1 1
14 5065 1 1 2 ILE HD11 H -13.373 -5.249 -8.389 1.00 . A A . 10 ILE HD11 1 1
14 5066 1 1 2 ILE HD12 H -14.482 -5.220 -7.019 1.00 . A A . 10 ILE HD12 1 1
14 5067 1 1 2 ILE HD13 H -13.654 -6.716 -7.451 1.00 . A A . 10 ILE HD13 1 1
14 5068 1 1 2 ILE HG12 H -12.454 -4.214 -6.242 1.00 . A A . 10 ILE HG12 1 1
14 5069 1 1 2 ILE HG13 H -11.470 -5.490 -6.961 1.00 . A A . 10 ILE HG13 1 1
14 5070 1 1 2 ILE HG21 H -14.142 -4.779 -4.623 1.00 . A A . 10 ILE HG21 1 1
14 5071 1 1 2 ILE HG22 H -13.810 -6.059 -3.454 1.00 . A A . 10 ILE HG22 1 1
14 5072 1 1 2 ILE HG23 H -14.623 -6.439 -4.972 1.00 . A A . 10 ILE HG23 1 1
14 5073 1 1 2 ILE N N -11.243 -6.684 -3.174 1.00 . A A . 10 ILE N 1 1
14 5074 1 1 2 ILE O O -12.634 -4.067 -2.991 1.00 . A A . 10 ILE O 1 1
14 5075 1 1 3 VAL C C -10.979 -1.036 -4.459 1.00 . A A . 11 VAL C 1 1
14 5076 1 1 3 VAL CA C -10.772 -2.028 -3.330 1.00 . A A . 11 VAL CA 1 1
14 5077 1 1 3 VAL CB C -9.506 -1.662 -2.557 1.00 . A A . 11 VAL CB 1 1
14 5078 1 1 3 VAL CG1 C -8.286 -1.806 -3.468 1.00 . A A . 11 VAL CG1 1 1
14 5079 1 1 3 VAL CG2 C -9.608 -0.214 -2.069 1.00 . A A . 11 VAL CG2 1 1
14 5080 1 1 3 VAL H H -9.871 -3.647 -4.366 1.00 . A A . 11 VAL H 1 1
14 5081 1 1 3 VAL HA H -11.615 -1.956 -2.664 1.00 . A A . 11 VAL HA 1 1
14 5082 1 1 3 VAL HB H -9.402 -2.321 -1.708 1.00 . A A . 11 VAL HB 1 1
14 5083 1 1 3 VAL HG11 H -8.344 -2.743 -4.002 1.00 . A A . 11 VAL HG11 1 1
14 5084 1 1 3 VAL HG12 H -7.386 -1.787 -2.871 1.00 . A A . 11 VAL HG12 1 1
14 5085 1 1 3 VAL HG13 H -8.267 -0.990 -4.175 1.00 . A A . 11 VAL HG13 1 1
14 5086 1 1 3 VAL HG21 H -10.585 -0.047 -1.637 1.00 . A A . 11 VAL HG21 1 1
14 5087 1 1 3 VAL HG22 H -9.465 0.458 -2.903 1.00 . A A . 11 VAL HG22 1 1
14 5088 1 1 3 VAL HG23 H -8.849 -0.030 -1.324 1.00 . A A . 11 VAL HG23 1 1
14 5089 1 1 3 VAL N N -10.664 -3.394 -3.852 1.00 . A A . 11 VAL N 1 1
14 5090 1 1 3 VAL O O -10.344 -1.126 -5.510 1.00 . A A . 11 VAL O 1 1
14 5091 1 1 4 SER C C -11.172 2.080 -5.125 1.00 . A A . 12 SER C 1 1
14 5092 1 1 4 SER CA C -12.165 0.935 -5.226 1.00 . A A . 12 SER CA 1 1
14 5093 1 1 4 SER CB C -13.576 1.477 -5.045 1.00 . A A . 12 SER CB 1 1
14 5094 1 1 4 SER H H -12.344 -0.064 -3.367 1.00 . A A . 12 SER H 1 1
14 5095 1 1 4 SER HA H -12.088 0.496 -6.210 1.00 . A A . 12 SER HA 1 1
14 5096 1 1 4 SER HB2 H -13.710 2.331 -5.687 1.00 . A A . 12 SER HB2 1 1
14 5097 1 1 4 SER HB3 H -14.291 0.711 -5.314 1.00 . A A . 12 SER HB3 1 1
14 5098 1 1 4 SER HG H -14.540 1.415 -3.356 1.00 . A A . 12 SER HG 1 1
14 5099 1 1 4 SER N N -11.874 -0.082 -4.227 1.00 . A A . 12 SER N 1 1
14 5100 1 1 4 SER O O -11.070 2.751 -4.097 1.00 . A A . 12 SER O 1 1
14 5101 1 1 4 SER OG O -13.763 1.869 -3.693 1.00 . A A . 12 SER OG 1 1
14 5102 1 1 5 CYS C C -10.131 4.709 -5.998 1.00 . A A . 13 CYS C 1 1
14 5103 1 1 5 CYS CA C -9.465 3.361 -6.274 1.00 . A A . 13 CYS CA 1 1
14 5104 1 1 5 CYS CB C -8.810 3.366 -7.659 1.00 . A A . 13 CYS CB 1 1
14 5105 1 1 5 CYS H H -10.603 1.717 -6.984 1.00 . A A . 13 CYS H 1 1
14 5106 1 1 5 CYS HA H -8.706 3.184 -5.527 1.00 . A A . 13 CYS HA 1 1
14 5107 1 1 5 CYS HB2 H -8.648 2.349 -7.981 1.00 . A A . 13 CYS HB2 1 1
14 5108 1 1 5 CYS HB3 H -9.456 3.864 -8.362 1.00 . A A . 13 CYS HB3 1 1
14 5109 1 1 5 CYS N N -10.456 2.292 -6.208 1.00 . A A . 13 CYS N 1 1
14 5110 1 1 5 CYS O O -11.200 4.764 -5.391 1.00 . A A . 13 CYS O 1 1
14 5111 1 1 5 CYS SG S -7.221 4.231 -7.593 1.00 . A A . 13 CYS SG 1 1
14 5112 1 1 6 ARG C C -9.756 8.039 -7.430 1.00 . A A . 14 ARG C 1 1
14 5113 1 1 6 ARG CA C -10.056 7.136 -6.233 1.00 . A A . 14 ARG CA 1 1
14 5114 1 1 6 ARG CB C -9.463 7.747 -4.947 1.00 . A A . 14 ARG CB 1 1
14 5115 1 1 6 ARG CD C -11.447 7.969 -3.399 1.00 . A A . 14 ARG CD 1 1
14 5116 1 1 6 ARG CG C -10.465 8.728 -4.301 1.00 . A A . 14 ARG CG 1 1
14 5117 1 1 6 ARG CZ C -11.352 6.684 -1.340 1.00 . A A . 14 ARG CZ 1 1
14 5118 1 1 6 ARG H H -8.650 5.695 -6.923 1.00 . A A . 14 ARG H 1 1
14 5119 1 1 6 ARG HA H -11.128 7.059 -6.126 1.00 . A A . 14 ARG HA 1 1
14 5120 1 1 6 ARG HB2 H -9.236 6.952 -4.250 1.00 . A A . 14 ARG HB2 1 1
14 5121 1 1 6 ARG HB3 H -8.550 8.277 -5.184 1.00 . A A . 14 ARG HB3 1 1
14 5122 1 1 6 ARG HD2 H -12.103 8.675 -2.914 1.00 . A A . 14 ARG HD2 1 1
14 5123 1 1 6 ARG HD3 H -12.035 7.291 -3.998 1.00 . A A . 14 ARG HD3 1 1
14 5124 1 1 6 ARG HE H -9.753 7.096 -2.470 1.00 . A A . 14 ARG HE 1 1
14 5125 1 1 6 ARG HG2 H -9.925 9.452 -3.708 1.00 . A A . 14 ARG HG2 1 1
14 5126 1 1 6 ARG HG3 H -11.017 9.242 -5.074 1.00 . A A . 14 ARG HG3 1 1
14 5127 1 1 6 ARG HH11 H -13.155 7.352 -1.895 1.00 . A A . 14 ARG HH11 1 1
14 5128 1 1 6 ARG HH12 H -13.116 6.436 -0.426 1.00 . A A . 14 ARG HH12 1 1
14 5129 1 1 6 ARG HH21 H -9.693 5.896 -0.544 1.00 . A A . 14 ARG HH21 1 1
14 5130 1 1 6 ARG HH22 H -11.155 5.611 0.340 1.00 . A A . 14 ARG HH22 1 1
14 5131 1 1 6 ARG N N -9.500 5.795 -6.445 1.00 . A A . 14 ARG N 1 1
14 5132 1 1 6 ARG NE N -10.721 7.215 -2.383 1.00 . A A . 14 ARG NE 1 1
14 5133 1 1 6 ARG NH1 N -12.642 6.835 -1.210 1.00 . A A . 14 ARG NH1 1 1
14 5134 1 1 6 ARG NH2 N -10.681 6.011 -0.445 1.00 . A A . 14 ARG NH2 1 1
14 5135 1 1 6 ARG O O -10.001 9.245 -7.386 1.00 . A A . 14 ARG O 1 1
14 5136 1 1 7 ILE C C -9.481 7.494 -10.932 1.00 . A A . 15 ILE C 1 1
14 5137 1 1 7 ILE CA C -8.894 8.194 -9.714 1.00 . A A . 15 ILE CA 1 1
14 5138 1 1 7 ILE CB C -7.375 8.285 -9.870 1.00 . A A . 15 ILE CB 1 1
14 5139 1 1 7 ILE CD1 C -5.259 8.656 -8.592 1.00 . A A . 15 ILE CD1 1 1
14 5140 1 1 7 ILE CG1 C -6.763 8.933 -8.622 1.00 . A A . 15 ILE CG1 1 1
14 5141 1 1 7 ILE CG2 C -7.038 9.131 -11.100 1.00 . A A . 15 ILE CG2 1 1
14 5142 1 1 7 ILE H H -9.057 6.482 -8.471 1.00 . A A . 15 ILE H 1 1
14 5143 1 1 7 ILE HA H -9.301 9.194 -9.653 1.00 . A A . 15 ILE HA 1 1
14 5144 1 1 7 ILE HB H -6.970 7.291 -9.999 1.00 . A A . 15 ILE HB 1 1
14 5145 1 1 7 ILE HD11 H -5.092 7.590 -8.623 1.00 . A A . 15 ILE HD11 1 1
14 5146 1 1 7 ILE HD12 H -4.837 9.061 -7.685 1.00 . A A . 15 ILE HD12 1 1
14 5147 1 1 7 ILE HD13 H -4.791 9.120 -9.447 1.00 . A A . 15 ILE HD13 1 1
14 5148 1 1 7 ILE HG12 H -6.934 9.999 -8.647 1.00 . A A . 15 ILE HG12 1 1
14 5149 1 1 7 ILE HG13 H -7.218 8.516 -7.737 1.00 . A A . 15 ILE HG13 1 1
14 5150 1 1 7 ILE HG21 H -5.993 9.400 -11.078 1.00 . A A . 15 ILE HG21 1 1
14 5151 1 1 7 ILE HG22 H -7.641 10.027 -11.095 1.00 . A A . 15 ILE HG22 1 1
14 5152 1 1 7 ILE HG23 H -7.246 8.563 -11.995 1.00 . A A . 15 ILE HG23 1 1
14 5153 1 1 7 ILE N N -9.226 7.446 -8.498 1.00 . A A . 15 ILE N 1 1
14 5154 1 1 7 ILE O O -9.909 8.137 -11.890 1.00 . A A . 15 ILE O 1 1
14 5155 1 1 8 CYS C C -11.015 4.330 -11.419 1.00 . A A . 16 CYS C 1 1
14 5156 1 1 8 CYS CA C -10.027 5.349 -11.971 1.00 . A A . 16 CYS CA 1 1
14 5157 1 1 8 CYS CB C -8.880 4.621 -12.670 1.00 . A A . 16 CYS CB 1 1
