NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | subtype | item_count |
|
|
481793 |
1hpk   |
cing | 4-filtered-FRED | STAR | entry | full | 473 |
data_FRED_restraints_with_modified_coordinates_PDB_code_1hpk
# This FRED archive file contains, for PDB entry <1hpk>:
#
# - Coordinates and sequence information from the PDB mmCIF file
# - NMR restraints from the PDB MR file
#
# In this file, the coordinates and NMR restraints share the same atom names,
# and in this way can differ from the data deposited at the wwPDB. To achieve
# this aim, the NMR restraints were parsed from their original format files, and
# the coordinates and NMR restraints information were subsequently harmonized.
#
# Due to the complexity of this harmonization process and the filtering process
# used in creating these files, the NMR restraints information in these files
# may differ significantly from that in the originally deposited file. Other
# modifications could have occurred to the NMR restraints information, or data
# could have been lost because of parsing or conversion errors. The PDB file
# remains the authoritative reference for the atomic coordinates and the
# originally deposited restraints files remain the primary reference for these
# data.
#
# This file is generated at the BioMagResBank (BMRB) in collaboration with the
# PDBe (formerly MSD) group at the European Bioinformatics Institute (EBI) and
# the CMBI/IMM group at the Radboud University of Nijmegen.
#
# Several software packages were used to produce this file:
#