14 5158 1 1 8 CYS H H -9.139 5.715 -10.088 1.00 . A A . 16 CYS H 1 1
14 5159 1 1 8 CYS HA H -10.534 5.980 -12.690 1.00 . A A . 16 CYS HA 1 1
14 5160 1 1 8 CYS HB2 H -9.242 4.170 -13.583 1.00 . A A . 16 CYS HB2 1 1
14 5161 1 1 8 CYS HB3 H -8.096 5.325 -12.902 1.00 . A A . 16 CYS HB3 1 1
14 5162 1 1 8 CYS N N -9.495 6.164 -10.881 1.00 . A A . 16 CYS N 1 1
14 5163 1 1 8 CYS O O -11.713 3.651 -12.173 1.00 . A A . 16 CYS O 1 1
14 5164 1 1 8 CYS SG S -8.234 3.335 -11.575 1.00 . A A . 16 CYS SG 1 1
14 5165 1 1 9 LYS C C -11.714 1.876 -9.921 1.00 . A A . 17 LYS C 1 1
14 5166 1 1 9 LYS CA C -11.969 3.300 -9.437 1.00 . A A . 17 LYS CA 1 1
14 5167 1 1 9 LYS CB C -13.421 3.690 -9.721 1.00 . A A . 17 LYS CB 1 1
14 5168 1 1 9 LYS CD C -14.050 5.190 -7.769 1.00 . A A . 17 LYS CD 1 1
14 5169 1 1 9 LYS CE C -15.569 5.065 -7.582 1.00 . A A . 17 LYS CE 1 1
14 5170 1 1 9 LYS CG C -13.687 5.143 -9.272 1.00 . A A . 17 LYS CG 1 1
14 5171 1 1 9 LYS H H -10.488 4.801 -9.547 1.00 . A A . 17 LYS H 1 1
14 5172 1 1 9 LYS HA H -11.799 3.341 -8.374 1.00 . A A . 17 LYS HA 1 1
14 5173 1 1 9 LYS HB2 H -13.614 3.601 -10.781 1.00 . A A . 17 LYS HB2 1 1
14 5174 1 1 9 LYS HB3 H -14.071 3.024 -9.185 1.00 . A A . 17 LYS HB3 1 1
14 5175 1 1 9 LYS HD2 H -13.559 4.380 -7.249 1.00 . A A . 17 LYS HD2 1 1
14 5176 1 1 9 LYS HD3 H -13.720 6.131 -7.351 1.00 . A A . 17 LYS HD3 1 1
14 5177 1 1 9 LYS HE2 H -15.781 4.709 -6.584 1.00 . A A . 17 LYS HE2 1 1
14 5178 1 1 9 LYS HE3 H -16.030 6.032 -7.724 1.00 . A A . 17 LYS HE3 1 1
14 5179 1 1 9 LYS HG2 H -12.802 5.741 -9.445 1.00 . A A . 17 LYS HG2 1 1
14 5180 1 1 9 LYS HG3 H -14.503 5.551 -9.852 1.00 . A A . 17 LYS HG3 1 1
14 5181 1 1 9 LYS HZ1 H -15.884 4.422 -9.537 1.00 . A A . 17 LYS HZ1 1 1
14 5182 1 1 9 LYS HZ2 H -17.156 4.053 -8.474 1.00 . A A . 17 LYS HZ2 1 1
14 5183 1 1 9 LYS HZ3 H -15.711 3.162 -8.415 1.00 . A A . 17 LYS HZ3 1 1
14 5184 1 1 9 LYS N N -11.067 4.233 -10.094 1.00 . A A . 17 LYS N 1 1
14 5185 1 1 9 LYS NZ N -16.122 4.103 -8.577 1.00 . A A . 17 LYS NZ 1 1
14 5186 1 1 9 LYS O O -12.649 1.106 -10.134 1.00 . A A . 17 LYS O 1 1
14 5187 1 1 10 GLY C C -9.966 -0.768 -9.369 1.00 . A A . 18 GLY C 1 1
14 5188 1 1 10 GLY CA C -10.065 0.198 -10.545 1.00 . A A . 18 GLY CA 1 1
14 5189 1 1 10 GLY H H -9.737 2.190 -9.901 1.00 . A A . 18 GLY H 1 1
14 5190 1 1 10 GLY HA2 H -10.809 -0.164 -11.242 1.00 . A A . 18 GLY HA2 1 1
14 5191 1 1 10 GLY HA3 H -9.108 0.247 -11.041 1.00 . A A . 18 GLY HA3 1 1
14 5192 1 1 10 GLY N N -10.439 1.534 -10.089 1.00 . A A . 18 GLY N 1 1
14 5193 1 1 10 GLY O O -10.846 -0.807 -8.509 1.00 . A A . 18 GLY O 1 1
14 5194 1 1 11 ASP C C -7.360 -2.223 -7.532 1.00 . A A . 19 ASP C 1 1
14 5195 1 1 11 ASP CA C -8.665 -2.521 -8.264 1.00 . A A . 19 ASP CA 1 1
14 5196 1 1 11 ASP CB C -8.608 -3.933 -8.850 1.00 . A A . 19 ASP CB 1 1
14 5197 1 1 11 ASP CG C -7.400 -4.066 -9.771 1.00 . A A . 19 ASP CG 1 1
14 5198 1 1 11 ASP H H -8.220 -1.470 -10.053 1.00 . A A . 19 ASP H 1 1
14 5199 1 1 11 ASP HA H -9.481 -2.472 -7.554 1.00 . A A . 19 ASP HA 1 1
14 5200 1 1 11 ASP HB2 H -8.527 -4.651 -8.047 1.00 . A A . 19 ASP HB2 1 1
14 5201 1 1 11 ASP HB3 H -9.509 -4.123 -9.413 1.00 . A A . 19 ASP HB3 1 1
14 5202 1 1 11 ASP N N -8.886 -1.547 -9.338 1.00 . A A . 19 ASP N 1 1
14 5203 1 1 11 ASP O O -6.435 -3.034 -7.539 1.00 . A A . 19 ASP O 1 1
14 5204 1 1 11 ASP OD1 O -6.952 -3.052 -10.279 1.00 . A A . 19 ASP OD1 1 1
14 5205 1 1 11 ASP OD2 O -6.942 -5.182 -9.956 1.00 . A A . 19 ASP OD2 1 1
14 5206 1 1 12 HIS C C -6.296 0.730 -5.562 1.00 . A A . 20 HIS C 1 1
14 5207 1 1 12 HIS CA C -6.106 -0.659 -6.161 1.00 . A A . 20 HIS CA 1 1
14 5208 1 1 12 HIS CB C -4.880 -0.664 -7.085 1.00 . A A . 20 HIS CB 1 1
14 5209 1 1 12 HIS CD2 C -5.664 1.175 -8.796 1.00 . A A . 20 HIS CD2 1 1
14 5210 1 1 12 HIS CE1 C -5.526 -0.005 -10.607 1.00 . A A . 20 HIS CE1 1 1
14 5211 1 1 12 HIS CG C -5.239 -0.078 -8.423 1.00 . A A . 20 HIS CG 1 1
14 5212 1 1 12 HIS H H -8.063 -0.450 -6.921 1.00 . A A . 20 HIS H 1 1
14 5213 1 1 12 HIS HA H -5.942 -1.365 -5.361 1.00 . A A . 20 HIS HA 1 1
14 5214 1 1 12 HIS HB2 H -4.089 -0.080 -6.640 1.00 . A A . 20 HIS HB2 1 1
14 5215 1 1 12 HIS HB3 H -4.538 -1.680 -7.220 1.00 . A A . 20 HIS HB3 1 1
14 5216 1 1 12 HIS HD2 H -5.832 2.002 -8.124 1.00 . A A . 20 HIS HD2 1 1
14 5217 1 1 12 HIS HE1 H -5.556 -0.308 -11.643 1.00 . A A . 20 HIS HE1 1 1
14 5218 1 1 12 HIS N N -7.296 -1.055 -6.898 1.00 . A A . 20 HIS N 1 1
14 5219 1 1 12 HIS ND1 N -5.160 -0.813 -9.595 1.00 . A A . 20 HIS ND1 1 1
14 5220 1 1 12 HIS NE2 N -5.843 1.218 -10.174 1.00 . A A . 20 HIS NE2 1 1
14 5221 1 1 12 HIS O O -6.977 1.580 -6.135 1.00 . A A . 20 HIS O 1 1
14 5222 1 1 13 TRP C C -5.228 3.341 -4.622 1.00 . A A . 21 TRP C 1 1
14 5223 1 1 13 TRP CA C -5.792 2.238 -3.731 1.00 . A A . 21 TRP CA 1 1
14 5224 1 1 13 TRP CB C -5.020 2.203 -2.411 1.00 . A A . 21 TRP CB 1 1
14 5225 1 1 13 TRP CD1 C -5.840 -0.019 -1.528 1.00 . A A . 21 TRP CD1 1 1
14 5226 1 1 13 TRP CD2 C -6.446 1.708 -0.219 1.00 . A A . 21 TRP CD2 1 1
14 5227 1 1 13 TRP CE2 C -6.965 0.539 0.385 1.00 . A A . 21 TRP CE2 1 1
14 5228 1 1 13 TRP CE3 C -6.687 2.944 0.409 1.00 . A A . 21 TRP CE3 1 1
14 5229 1 1 13 TRP CG C -5.736 1.327 -1.434 1.00 . A A . 21 TRP CG 1 1
14 5230 1 1 13 TRP CH2 C -7.928 1.828 2.184 1.00 . A A . 21 TRP CH2 1 1
14 5231 1 1 13 TRP CZ2 C -7.697 0.593 1.572 1.00 . A A . 21 TRP CZ2 1 1
14 5232 1 1 13 TRP CZ3 C -7.424 3.002 1.604 1.00 . A A . 21 TRP CZ3 1 1
14 5233 1 1 13 TRP H H -5.166 0.232 -3.999 1.00 . A A . 21 TRP H 1 1
14 5234 1 1 13 TRP HA H -6.831 2.448 -3.526 1.00 . A A . 21 TRP HA 1 1
14 5235 1 1 13 TRP HB2 H -4.029 1.812 -2.584 1.00 . A A . 21 TRP HB2 1 1
14 5236 1 1 13 TRP HB3 H -4.947 3.204 -2.010 1.00 . A A . 21 TRP HB3 1 1
14 5237 1 1 13 TRP HD1 H -5.423 -0.628 -2.316 1.00 . A A . 21 TRP HD1 1 1
14 5238 1 1 13 TRP HE1 H -6.788 -1.427 -0.280 1.00 . A A . 21 TRP HE1 1 1
14 5239 1 1 13 TRP HE3 H -6.304 3.853 -0.029 1.00 . A A . 21 TRP HE3 1 1
14 5240 1 1 13 TRP HH2 H -8.493 1.880 3.102 1.00 . A A . 21 TRP HH2 1 1
14 5241 1 1 13 TRP HZ2 H -8.082 -0.313 2.015 1.00 . A A . 21 TRP HZ2 1 1
14 5242 1 1 13 TRP HZ3 H -7.604 3.955 2.078 1.00 . A A . 21 TRP HZ3 1 1
14 5243 1 1 13 TRP N N -5.690 0.949 -4.404 1.00 . A A . 21 TRP N 1 1
14 5244 1 1 13 TRP NE1 N -6.569 -0.488 -0.449 1.00 . A A . 21 TRP NE1 1 1
14 5245 1 1 13 TRP O O -4.986 3.128 -5.810 1.00 . A A . 21 TRP O 1 1
14 5246 1 1 14 THR C C -2.954 5.551 -4.877 1.00 . A A . 22 THR C 1 1
14 5247 1 1 14 THR CA C -4.475 5.645 -4.796 1.00 . A A . 22 THR CA 1 1
14 5248 1 1 14 THR CB C -4.872 6.962 -4.126 1.00 . A A . 22 THR CB 1 1
14 5249 1 1 14 THR CG2 C -6.391 7.019 -3.964 1.00 . A A . 22 THR CG2 1 1
14 5250 1 1 14 THR H H -5.224 4.631 -3.091 1.00 . A A . 22 THR H 1 1
14 5251 1 1 14 THR HA H -4.882 5.628 -5.797 1.00 . A A . 22 THR HA 1 1
14 5252 1 1 14 THR HB H -4.548 7.790 -4.737 1.00 . A A . 22 THR HB 1 1
14 5253 1 1 14 THR HG1 H -4.894 6.766 -2.190 1.00 . A A . 22 THR HG1 1 1
14 5254 1 1 14 THR HG21 H -6.691 6.380 -3.146 1.00 . A A . 22 THR HG21 1 1
14 5255 1 1 14 THR HG22 H -6.864 6.681 -4.875 1.00 . A A . 22 THR HG22 1 1
14 5256 1 1 14 THR HG23 H -6.694 8.035 -3.757 1.00 . A A . 22 THR HG23 1 1
14 5257 1 1 14 THR N N -5.015 4.518 -4.041 1.00 . A A . 22 THR N 1 1
14 5258 1 1 14 THR O O -2.376 5.594 -5.962 1.00 . A A . 22 THR O 1 1
14 5259 1 1 14 THR OG1 O -4.254 7.047 -2.848 1.00 . A A . 22 THR OG1 1 1
14 5260 1 1 15 THR C C -0.353 4.319 -4.704 1.00 . A A . 23 THR C 1 1
14 5261 1 1 15 THR CA C -0.857 5.319 -3.669 1.00 . A A . 23 THR CA 1 1
14 5262 1 1 15 THR CB C -0.410 4.880 -2.272 1.00 . A A . 23 THR CB 1 1
14 5263 1 1 15 THR CG2 C -0.794 5.953 -1.252 1.00 . A A . 23 THR CG2 1 1
14 5264 1 1 15 THR H H -2.825 5.390 -2.884 1.00 . A A . 23 THR H 1 1
14 5265 1 1 15 THR HA H -0.431 6.288 -3.882 1.00 . A A . 23 THR HA 1 1
14 5266 1 1 15 THR HB H 0.659 4.745 -2.261 1.00 . A A . 23 THR HB 1 1
14 5267 1 1 15 THR HG1 H -1.647 3.427 -2.652 1.00 . A A . 23 THR HG1 1 1
14 5268 1 1 15 THR HG21 H -0.440 5.661 -0.273 1.00 . A A . 23 THR HG21 1 1
14 5269 1 1 15 THR HG22 H -1.868 6.061 -1.229 1.00 . A A . 23 THR HG22 1 1
14 5270 1 1 15 THR HG23 H -0.343 6.893 -1.531 1.00 . A A . 23 THR HG23 1 1
14 5271 1 1 15 THR N N -2.312 5.420 -3.718 1.00 . A A . 23 THR N 1 1
14 5272 1 1 15 THR O O 0.824 4.322 -5.065 1.00 . A A . 23 THR O 1 1
14 5273 1 1 15 THR OG1 O -1.048 3.655 -1.937 1.00 . A A . 23 THR OG1 1 1
14 5274 1 1 16 ARG C C -1.834 2.574 -7.392 1.00 . A A . 24 ARG C 1 1
14 5275 1 1 16 ARG CA C -0.911 2.448 -6.181 1.00 . A A . 24 ARG CA 1 1
14 5276 1 1 16 ARG CB C -1.033 1.047 -5.563 1.00 . A A . 24 ARG CB 1 1
14 5277 1 1 16 ARG CD C -2.443 -0.412 -4.103 1.00 . A A . 24 ARG CD 1 1
14 5278 1 1 16 ARG CG C -2.215 1.020 -4.593 1.00 . A A . 24 ARG CG 1 1
14 5279 1 1 16 ARG CZ C -2.737 -2.627 -5.054 1.00 . A A . 24 ARG CZ 1 1
14 5280 1 1 16 ARG H H -2.179 3.511 -4.853 1.00 . A A . 24 ARG H 1 1
14 5281 1 1 16 ARG HA H 0.110 2.596 -6.510 1.00 . A A . 24 ARG HA 1 1
14 5282 1 1 16 ARG HB2 H -1.185 0.311 -6.343 1.00 . A A . 24 ARG HB2 1 1
14 5283 1 1 16 ARG HB3 H -0.126 0.813 -5.023 1.00 . A A . 24 ARG HB3 1 1
14 5284 1 1 16 ARG HD2 H -1.604 -0.719 -3.497 1.00 . A A . 24 ARG HD2 1 1
14 5285 1 1 16 ARG HD3 H -3.343 -0.446 -3.507 1.00 . A A . 24 ARG HD3 1 1
14 5286 1 1 16 ARG HE H -2.543 -0.962 -6.147 1.00 . A A . 24 ARG HE 1 1
14 5287 1 1 16 ARG HG2 H -2.001 1.660 -3.749 1.00 . A A . 24 ARG HG2 1 1
14 5288 1 1 16 ARG HG3 H -3.103 1.372 -5.096 1.00 . A A . 24 ARG HG3 1 1
14 5289 1 1 16 ARG HH11 H -2.687 -2.509 -3.056 1.00 . A A . 24 ARG HH11 1 1
14 5290 1 1 16 ARG HH12 H -2.902 -4.100 -3.707 1.00 . A A . 24 ARG HH12 1 1
14 5291 1 1 16 ARG HH21 H -2.824 -3.044 -7.010 1.00 . A A . 24 ARG HH21 1 1
14 5292 1 1 16 ARG HH22 H -2.980 -4.402 -5.946 1.00 . A A . 24 ARG HH22 1 1
14 5293 1 1 16 ARG N N -1.257 3.461 -5.180 1.00 . A A . 24 ARG N 1 1
14 5294 1 1 16 ARG NE N -2.574 -1.320 -5.236 1.00 . A A . 24 ARG NE 1 1
14 5295 1 1 16 ARG NH1 N -2.779 -3.116 -3.845 1.00 . A A . 24 ARG NH1 1 1
14 5296 1 1 16 ARG NH2 N -2.857 -3.420 -6.084 1.00 . A A . 24 ARG NH2 1 1
14 5297 1 1 16 ARG O O -2.470 1.606 -7.810 1.00 . A A . 24 ARG O 1 1
14 5298 1 1 17 CYS C C -1.896 4.613 -10.259 1.00 . A A . 25 CYS C 1 1
14 5299 1 1 17 CYS CA C -2.740 4.054 -9.119 1.00 . A A . 25 CYS CA 1 1
14 5300 1 1 17 CYS CB C -3.822 5.072 -8.753 1.00 . A A . 25 CYS CB 1 1
14 5301 1 1 17 CYS H H -1.366 4.512 -7.568 1.00 . A A . 25 CYS H 1 1
14 5302 1 1 17 CYS HA H -3.221 3.143 -9.445 1.00 . A A . 25 CYS HA 1 1
14 5303 1 1 17 CYS HB2 H -4.381 4.715 -7.902 1.00 . A A . 25 CYS HB2 1 1
14 5304 1 1 17 CYS HB3 H -3.358 6.017 -8.511 1.00 . A A . 25 CYS HB3 1 1
14 5305 1 1 17 CYS N N -1.899 3.784 -7.951 1.00 . A A . 25 CYS N 1 1
14 5306 1 1 17 CYS O O -1.877 5.822 -10.489 1.00 . A A . 25 CYS O 1 1
14 5307 1 1 17 CYS SG S -4.938 5.296 -10.160 1.00 . A A . 25 CYS SG 1 1
14 5308 1 1 18 PRO C C -1.023 5.210 -13.012 1.00 . A A . 26 PRO C 1 1
14 5309 1 1 18 PRO CA C -0.326 4.198 -12.103 1.00 . A A . 26 PRO CA 1 1
14 5310 1 1 18 PRO CB C -0.032 2.886 -12.840 1.00 . A A . 26 PRO CB 1 1
14 5311 1 1 18 PRO CD C -1.150 2.304 -10.777 1.00 . A A . 26 PRO CD 1 1
14 5312 1 1 18 PRO CG C -0.081 1.839 -11.774 1.00 . A A . 26 PRO CG 1 1
14 5313 1 1 18 PRO HA H 0.596 4.612 -11.727 1.00 . A A . 26 PRO HA 1 1
14 5314 1 1 18 PRO HB2 H -0.788 2.698 -13.592 1.00 . A A . 26 PRO HB2 1 1
14 5315 1 1 18 PRO HB3 H 0.949 2.914 -13.290 1.00 . A A . 26 PRO HB3 1 1
14 5316 1 1 18 PRO HD2 H -2.106 1.856 -11.015 1.00 . A A . 26 PRO HD2 1 1
14 5317 1 1 18 PRO HD3 H -0.860 2.069 -9.764 1.00 . A A . 26 PRO HD3 1 1
14 5318 1 1 18 PRO HG2 H -0.353 0.883 -12.203 1.00 . A A . 26 PRO HG2 1 1
14 5319 1 1 18 PRO HG3 H 0.875 1.767 -11.276 1.00 . A A . 26 PRO HG3 1 1
14 5320 1 1 18 PRO N N -1.194 3.767 -10.969 1.00 . A A . 26 PRO N 1 1
14 5321 1 1 18 PRO O O -0.388 5.837 -13.860 1.00 . A A . 26 PRO O 1 1
14 5322 1 1 19 TYR C C -3.139 7.681 -12.961 1.00 . A A . 27 TYR C 1 1
14 5323 1 1 19 TYR CA C -3.110 6.309 -13.626 1.00 . A A . 27 TYR CA 1 1
14 5324 1 1 19 TYR CB C -4.541 5.793 -13.792 1.00 . A A . 27 TYR CB 1 1
14 5325 1 1 19 TYR CD1 C -3.986 4.149 -15.621 1.00 . A A . 27 TYR CD1 1 1
14 5326 1 1 19 TYR CD2 C -5.000 3.315 -13.581 1.00 . A A . 27 TYR CD2 1 1
14 5327 1 1 19 TYR CE1 C -3.954 2.848 -16.137 1.00 . A A . 27 TYR CE1 1 1
14 5328 1 1 19 TYR CE2 C -4.968 2.014 -14.098 1.00 . A A . 27 TYR CE2 1 1
14 5329 1 1 19 TYR CG C -4.509 4.385 -14.344 1.00 . A A . 27 TYR CG 1 1
14 5330 1 1 19 TYR CZ C -4.444 1.781 -15.375 1.00 . A A . 27 TYR CZ 1 1
14 5331 1 1 19 TYR H H -2.782 4.841 -12.130 1.00 . A A . 27 TYR H 1 1
14 5332 1 1 19 TYR HA H -2.660 6.404 -14.602 1.00 . A A . 27 TYR HA 1 1
14 5333 1 1 19 TYR HB2 H -5.038 5.798 -12.832 1.00 . A A . 27 TYR HB2 1 1
14 5334 1 1 19 TYR HB3 H -5.077 6.434 -14.476 1.00 . A A . 27 TYR HB3 1 1
14 5335 1 1 19 TYR HD1 H -3.607 4.972 -16.209 1.00 . A A . 27 TYR HD1 1 1
14 5336 1 1 19 TYR HD2 H -5.403 3.495 -12.596 1.00 . A A . 27 TYR HD2 1 1
14 5337 1 1 19 TYR HE1 H -3.551 2.668 -17.122 1.00 . A A . 27 TYR HE1 1 1
14 5338 1 1 19 TYR HE2 H -5.345 1.191 -13.510 1.00 . A A . 27 TYR HE2 1 1
14 5339 1 1 19 TYR HH H -5.296 0.129 -15.810 1.00 . A A . 27 TYR HH 1 1
14 5340 1 1 19 TYR N N -2.332 5.366 -12.823 1.00 . A A . 27 TYR N 1 1
14 5341 1 1 19 TYR O O -4.015 8.500 -13.240 1.00 . A A . 27 TYR O 1 1
14 5342 1 1 19 TYR OH O -4.413 0.498 -15.883 1.00 . A A . 27 TYR OH 1 1
14 5343 1 1 20 LYS C C -1.474 10.268 -12.265 1.00 . A A . 28 LYS C 1 1
14 5344 1 1 20 LYS CA C -2.092 9.194 -11.373 1.00 . A A . 28 LYS CA 1 1
14 5345 1 1 20 LYS CB C -1.271 9.022 -10.086 1.00 . A A . 28 LYS CB 1 1
14 5346 1 1 20 LYS CD C 0.529 7.898 -11.457 1.00 . A A . 28 LYS CD 1 1
14 5347 1 1 20 LYS CE C 2.041 7.684 -11.557 1.00 . A A . 28 LYS CE 1 1
14 5348 1 1 20 LYS CG C 0.237 8.959 -10.393 1.00 . A A . 28 LYS CG 1 1
14 5349 1 1 20 LYS H H -1.507 7.232 -11.896 1.00 . A A . 28 LYS H 1 1
14 5350 1 1 20 LYS HA H -3.089 9.505 -11.105 1.00 . A A . 28 LYS HA 1 1
14 5351 1 1 20 LYS HB2 H -1.463 9.858 -9.429 1.00 . A A . 28 LYS HB2 1 1
14 5352 1 1 20 LYS HB3 H -1.570 8.108 -9.595 1.00 . A A . 28 LYS HB3 1 1
14 5353 1 1 20 LYS HD2 H 0.056 6.968 -11.180 1.00 . A A . 28 LYS HD2 1 1
14 5354 1 1 20 LYS HD3 H 0.154 8.228 -12.413 1.00 . A A . 28 LYS HD3 1 1
14 5355 1 1 20 LYS HE2 H 2.526 8.628 -11.752 1.00 . A A . 28 LYS HE2 1 1
14 5356 1 1 20 LYS HE3 H 2.409 7.276 -10.628 1.00 . A A . 28 LYS HE3 1 1
14 5357 1 1 20 LYS HG2 H 0.574 9.920 -10.744 1.00 . A A . 28 LYS HG2 1 1
14 5358 1 1 20 LYS HG3 H 0.768 8.706 -9.490 1.00 . A A . 28 LYS HG3 1 1
14 5359 1 1 20 LYS HZ1 H 1.460 6.527 -13.188 1.00 . A A . 28 LYS HZ1 1 1
14 5360 1 1 20 LYS HZ2 H 2.726 5.854 -12.275 1.00 . A A . 28 LYS HZ2 1 1
14 5361 1 1 20 LYS HZ3 H 3.027 7.163 -13.316 1.00 . A A . 28 LYS HZ3 1 1
14 5362 1 1 20 LYS N N -2.175 7.923 -12.078 1.00 . A A . 28 LYS N 1 1
14 5363 1 1 20 LYS NZ N 2.335 6.735 -12.669 1.00 . A A . 28 LYS NZ 1 1
14 5364 1 1 20 LYS O O -1.052 11.320 -11.786 1.00 . A A . 28 LYS O 1 1
14 5365 1 1 21 ASP C C -1.764 12.127 -14.689 1.00 . A A . 29 ASP C 1 1
14 5366 1 1 21 ASP CA C -0.855 10.917 -14.510 1.00 . A A . 29 ASP CA 1 1
14 5367 1 1 21 ASP CB C -0.661 10.182 -15.834 1.00 . A A . 29 ASP CB 1 1
14 5368 1 1 21 ASP CG C -1.981 10.065 -16.597 1.00 . A A . 29 ASP CG 1 1
14 5369 1 1 21 ASP H H -1.764 9.138 -13.885 1.00 . A A . 29 ASP H 1 1
14 5370 1 1 21 ASP HA H 0.098 11.250 -14.148 1.00 . A A . 29 ASP HA 1 1
14 5371 1 1 21 ASP HB2 H 0.049 10.710 -16.427 1.00 . A A . 29 ASP HB2 1 1
14 5372 1 1 21 ASP HB3 H -0.287 9.193 -15.628 1.00 . A A . 29 ASP HB3 1 1
14 5373 1 1 21 ASP N N -1.422 9.990 -13.559 1.00 . A A . 29 ASP N 1 1
14 5374 1 1 21 ASP O O -1.458 13.050 -15.445 1.00 . A A . 29 ASP O 1 1
14 5375 1 1 21 ASP OD1 O -2.700 9.111 -16.353 1.00 . A A . 29 ASP OD1 1 1
14 5376 1 1 21 ASP OD2 O -2.249 10.931 -17.412 1.00 . A A . 29 ASP OD2 1 1
14 5377 1 1 22 THR C C -3.565 14.240 -12.979 1.00 . A A . 30 THR C 1 1
14 5378 1 1 22 THR CA C -3.857 13.189 -14.046 1.00 . A A . 30 THR CA 1 1
14 5379 1 1 22 THR CB C -5.272 12.631 -13.850 1.00 . A A . 30 THR CB 1 1
14 5380 1 1 22 THR CG2 C -5.445 12.141 -12.409 1.00 . A A . 30 THR CG2 1 1
14 5381 1 1 22 THR H H -3.050 11.331 -13.406 1.00 . A A . 30 THR H 1 1
14 5382 1 1 22 THR HA H -3.805 13.658 -15.019 1.00 . A A . 30 THR HA 1 1
14 5383 1 1 22 THR HB H -5.429 11.806 -14.526 1.00 . A A . 30 THR HB 1 1
14 5384 1 1 22 THR HG1 H -5.862 14.216 -14.809 1.00 . A A . 30 THR HG1 1 1
14 5385 1 1 22 THR HG21 H -6.276 11.453 -12.363 1.00 . A A . 30 THR HG21 1 1
14 5386 1 1 22 THR HG22 H -5.641 12.986 -11.765 1.00 . A A . 30 THR HG22 1 1
14 5387 1 1 22 THR HG23 H -4.544 11.640 -12.084 1.00 . A A . 30 THR HG23 1 1
14 5388 1 1 22 THR N N -2.880 12.102 -13.982 1.00 . A A . 30 THR N 1 1
14 5389 1 1 22 THR O O -3.885 15.416 -13.150 1.00 . A A . 30 THR O 1 1
14 5390 1 1 22 THR OG1 O -6.220 13.652 -14.120 1.00 . A A . 30 THR OG1 1 1
14 5391 1 1 23 LEU C C -1.971 15.996 -11.357 1.00 . A A . 31 LEU C 1 1
14 5392 1 1 23 LEU CA C -2.619 14.731 -10.794 1.00 . A A . 31 LEU CA 1 1
14 5393 1 1 23 LEU CB C -1.660 14.049 -9.800 1.00 . A A . 31 LEU CB 1 1
14 5394 1 1 23 LEU CD1 C -3.384 12.251 -9.526 1.00 . A A . 31 LEU CD1 1 1
14 5395 1 1 23 LEU CD2 C -1.481 12.415 -7.915 1.00 . A A . 31 LEU CD2 1 1
14 5396 1 1 23 LEU CG C -2.454 13.214 -8.786 1.00 . A A . 31 LEU CG 1 1
14 5397 1 1 23 LEU H H -2.717 12.863 -11.795 1.00 . A A . 31 LEU H 1 1
14 5398 1 1 23 LEU HA H -3.527 15.008 -10.278 1.00 . A A . 31 LEU HA 1 1
14 5399 1 1 23 LEU HB2 H -0.984 13.403 -10.342 1.00 . A A . 31 LEU HB2 1 1
14 5400 1 1 23 LEU HB3 H -1.089 14.799 -9.269 1.00 . A A . 31 LEU HB3 1 1
14 5401 1 1 23 LEU HD11 H -4.230 12.798 -9.915 1.00 . A A . 31 LEU HD11 1 1
14 5402 1 1 23 LEU HD12 H -3.732 11.489 -8.844 1.00 . A A . 31 LEU HD12 1 1
14 5403 1 1 23 LEU HD13 H -2.850 11.787 -10.341 1.00 . A A . 31 LEU HD13 1 1
14 5404 1 1 23 LEU HD21 H -2.030 11.681 -7.343 1.00 . A A . 31 LEU HD21 1 1
14 5405 1 1 23 LEU HD22 H -0.967 13.085 -7.242 1.00 . A A . 31 LEU HD22 1 1
14 5406 1 1 23 LEU HD23 H -0.759 11.915 -8.544 1.00 . A A . 31 LEU HD23 1 1
14 5407 1 1 23 LEU HG H -3.041 13.872 -8.163 1.00 . A A . 31 LEU HG 1 1
14 5408 1 1 23 LEU N N -2.952 13.811 -11.878 1.00 . A A . 31 LEU N 1 1
14 5409 1 1 23 LEU O O -2.582 17.064 -11.371 1.00 . A A . 31 LEU O 1 1
14 5410 1 1 24 GLY C C -0.814 17.649 -13.509 1.00 . A A . 32 GLY C 1 1
14 5411 1 1 24 GLY CA C -0.013 17.000 -12.384 1.00 . A A . 32 GLY CA 1 1
14 5412 1 1 24 GLY H H -0.296 14.987 -11.785 1.00 . A A . 32 GLY H 1 1
14 5413 1 1 24 GLY HA2 H 0.162 17.730 -11.605 1.00 . A A . 32 GLY HA2 1 1
14 5414 1 1 24 GLY HA3 H 0.934 16.663 -12.774 1.00 . A A . 32 GLY HA3 1 1
14 5415 1 1 24 GLY N N -0.733 15.864 -11.821 1.00 . A A . 32 GLY N 1 1
14 5416 1 1 24 GLY O O -0.900 17.050 -14.567 1.00 . A A . 32 GLY O 1 1
14 5417 1 1 24 GLY OXT O -1.327 18.734 -13.294 1.00 . A A . 32 GLY OXT 1 1
14 5418 2 2 1 ZN ZN ZN -6.463 3.496 -9.944 1.00 . B A . 300 ZN ZN 1 1
15 5419 1 1 1 LYS C C -12.184 -4.902 1.882 1.00 . A A . 9 LYS C 1 1
15 5420 1 1 1 LYS CA C -11.586 -5.272 3.237 1.00 . A A . 9 LYS CA 1 1
15 5421 1 1 1 LYS CB C -10.117 -5.695 3.072 1.00 . A A . 9 LYS CB 1 1
15 5422 1 1 1 LYS CD C -8.825 -3.959 4.373 1.00 . A A . 9 LYS CD 1 1
15 5423 1 1 1 LYS CE C -7.826 -2.807 4.251 1.00 . A A . 9 LYS CE 1 1
15 5424 1 1 1 LYS CG C -9.211 -4.451 2.971 1.00 . A A . 9 LYS CG 1 1
15 5425 1 1 1 LYS H1 H -13.366 -6.147 3.867 1.00 . A A . 9 LYS H1 1 1
15 5426 1 1 1 LYS H2 H -12.009 -6.602 4.782 1.00 . A A . 9 LYS H2 1 1
15 5427 1 1 1 LYS H3 H -12.245 -7.248 3.228 1.00 . A A . 9 LYS H3 1 1
15 5428 1 1 1 LYS HA H -11.645 -4.421 3.898 1.00 . A A . 9 LYS HA 1 1
15 5429 1 1 1 LYS HB2 H -9.822 -6.293 3.923 1.00 . A A . 9 LYS HB2 1 1
15 5430 1 1 1 LYS HB3 H -10.014 -6.286 2.173 1.00 . A A . 9 LYS HB3 1 1
15 5431 1 1 1 LYS HD2 H -9.707 -3.616 4.892 1.00 . A A . 9 LYS HD2 1 1
15 5432 1 1 1 LYS HD3 H -8.371 -4.766 4.927 1.00 . A A . 9 LYS HD3 1 1
15 5433 1 1 1 LYS HE2 H -6.982 -3.123 3.655 1.00 . A A . 9 LYS HE2 1 1
15 5434 1 1 1 LYS HE3 H -8.305 -1.964 3.776 1.00 . A A . 9 LYS HE3 1 1
15 5435 1 1 1 LYS HG2 H -8.314 -4.708 2.426 1.00 . A A . 9 LYS HG2 1 1
15 5436 1 1 1 LYS HG3 H -9.732 -3.663 2.446 1.00 . A A . 9 LYS HG3 1 1
15 5437 1 1 1 LYS HZ1 H -6.366 -2.094 5.554 1.00 . A A . 9 LYS HZ1 1 1
15 5438 1 1 1 LYS HZ2 H -7.423 -3.230 6.249 1.00 . A A . 9 LYS HZ2 1 1
15 5439 1 1 1 LYS HZ3 H -7.946 -1.637 5.969 1.00 . A A . 9 LYS HZ3 1 1
15 5440 1 1 1 LYS N N -12.360 -6.403 3.823 1.00 . A A . 9 LYS N 1 1
15 5441 1 1 1 LYS NZ N -7.355 -2.412 5.608 1.00 . A A . 9 LYS NZ 1 1
15 5442 1 1 1 LYS O O -12.794 -5.737 1.214 1.00 . A A . 9 LYS O 1 1
15 5443 1 1 2 ILE C C -11.542 -2.209 -0.454 1.00 . A A . 10 ILE C 1 1
15 5444 1 1 2 ILE CA C -12.535 -3.162 0.209 1.00 . A A . 10 ILE CA 1 1
15 5445 1 1 2 ILE CB C -13.875 -2.451 0.447 1.00 . A A . 10 ILE CB 1 1
15 5446 1 1 2 ILE CD1 C -15.048 -3.582 -1.498 1.00 . A A . 10 ILE CD1 1 1
15 5447 1 1 2 ILE CG1 C -14.599 -2.238 -0.897 1.00 . A A . 10 ILE CG1 1 1
15 5448 1 1 2 ILE CG2 C -13.645 -1.091 1.129 1.00 . A A . 10 ILE CG2 1 1
15 5449 1 1 2 ILE H H -11.519 -3.023 2.058 1.00 . A A . 10 ILE H 1 1
15 5450 1 1 2 ILE HA H -12.699 -4.002 -0.450 1.00 . A A . 10 ILE HA 1 1
15 5451 1 1 2 ILE HB H -14.484 -3.065 1.092 1.00 . A A . 10 ILE HB 1 1
15 5452 1 1 2 ILE HD11 H -14.280 -3.958 -2.156 1.00 . A A . 10 ILE HD11 1 1
15 5453 1 1 2 ILE HD12 H -15.958 -3.434 -2.061 1.00 . A A . 10 ILE HD12 1 1
15 5454 1 1 2 ILE HD13 H -15.233 -4.300 -0.711 1.00 . A A . 10 ILE HD13 1 1
15 5455 1 1 2 ILE HG12 H -15.465 -1.613 -0.737 1.00 . A A . 10 ILE HG12 1 1
15 5456 1 1 2 ILE HG13 H -13.929 -1.747 -1.587 1.00 . A A . 10 ILE HG13 1 1
15 5457 1 1 2 ILE HG21 H -14.544 -0.796 1.650 1.00 . A A . 10 ILE HG21 1 1
15 5458 1 1 2 ILE HG22 H -13.401 -0.345 0.386 1.00 . A A . 10 ILE HG22 1 1
15 5459 1 1 2 ILE HG23 H -12.832 -1.173 1.837 1.00 . A A . 10 ILE HG23 1 1
15 5460 1 1 2 ILE N N -12.008 -3.642 1.484 1.00 . A A . 10 ILE N 1 1
15 5461 1 1 2 ILE O O -11.234 -1.143 0.077 1.00 . A A . 10 ILE O 1 1
15 5462 1 1 3 VAL C C -10.745 -1.119 -3.544 1.00 . A A . 11 VAL C 1 1
15 5463 1 1 3 VAL CA C -10.076 -1.796 -2.366 1.00 . A A . 11 VAL CA 1 1
15 5464 1 1 3 VAL CB C -8.918 -2.664 -2.860 1.00 . A A . 11 VAL CB 1 1
15 5465 1 1 3 VAL CG1 C -9.455 -3.814 -3.715 1.00 . A A . 11 VAL CG1 1 1
15 5466 1 1 3 VAL CG2 C -7.964 -1.811 -3.700 1.00 . A A . 11 VAL CG2 1 1
15 5467 1 1 3 VAL H H -11.323 -3.473 -1.986 1.00 . A A . 11 VAL H 1 1
15 5468 1 1 3 VAL HA H -9.675 -1.025 -1.723 1.00 . A A . 11 VAL HA 1 1
15 5469 1 1 3 VAL HB H -8.387 -3.063 -2.011 1.00 . A A . 11 VAL HB 1 1
15 5470 1 1 3 VAL HG11 H -10.281 -4.288 -3.205 1.00 . A A . 11 VAL HG11 1 1
15 5471 1 1 3 VAL HG12 H -8.670 -4.538 -3.877 1.00 . A A . 11 VAL HG12 1 1
15 5472 1 1 3 VAL HG13 H -9.791 -3.429 -4.666 1.00 . A A . 11 VAL HG13 1 1
15 5473 1 1 3 VAL HG21 H -8.410 -1.615 -4.665 1.00 . A A . 11 VAL HG21 1 1
15 5474 1 1 3 VAL HG22 H -7.032 -2.340 -3.836 1.00 . A A . 11 VAL HG22 1 1
15 5475 1 1 3 VAL HG23 H -7.776 -0.875 -3.194 1.00 . A A . 11 VAL HG23 1 1
15 5476 1 1 3 VAL N N -11.040 -2.610 -1.620 1.00 . A A . 11 VAL N 1 1
15 5477 1 1 3 VAL O O -11.417 -1.758 -4.355 1.00 . A A . 11 VAL O 1 1
15 5478 1 1 4 SER C C -10.361 2.283 -4.858 1.00 . A A . 12 SER C 1 1
15 5479 1 1 4 SER CA C -11.111 0.971 -4.708 1.00 . A A . 12 SER CA 1 1
15 5480 1 1 4 SER CB C -12.584 1.258 -4.450 1.00 . A A . 12 SER CB 1 1
15 5481 1 1 4 SER H H -9.989 0.625 -2.951 1.00 . A A . 12 SER H 1 1
15 5482 1 1 4 SER HA H -11.024 0.413 -5.630 1.00 . A A . 12 SER HA 1 1
15 5483 1 1 4 SER HB2 H -12.936 1.975 -5.172 1.00 . A A . 12 SER HB2 1 1
15 5484 1 1 4 SER HB3 H -13.152 0.343 -4.548 1.00 . A A . 12 SER HB3 1 1
15 5485 1 1 4 SER HG H -12.601 2.742 -3.191 1.00 . A A . 12 SER HG 1 1
15 5486 1 1 4 SER N N -10.543 0.184 -3.630 1.00 . A A . 12 SER N 1 1
15 5487 1 1 4 SER O O -10.263 3.074 -3.922 1.00 . A A . 12 SER O 1 1
15 5488 1 1 4 SER OG O -12.739 1.793 -3.142 1.00 . A A . 12 SER OG 1 1
15 5489 1 1 5 CYS C C -10.039 4.912 -6.349 1.00 . A A . 13 CYS C 1 1
15 5490 1 1 5 CYS CA C -9.099 3.711 -6.352 1.00 . A A . 13 CYS CA 1 1
15 5491 1 1 5 CYS CB C -8.429 3.571 -7.718 1.00 . A A . 13 CYS CB 1 1
15 5492 1 1 5 CYS H H -9.967 1.821 -6.745 1.00 . A A . 13 CYS H 1 1
15 5493 1 1 5 CYS HA H -8.337 3.856 -5.601 1.00 . A A . 13 CYS HA 1 1
15 5494 1 1 5 CYS HB2 H -7.976 2.596 -7.798 1.00 . A A . 13 CYS HB2 1 1
15 5495 1 1 5 CYS HB3 H -9.167 3.684 -8.493 1.00 . A A . 13 CYS HB3 1 1
15 5496 1 1 5 CYS N N -9.842 2.497 -6.051 1.00 . A A . 13 CYS N 1 1
15 5497 1 1 5 CYS O O -11.247 4.756 -6.162 1.00 . A A . 13 CYS O 1 1
15 5498 1 1 5 CYS SG S -7.157 4.842 -7.913 1.00 . A A . 13 CYS SG 1 1
15 5499 1 1 6 ARG C C -10.079 8.127 -7.846 1.00 . A A . 14 ARG C 1 1
15 5500 1 1 6 ARG CA C -10.307 7.335 -6.562 1.00 . A A . 14 ARG CA 1 1
15 5501 1 1 6 ARG CB C -9.965 8.207 -5.347 1.00 . A A . 14 ARG CB 1 1
15 5502 1 1 6 ARG CD C -8.129 9.474 -4.201 1.00 . A A . 14 ARG CD 1 1
15 5503 1 1 6 ARG CG C -8.579 8.840 -5.522 1.00 . A A . 14 ARG CG 1 1
15 5504 1 1 6 ARG CZ C -7.379 11.619 -5.057 1.00 . A A . 14 ARG CZ 1 1
15 5505 1 1 6 ARG H H -8.518 6.180 -6.692 1.00 . A A . 14 ARG H 1 1
15 5506 1 1 6 ARG HA H -11.355 7.070 -6.509 1.00 . A A . 14 ARG HA 1 1
15 5507 1 1 6 ARG HB2 H -10.706 8.987 -5.247 1.00 . A A . 14 ARG HB2 1 1
15 5508 1 1 6 ARG HB3 H -9.968 7.595 -4.457 1.00 . A A . 14 ARG HB3 1 1
15 5509 1 1 6 ARG HD2 H -8.972 9.951 -3.722 1.00 . A A . 14 ARG HD2 1 1
15 5510 1 1 6 ARG HD3 H -7.739 8.706 -3.550 1.00 . A A . 14 ARG HD3 1 1
15 5511 1 1 6 ARG HE H -6.176 10.295 -4.162 1.00 . A A . 14 ARG HE 1 1
15 5512 1 1 6 ARG HG2 H -7.871 8.080 -5.816 1.00 . A A . 14 ARG HG2 1 1
15 5513 1 1 6 ARG HG3 H -8.625 9.603 -6.284 1.00 . A A . 14 ARG HG3 1 1
15 5514 1 1 6 ARG HH11 H -9.324 11.195 -5.282 1.00 . A A . 14 ARG HH11 1 1
15 5515 1 1 6 ARG HH12 H -8.815 12.729 -5.902 1.00 . A A . 14 ARG HH12 1 1
15 5516 1 1 6 ARG HH21 H -5.501 12.307 -4.972 1.00 . A A . 14 ARG HH21 1 1
15 5517 1 1 6 ARG HH22 H -6.651 13.359 -5.727 1.00 . A A . 14 ARG HH22 1 1
15 5518 1 1 6 ARG N N -9.489 6.112 -6.551 1.00 . A A . 14 ARG N 1 1
15 5519 1 1 6 ARG NE N -7.095 10.472 -4.449 1.00 . A A . 14 ARG NE 1 1
15 5520 1 1 6 ARG NH1 N -8.601 11.867 -5.445 1.00 . A A . 14 ARG NH1 1 1
15 5521 1 1 6 ARG NH2 N -6.438 12.497 -5.269 1.00 . A A . 14 ARG NH2 1 1
15 5522 1 1 6 ARG O O -10.876 8.998 -8.199 1.00 . A A . 14 ARG O 1 1
15 5523 1 1 7 ILE C C -9.283 7.795 -10.971 1.00 . A A . 15 ILE C 1 1
15 5524 1 1 7 ILE CA C -8.657 8.513 -9.781 1.00 . A A . 15 ILE CA 1 1
15 5525 1 1 7 ILE CB C -7.138 8.557 -9.958 1.00 . A A . 15 ILE CB 1 1
15 5526 1 1 7 ILE CD1 C -5.008 8.873 -8.684 1.00 . A A . 15 ILE CD1 1 1
15 5527 1 1 7 ILE CG1 C -6.492 9.233 -8.738 1.00 . A A . 15 ILE CG1 1 1
15 5528 1 1 7 ILE CG2 C -6.797 9.348 -11.223 1.00 . A A . 15 ILE CG2 1 1
15 5529 1 1 7 ILE H H -8.389 7.123 -8.205 1.00 . A A . 15 ILE H 1 1
15 5530 1 1 7 ILE HA H -9.033 9.526 -9.741 1.00 . A A . 15 ILE HA 1 1
15 5531 1 1 7 ILE HB H -6.763 7.547 -10.056 1.00 . A A . 15 ILE HB 1 1
15 5532 1 1 7 ILE HD11 H -4.533 9.157 -9.611 1.00 . A A . 15 ILE HD11 1 1
15 5533 1 1 7 ILE HD12 H -4.903 7.807 -8.538 1.00 . A A . 15 ILE HD12 1 1
15 5534 1 1 7 ILE HD13 H -4.540 9.397 -7.863 1.00 . A A . 15 ILE HD13 1 1
15 5535 1 1 7 ILE HG12 H -6.600 10.305 -8.818 1.00 . A A . 15 ILE HG12 1 1
15 5536 1 1 7 ILE HG13 H -6.973 8.891 -7.835 1.00 . A A . 15 ILE HG13 1 1
15 5537 1 1 7 ILE HG21 H -5.744 9.591 -11.222 1.00 . A A . 15 ILE HG21 1 1
15 5538 1 1 7 ILE HG22 H -7.376 10.259 -11.244 1.00 . A A . 15 ILE HG22 1 1
15 5539 1 1 7 ILE HG23 H -7.028 8.753 -12.094 1.00 . A A . 15 ILE HG23 1 1
15 5540 1 1 7 ILE N N -8.988 7.822 -8.537 1.00 . A A . 15 ILE N 1 1
15 5541 1 1 7 ILE O O -9.665 8.423 -11.958 1.00 . A A . 15 ILE O 1 1
15 5542 1 1 8 CYS C C -10.915 4.614 -11.381 1.00 . A A . 16 CYS C 1 1
15 5543 1 1 8 CYS CA C -9.947 5.655 -11.943 1.00 . A A . 16 CYS CA 1 1
15 5544 1 1 8 CYS CB C -8.820 4.952 -12.695 1.00 . A A . 16 CYS CB 1 1
15 5545 1 1 8 CYS H H -9.046 6.030 -10.063 1.00 . A A . 16 CYS H 1 1
15 5546 1 1 8 CYS HA H -10.483 6.289 -12.636 1.00 . A A . 16 CYS HA 1 1
15 5547 1 1 8 CYS HB2 H -9.214 4.475 -13.579 1.00 . A A . 16 CYS HB2 1 1
15 5548 1 1 8 CYS HB3 H -8.074 5.679 -12.979 1.00 . A A . 16 CYS HB3 1 1
15 5549 1 1 8 CYS N N -9.377 6.470 -10.871 1.00 . A A . 16 CYS N 1 1
15 5550 1 1 8 CYS O O -11.726 4.054 -12.118 1.00 . A A . 16 CYS O 1 1
15 5551 1 1 8 CYS SG S -8.065 3.708 -11.621 1.00 . A A . 16 CYS SG 1 1
15 5552 1 1 9 LYS C C -11.482 1.995 -10.031 1.00 . A A . 17 LYS C 1 1
15 5553 1 1 9 LYS CA C -11.701 3.383 -9.436 1.00 . A A . 17 LYS CA 1 1
15 5554 1 1 9 LYS CB C -13.167 3.791 -9.603 1.00 . A A . 17 LYS CB 1 1
15 5555 1 1 9 LYS CD C -14.774 5.716 -9.566 1.00 . A A . 17 LYS CD 1 1
15 5556 1 1 9 LYS CE C -15.782 4.844 -8.811 1.00 . A A . 17 LYS CE 1 1
15 5557 1 1 9 LYS CG C -13.343 5.271 -9.243 1.00 . A A . 17 LYS CG 1 1
15 5558 1 1 9 LYS H H -10.160 4.828 -9.534 1.00 . A A . 17 LYS H 1 1
15 5559 1 1 9 LYS HA H -11.471 3.349 -8.382 1.00 . A A . 17 LYS HA 1 1
15 5560 1 1 9 LYS HB2 H -13.474 3.627 -10.624 1.00 . A A . 17 LYS HB2 1 1
15 5561 1 1 9 LYS HB3 H -13.772 3.191 -8.946 1.00 . A A . 17 LYS HB3 1 1
15 5562 1 1 9 LYS HD2 H -14.902 6.748 -9.271 1.00 . A A . 17 LYS HD2 1 1
15 5563 1 1 9 LYS HD3 H -14.946 5.624 -10.628 1.00 . A A . 17 LYS HD3 1 1
15 5564 1 1 9 LYS HE2 H -16.719 5.374 -8.719 1.00 . A A . 17 LYS HE2 1 1
15 5565 1 1 9 LYS HE3 H -15.944 3.926 -9.357 1.00 . A A . 17 LYS HE3 1 1
15 5566 1 1 9 LYS HG2 H -13.149 5.412 -8.190 1.00 . A A . 17 LYS HG2 1 1
15 5567 1 1 9 LYS HG3 H -12.649 5.867 -9.817 1.00 . A A . 17 LYS HG3 1 1
15 5568 1 1 9 LYS HZ1 H -14.284 4.175 -7.525 1.00 . A A . 17 LYS HZ1 1 1
15 5569 1 1 9 LYS HZ2 H -15.859 3.803 -7.008 1.00 . A A . 17 LYS HZ2 1 1
15 5570 1 1 9 LYS HZ3 H -15.268 5.390 -6.868 1.00 . A A . 17 LYS HZ3 1 1
15 5571 1 1 9 LYS N N -10.826 4.357 -10.076 1.00 . A A . 17 LYS N 1 1
15 5572 1 1 9 LYS NZ N -15.259 4.529 -7.451 1.00 . A A . 17 LYS NZ 1 1
15 5573 1 1 9 LYS O O -12.438 1.286 -10.345 1.00 . A A . 17 LYS O 1 1
15 5574 1 1 10 GLY C C -9.767 -0.741 -9.634 1.00 . A A . 18 GLY C 1 1
15 5575 1 1 10 GLY CA C -9.872 0.307 -10.736 1.00 . A A . 18 GLY CA 1 1
15 5576 1 1 10 GLY H H -9.496 2.224 -9.910 1.00 . A A . 18 GLY H 1 1
15 5577 1 1 10 GLY HA2 H -10.632 0.006 -11.444 1.00 . A A . 18 GLY HA2 1 1
15 5578 1 1 10 GLY HA3 H -8.923 0.378 -11.245 1.00 . A A . 18 GLY HA3 1 1
15 5579 1 1 10 GLY N N -10.215 1.615 -10.181 1.00 . A A . 18 GLY N 1 1
15 5580 1 1 10 GLY O O -10.675 -0.889 -8.816 1.00 . A A . 18 GLY O 1 1
15 5581 1 1 11 ASP C C -7.127 -2.243 -7.849 1.00 . A A . 19 ASP C 1 1
15 5582 1 1 11 ASP CA C -8.420 -2.512 -8.614 1.00 . A A . 19 ASP CA 1 1
15 5583 1 1 11 ASP CB C -8.332 -3.876 -9.299 1.00 . A A . 19 ASP CB 1 1
15 5584 1 1 11 ASP CG C -7.102 -3.930 -10.200 1.00 . A A . 19 ASP CG 1 1
15 5585 1 1 11 ASP H H -7.964 -1.304 -10.297 1.00 . A A . 19 ASP H 1 1
15 5586 1 1 11 ASP HA H -9.242 -2.530 -7.911 1.00 . A A . 19 ASP HA 1 1
15 5587 1 1 11 ASP HB2 H -8.262 -4.652 -8.550 1.00 . A A . 19 ASP HB2 1 1
15 5588 1 1 11 ASP HB3 H -9.217 -4.034 -9.896 1.00 . A A . 19 ASP HB3 1 1
15 5589 1 1 11 ASP N N -8.649 -1.469 -9.617 1.00 . A A . 19 ASP N 1 1
15 5590 1 1 11 ASP O O -6.177 -3.023 -7.921 1.00 . A A . 19 ASP O 1 1
15 5591 1 1 11 ASP OD1 O -6.670 -2.879 -10.642 1.00 . A A . 19 ASP OD1 1 1
15 5592 1 1 11 ASP OD2 O -6.610 -5.021 -10.432 1.00 . A A . 19 ASP OD2 1 1
15 5593 1 1 12 HIS C C -6.174 0.538 -5.591 1.00 . A A . 20 HIS C 1 1
15 5594 1 1 12 HIS CA C -5.926 -0.769 -6.335 1.00 . A A . 20 HIS CA 1 1
15 5595 1 1 12 HIS CB C -4.709 -0.613 -7.254 1.00 . A A . 20 HIS CB 1 1
15 5596 1 1 12 HIS CD2 C -5.413 1.494 -8.661 1.00 . A A . 20 HIS CD2 1 1
15 5597 1 1 12 HIS CE1 C -5.553 0.540 -10.602 1.00 . A A . 20 HIS CE1 1 1
15 5598 1 1 12 HIS CG C -5.099 0.169 -8.478 1.00 . A A . 20 HIS CG 1 1
15 5599 1 1 12 HIS H H -7.888 -0.554 -7.090 1.00 . A A . 20 HIS H 1 1
15 5600 1 1 12 HIS HA H -5.723 -1.549 -5.617 1.00 . A A . 20 HIS HA 1 1
15 5601 1 1 12 HIS HB2 H -3.925 -0.089 -6.727 1.00 . A A . 20 HIS HB2 1 1
15 5602 1 1 12 HIS HB3 H -4.352 -1.588 -7.548 1.00 . A A . 20 HIS HB3 1 1
15 5603 1 1 12 HIS HD2 H -5.438 2.242 -7.883 1.00 . A A . 20 HIS HD2 1 1
15 5604 1 1 12 HIS HE1 H -5.704 0.372 -11.658 1.00 . A A . 20 HIS HE1 1 1
15 5605 1 1 12 HIS N N -7.101 -1.135 -7.113 1.00 . A A . 20 HIS N 1 1
15 5606 1 1 12 HIS ND1 N -5.195 -0.419 -9.729 1.00 . A A . 20 HIS ND1 1 1
15 5607 1 1 12 HIS NE2 N -5.698 1.725 -10.003 1.00 . A A . 20 HIS NE2 1 1
15 5608 1 1 12 HIS O O -6.789 1.460 -6.123 1.00 . A A . 20 HIS O 1 1
15 5609 1 1 13 TRP C C -5.330 3.029 -4.290 1.00 . A A . 21 TRP C 1 1
15 5610 1 1 13 TRP CA C -5.867 1.807 -3.550 1.00 . A A . 21 TRP CA 1 1
15 5611 1 1 13 TRP CB C -5.130 1.649 -2.215 1.00 . A A . 21 TRP CB 1 1
15 5612 1 1 13 TRP CD1 C -5.693 -0.610 -1.231 1.00 . A A . 21 TRP CD1 1 1
15 5613 1 1 13 TRP CD2 C -6.977 1.040 -0.400 1.00 . A A . 21 TRP CD2 1 1
15 5614 1 1 13 TRP CE2 C -7.395 -0.156 0.231 1.00 . A A . 21 TRP CE2 1 1
15 5615 1 1 13 TRP CE3 C -7.631 2.236 -0.051 1.00 . A A . 21 TRP CE3 1 1
15 5616 1 1 13 TRP CG C -5.896 0.724 -1.323 1.00 . A A . 21 TRP CG 1 1
15 5617 1 1 13 TRP CH2 C -9.062 1.031 1.508 1.00 . A A . 21 TRP CH2 1 1
15 5618 1 1 13 TRP CZ2 C -8.424 -0.166 1.172 1.00 . A A . 21 TRP CZ2 1 1
15 5619 1 1 13 TRP CZ3 C -8.667 2.230 0.897 1.00 . A A . 21 TRP CZ3 1 1
15 5620 1 1 13 TRP H H -5.213 -0.161 -3.990 1.00 . A A . 21 TRP H 1 1
15 5621 1 1 13 TRP HA H -6.920 1.951 -3.356 1.00 . A A . 21 TRP HA 1 1
15 5622 1 1 13 TRP HB2 H -4.147 1.241 -2.395 1.00 . A A . 21 TRP HB2 1 1
15 5623 1 1 13 TRP HB3 H -5.036 2.614 -1.739 1.00 . A A . 21 TRP HB3 1 1
15 5624 1 1 13 TRP HD1 H -4.958 -1.173 -1.785 1.00 . A A . 21 TRP HD1 1 1
15 5625 1 1 13 TRP HE1 H -6.644 -2.079 -0.057 1.00 . A A . 21 TRP HE1 1 1
15 5626 1 1 13 TRP HE3 H -7.333 3.165 -0.515 1.00 . A A . 21 TRP HE3 1 1
15 5627 1 1 13 TRP HH2 H -9.860 1.033 2.236 1.00 . A A . 21 TRP HH2 1 1
15 5628 1 1 13 TRP HZ2 H -8.725 -1.092 1.639 1.00 . A A . 21 TRP HZ2 1 1
15 5629 1 1 13 TRP HZ3 H -9.161 3.154 1.157 1.00 . A A . 21 TRP HZ3 1 1
15 5630 1 1 13 TRP N N -5.693 0.607 -4.359 1.00 . A A . 21 TRP N 1 1
15 5631 1 1 13 TRP NE1 N -6.583 -1.134 -0.310 1.00 . A A . 21 TRP NE1 1 1
15 5632 1 1 13 TRP O O -4.863 2.924 -5.424 1.00 . A A . 21 TRP O 1 1
15 5633 1 1 14 THR C C -3.389 5.444 -4.257 1.00 . A A . 22 THR C 1 1
15 5634 1 1 14 THR CA C -4.914 5.420 -4.244 1.00 . A A . 22 THR CA 1 1
15 5635 1 1 14 THR CB C -5.437 6.627 -3.461 1.00 . A A . 22 THR CB 1 1
15 5636 1 1 14 THR CG2 C -5.099 7.915 -4.213 1.00 . A A . 22 THR CG2 1 1
15 5637 1 1 14 THR H H -5.779 4.209 -2.737 1.00 . A A . 22 THR H 1 1
15 5638 1 1 14 THR HA H -5.274 5.480 -5.259 1.00 . A A . 22 THR HA 1 1
15 5639 1 1 14 THR HB H -4.974 6.651 -2.487 1.00 . A A . 22 THR HB 1 1
15 5640 1 1 14 THR HG1 H -7.147 5.793 -3.868 1.00 . A A . 22 THR HG1 1 1
15 5641 1 1 14 THR HG21 H -5.625 7.931 -5.156 1.00 . A A . 22 THR HG21 1 1
15 5642 1 1 14 THR HG22 H -4.035 7.960 -4.395 1.00 . A A . 22 THR HG22 1 1
15 5643 1 1 14 THR HG23 H -5.397 8.766 -3.619 1.00 . A A . 22 THR HG23 1 1
15 5644 1 1 14 THR N N -5.398 4.186 -3.639 1.00 . A A . 22 THR N 1 1
15 5645 1 1 14 THR O O -2.772 5.822 -5.253 1.00 . A A . 22 THR O 1 1
15 5646 1 1 14 THR OG1 O -6.846 6.517 -3.315 1.00 . A A . 22 THR OG1 1 1
15 5647 1 1 15 THR C C -0.730 4.112 -4.104 1.00 . A A . 23 THR C 1 1
15 5648 1 1 15 THR CA C -1.335 5.018 -3.037 1.00 . A A . 23 THR CA 1 1
15 5649 1 1 15 THR CB C -0.920 4.524 -1.649 1.00 . A A . 23 THR CB 1 1
15 5650 1 1 15 THR CG2 C -1.523 5.435 -0.580 1.00 . A A . 23 THR CG2 1 1
15 5651 1 1 15 THR H H -3.331 4.749 -2.381 1.00 . A A . 23 THR H 1 1
15 5652 1 1 15 THR HA H -0.960 6.020 -3.176 1.00 . A A . 23 THR HA 1 1
15 5653 1 1 15 THR HB H 0.156 4.543 -1.566 1.00 . A A . 23 THR HB 1 1
15 5654 1 1 15 THR HG1 H -1.874 3.166 -0.635 1.00 . A A . 23 THR HG1 1 1
15 5655 1 1 15 THR HG21 H -2.574 5.584 -0.785 1.00 . A A . 23 THR HG21 1 1
15 5656 1 1 15 THR HG22 H -1.016 6.389 -0.590 1.00 . A A . 23 THR HG22 1 1
15 5657 1 1 15 THR HG23 H -1.408 4.977 0.392 1.00 . A A . 23 THR HG23 1 1
15 5658 1 1 15 THR N N -2.788 5.038 -3.144 1.00 . A A . 23 THR N 1 1
15 5659 1 1 15 THR O O 0.490 3.983 -4.204 1.00 . A A . 23 THR O 1 1
15 5660 1 1 15 THR OG1 O -1.388 3.195 -1.462 1.00 . A A . 23 THR OG1 1 1
15 5661 1 1 16 ARG C C -2.027 2.700 -7.197 1.00 . A A . 24 ARG C 1 1
15 5662 1 1 16 ARG CA C -1.132 2.581 -5.963 1.00 . A A . 24 ARG CA 1 1
15 5663 1 1 16 ARG CB C -1.128 1.134 -5.447 1.00 . A A . 24 ARG CB 1 1
15 5664 1 1 16 ARG CD C -2.475 -0.565 -4.204 1.00 . A A . 24 ARG CD 1 1
15 5665 1 1 16 ARG CG C -2.317 0.926 -4.507 1.00 . A A . 24 ARG CG 1 1
15 5666 1 1 16 ARG CZ C -1.320 -2.269 -2.915 1.00 . A A . 24 ARG CZ 1 1
15 5667 1 1 16 ARG H H -2.555 3.619 -4.774 1.00 . A A . 24 ARG H 1 1
15 5668 1 1 16 ARG HA H -0.122 2.850 -6.245 1.00 . A A . 24 ARG HA 1 1
15 5669 1 1 16 ARG HB2 H -1.200 0.444 -6.279 1.00 . A A . 24 ARG HB2 1 1
15 5670 1 1 16 ARG HB3 H -0.212 0.948 -4.904 1.00 . A A . 24 ARG HB3 1 1
15 5671 1 1 16 ARG HD2 H -3.377 -0.721 -3.633 1.00 . A A . 24 ARG HD2 1 1
15 5672 1 1 16 ARG HD3 H -2.543 -1.113 -5.133 1.00 . A A . 24 ARG HD3 1 1
15 5673 1 1 16 ARG HE H -0.557 -0.461 -3.308 1.00 . A A . 24 ARG HE 1 1
15 5674 1 1 16 ARG HG2 H -2.144 1.465 -3.587 1.00 . A A . 24 ARG HG2 1 1
15 5675 1 1 16 ARG HG3 H -3.217 1.294 -4.976 1.00 . A A . 24 ARG HG3 1 1
15 5676 1 1 16 ARG HH11 H -3.139 -2.746 -3.603 1.00 . A A . 24 ARG HH11 1 1
15 5677 1 1 16 ARG HH12 H -2.336 -3.978 -2.689 1.00 . A A . 24 ARG HH12 1 1
15 5678 1 1 16 ARG HH21 H 0.501 -2.073 -2.107 1.00 . A A . 24 ARG HH21 1 1
15 5679 1 1 16 ARG HH22 H -0.276 -3.597 -1.841 1.00 . A A . 24 ARG HH22 1 1
15 5680 1 1 16 ARG N N -1.592 3.480 -4.902 1.00 . A A . 24 ARG N 1 1
15 5681 1 1 16 ARG NE N -1.331 -1.047 -3.439 1.00 . A A . 24 ARG NE 1 1
15 5682 1 1 16 ARG NH1 N -2.345 -3.059 -3.082 1.00 . A A . 24 ARG NH1 1 1
15 5683 1 1 16 ARG NH2 N -0.284 -2.678 -2.235 1.00 . A A . 24 ARG NH2 1 1
15 5684 1 1 16 ARG O O -2.614 1.717 -7.649 1.00 . A A . 24 ARG O 1 1
15 5685 1 1 17 CYS C C -2.010 4.377 -10.157 1.00 . A A . 25 CYS C 1 1
15 5686 1 1 17 CYS CA C -2.923 4.160 -8.945 1.00 . A A . 25 CYS CA 1 1
15 5687 1 1 17 CYS CB C -3.783 5.410 -8.748 1.00 . A A . 25 CYS CB 1 1
15 5688 1 1 17 CYS H H -1.613 4.654 -7.349 1.00 . A A . 25 CYS H 1 1
15 5689 1 1 17 CYS HA H -3.578 3.321 -9.118 1.00 . A A . 25 CYS HA 1 1
15 5690 1 1 17 CYS HB2 H -4.502 5.234 -7.963 1.00 . A A . 25 CYS HB2 1 1
15 5691 1 1 17 CYS HB3 H -3.154 6.245 -8.481 1.00 . A A . 25 CYS HB3 1 1
15 5692 1 1 17 CYS N N -2.113 3.912 -7.749 1.00 . A A . 25 CYS N 1 1
15 5693 1 1 17 CYS O O -1.429 5.451 -10.297 1.00 . A A . 25 CYS O 1 1
15 5694 1 1 17 CYS SG S -4.651 5.784 -10.293 1.00 . A A . 25 CYS SG 1 1
15 5695 1 1 18 PRO C C -1.659 4.321 -13.352 1.00 . A A . 26 PRO C 1 1
15 5696 1 1 18 PRO CA C -0.969 3.557 -12.220 1.00 . A A . 26 PRO CA 1 1
15 5697 1 1 18 PRO CB C -0.665 2.110 -12.617 1.00 . A A . 26 PRO CB 1 1
15 5698 1 1 18 PRO CD C -2.481 2.067 -10.997 1.00 . A A . 26 PRO CD 1 1
15 5699 1 1 18 PRO CG C -1.885 1.340 -12.215 1.00 . A A . 26 PRO CG 1 1
15 5700 1 1 18 PRO HA H -0.055 4.055 -11.942 1.00 . A A . 26 PRO HA 1 1
15 5701 1 1 18 PRO HB2 H -0.496 2.034 -13.684 1.00 . A A . 26 PRO HB2 1 1
15 5702 1 1 18 PRO HB3 H 0.197 1.747 -12.075 1.00 . A A . 26 PRO HB3 1 1
15 5703 1 1 18 PRO HD2 H -3.555 2.148 -11.097 1.00 . A A . 26 PRO HD2 1 1
15 5704 1 1 18 PRO HD3 H -2.221 1.558 -10.080 1.00 . A A . 26 PRO HD3 1 1
15 5705 1 1 18 PRO HG2 H -2.599 1.327 -13.032 1.00 . A A . 26 PRO HG2 1 1
15 5706 1 1 18 PRO HG3 H -1.618 0.328 -11.943 1.00 . A A . 26 PRO HG3 1 1
15 5707 1 1 18 PRO N N -1.852 3.405 -11.031 1.00 . A A . 26 PRO N 1 1
15 5708 1 1 18 PRO O O -1.526 3.969 -14.524 1.00 . A A . 26 PRO O 1 1
15 5709 1 1 19 TYR C C -3.225 7.631 -13.510 1.00 . A A . 27 TYR C 1 1
15 5710 1 1 19 TYR CA C -3.094 6.187 -13.984 1.00 . A A . 27 TYR CA 1 1
15 5711 1 1 19 TYR CB C -4.485 5.613 -14.249 1.00 . A A . 27 TYR CB 1 1
15 5712 1 1 19 TYR CD1 C -3.739 3.925 -15.969 1.00 . A A . 27 TYR CD1 1 1
15 5713 1 1 19 TYR CD2 C -4.874 3.129 -13.978 1.00 . A A . 27 TYR CD2 1 1
15 5714 1 1 19 TYR CE1 C -3.624 2.607 -16.429 1.00 . A A . 27 TYR CE1 1 1
15 5715 1 1 19 TYR CE2 C -4.758 1.812 -14.440 1.00 . A A . 27 TYR CE2 1 1
15 5716 1 1 19 TYR CG C -4.363 4.188 -14.743 1.00 . A A . 27 TYR CG 1 1
15 5717 1 1 19 TYR CZ C -4.134 1.552 -15.665 1.00 . A A . 27 TYR CZ 1 1
15 5718 1 1 19 TYR H H -2.458 5.611 -12.041 1.00 . A A . 27 TYR H 1 1
15 5719 1 1 19 TYR HA H -2.533 6.179 -14.905 1.00 . A A . 27 TYR HA 1 1
15 5720 1 1 19 TYR HB2 H -5.063 5.634 -13.335 1.00 . A A . 27 TYR HB2 1 1
15 5721 1 1 19 TYR HB3 H -4.981 6.211 -14.998 1.00 . A A . 27 TYR HB3 1 1
15 5722 1 1 19 TYR HD1 H -3.346 4.738 -16.560 1.00 . A A . 27 TYR HD1 1 1
15 5723 1 1 19 TYR HD2 H -5.358 3.330 -13.034 1.00 . A A . 27 TYR HD2 1 1
15 5724 1 1 19 TYR HE1 H -3.142 2.406 -17.374 1.00 . A A . 27 TYR HE1 1 1
15 5725 1 1 19 TYR HE2 H -5.152 0.998 -13.851 1.00 . A A . 27 TYR HE2 1 1
15 5726 1 1 19 TYR HH H -3.288 -0.160 -15.652 1.00 . A A . 27 TYR HH 1 1
15 5727 1 1 19 TYR N N -2.392 5.374 -12.990 1.00 . A A . 27 TYR N 1 1
15 5728 1 1 19 TYR O O -4.052 8.386 -14.020 1.00 . A A . 27 TYR O 1 1
15 5729 1 1 19 TYR OH O -4.019 0.253 -16.118 1.00 . A A . 27 TYR OH 1 1
15 5730 1 1 20 LYS C C -1.928 10.366 -13.055 1.00 . A A . 28 LYS C 1 1
15 5731 1 1 20 LYS CA C -2.443 9.373 -12.015 1.00 . A A . 28 LYS CA 1 1
15 5732 1 1 20 LYS CB C -1.609 9.479 -10.723 1.00 . A A . 28 LYS CB 1 1
15 5733 1 1 20 LYS CD C 0.423 8.949 -12.113 1.00 . A A . 28 LYS CD 1 1
15 5734 1 1 20 LYS CE C 1.828 8.349 -12.039 1.00 . A A . 28 LYS CE 1 1
15 5735 1 1 20 LYS CG C -0.340 8.619 -10.828 1.00 . A A . 28 LYS CG 1 1
15 5736 1 1 20 LYS H H -1.765 7.366 -12.171 1.00 . A A . 28 LYS H 1 1
15 5737 1 1 20 LYS HA H -3.467 9.621 -11.787 1.00 . A A . 28 LYS HA 1 1
15 5738 1 1 20 LYS HB2 H -1.329 10.510 -10.556 1.00 . A A . 28 LYS HB2 1 1
15 5739 1 1 20 LYS HB3 H -2.201 9.133 -9.888 1.00 . A A . 28 LYS HB3 1 1
15 5740 1 1 20 LYS HD2 H -0.100 8.531 -12.962 1.00 . A A . 28 LYS HD2 1 1
15 5741 1 1 20 LYS HD3 H 0.500 10.020 -12.225 1.00 . A A . 28 LYS HD3 1 1
15 5742 1 1 20 LYS HE2 H 2.396 8.859 -11.275 1.00 . A A . 28 LYS HE2 1 1
15 5743 1 1 20 LYS HE3 H 1.760 7.299 -11.795 1.00 . A A . 28 LYS HE3 1 1
15 5744 1 1 20 LYS HG2 H 0.295 8.819 -9.976 1.00 . A A . 28 LYS HG2 1 1
15 5745 1 1 20 LYS HG3 H -0.612 7.577 -10.831 1.00 . A A . 28 LYS HG3 1 1
15 5746 1 1 20 LYS HZ1 H 3.091 7.671 -13.549 1.00 . A A . 28 LYS HZ1 1 1
15 5747 1 1 20 LYS HZ2 H 3.113 9.356 -13.330 1.00 . A A . 28 LYS HZ2 1 1
15 5748 1 1 20 LYS HZ3 H 1.795 8.614 -14.103 1.00 . A A . 28 LYS HZ3 1 1
15 5749 1 1 20 LYS N N -2.404 8.010 -12.538 1.00 . A A . 28 LYS N 1 1
15 5750 1 1 20 LYS NZ N 2.508 8.510 -13.354 1.00 . A A . 28 LYS NZ 1 1
15 5751 1 1 20 LYS O O -1.656 11.524 -12.741 1.00 . A A . 28 LYS O 1 1
15 5752 1 1 21 ASP C C -2.224 11.931 -15.586 1.00 . A A . 29 ASP C 1 1
15 5753 1 1 21 ASP CA C -1.307 10.732 -15.368 1.00 . A A . 29 ASP CA 1 1
15 5754 1 1 21 ASP CB C -1.213 9.875 -16.631 1.00 . A A . 29 ASP CB 1 1
15 5755 1 1 21 ASP CG C -2.573 9.754 -17.321 1.00 . A A . 29 ASP CG 1 1
15 5756 1 1 21 ASP H H -2.014 8.972 -14.484 1.00 . A A . 29 ASP H 1 1
15 5757 1 1 21 ASP HA H -0.328 11.090 -15.113 1.00 . A A . 29 ASP HA 1 1
15 5758 1 1 21 ASP HB2 H -0.509 10.314 -17.302 1.00 . A A . 29 ASP HB2 1 1
15 5759 1 1 21 ASP HB3 H -0.872 8.889 -16.356 1.00 . A A . 29 ASP HB3 1 1
15 5760 1 1 21 ASP N N -1.792 9.900 -14.289 1.00 . A A . 29 ASP N 1 1
15 5761 1 1 21 ASP O O -1.961 12.791 -16.425 1.00 . A A . 29 ASP O 1 1
15 5762 1 1 21 ASP OD1 O -3.061 10.762 -17.804 1.00 . A A . 29 ASP OD1 1 1
15 5763 1 1 21 ASP OD2 O -3.102 8.656 -17.357 1.00 . A A . 29 ASP OD2 1 1
15 5764 1 1 22 THR C C -3.983 14.122 -13.857 1.00 . A A . 30 THR C 1 1
15 5765 1 1 22 THR CA C -4.276 13.053 -14.905 1.00 . A A . 30 THR CA 1 1
15 5766 1 1 22 THR CB C -5.686 12.501 -14.689 1.00 . A A . 30 THR CB 1 1
15 5767 1 1 22 THR CG2 C -5.784 11.871 -13.300 1.00 . A A . 30 THR CG2 1 1
15 5768 1 1 22 THR H H -3.436 11.244 -14.172 1.00 . A A . 30 THR H 1 1
15 5769 1 1 22 THR HA H -4.226 13.502 -15.887 1.00 . A A . 30 THR HA 1 1
15 5770 1 1 22 THR HB H -5.897 11.750 -15.436 1.00 . A A . 30 THR HB 1 1
15 5771 1 1 22 THR HG1 H -6.363 14.116 -15.535 1.00 . A A . 30 THR HG1 1 1
15 5772 1 1 22 THR HG21 H -6.678 11.267 -13.241 1.00 . A A . 30 THR HG21 1 1
15 5773 1 1 22 THR HG22 H -5.826 12.650 -12.553 1.00 . A A . 30 THR HG22 1 1
15 5774 1 1 22 THR HG23 H -4.918 11.250 -13.124 1.00 . A A . 30 THR HG23 1 1
15 5775 1 1 22 THR N N -3.299 11.967 -14.816 1.00 . A A . 30 THR N 1 1
15 5776 1 1 22 THR O O -4.167 15.314 -14.105 1.00 . A A . 30 THR O 1 1
15 5777 1 1 22 THR OG1 O -6.629 13.558 -14.801 1.00 . A A . 30 THR OG1 1 1
15 5778 1 1 23 LEU C C -2.126 15.598 -12.047 1.00 . A A . 31 LEU C 1 1
15 5779 1 1 23 LEU CA C -3.213 14.620 -11.609 1.00 . A A . 31 LEU CA 1 1
15 5780 1 1 23 LEU CB C -2.743 13.844 -10.368 1.00 . A A . 31 LEU CB 1 1
15 5781 1 1 23 LEU CD1 C -4.250 14.626 -8.498 1.00 . A A . 31 LEU CD1 1 1
15 5782 1 1 23 LEU CD2 C -1.816 14.281 -8.067 1.00 . A A . 31 LEU CD2 1 1
15 5783 1 1 23 LEU CG C -2.846 14.735 -9.109 1.00 . A A . 31 LEU CG 1 1
15 5784 1 1 23 LEU H H -3.400 12.728 -12.546 1.00 . A A . 31 LEU H 1 1
15 5785 1 1 23 LEU HA H -4.102 15.176 -11.358 1.00 . A A . 31 LEU HA 1 1
15 5786 1 1 23 LEU HB2 H -3.358 12.963 -10.244 1.00 . A A . 31 LEU HB2 1 1
15 5787 1 1 23 LEU HB3 H -1.715 13.539 -10.512 1.00 . A A . 31 LEU HB3 1 1
15 5788 1 1 23 LEU HD11 H -4.351 13.674 -7.997 1.00 . A A . 31 LEU HD11 1 1
15 5789 1 1 23 LEU HD12 H -4.992 14.703 -9.276 1.00 . A A . 31 LEU HD12 1 1
15 5790 1 1 23 LEU HD13 H -4.393 15.424 -7.784 1.00 . A A . 31 LEU HD13 1 1
15 5791 1 1 23 LEU HD21 H -1.971 13.236 -7.838 1.00 . A A . 31 LEU HD21 1 1
15 5792 1 1 23 LEU HD22 H -1.932 14.868 -7.167 1.00 . A A . 31 LEU HD22 1 1
15 5793 1 1 23 LEU HD23 H -0.820 14.419 -8.461 1.00 . A A . 31 LEU HD23 1 1
15 5794 1 1 23 LEU HG H -2.653 15.766 -9.376 1.00 . A A . 31 LEU HG 1 1
15 5795 1 1 23 LEU N N -3.526 13.688 -12.687 1.00 . A A . 31 LEU N 1 1
15 5796 1 1 23 LEU O O -0.959 15.230 -12.170 1.00 . A A . 31 LEU O 1 1
15 5797 1 1 24 GLY C C -2.298 19.151 -13.099 1.00 . A A . 32 GLY C 1 1
15 5798 1 1 24 GLY CA C -1.573 17.869 -12.707 1.00 . A A . 32 GLY CA 1 1
15 5799 1 1 24 GLY H H -3.466 17.081 -12.168 1.00 . A A . 32 GLY H 1 1
15 5800 1 1 24 GLY HA2 H -0.891 18.079 -11.896 1.00 . A A . 32 GLY HA2 1 1
15 5801 1 1 24 GLY HA3 H -1.016 17.506 -13.557 1.00 . A A . 32 GLY HA3 1 1
15 5802 1 1 24 GLY N N -2.521 16.845 -12.282 1.00 . A A . 32 GLY N 1 1
15 5803 1 1 24 GLY O O -2.854 19.788 -12.219 1.00 . A A . 32 GLY O 1 1
15 5804 1 1 24 GLY OXT O -2.289 19.478 -14.275 1.00 . A A . 32 GLY OXT 1 1
15 5805 2 2 1 ZN ZN ZN -6.357 3.989 -10.215 1.00 . B A . 300 ZN ZN 1 1
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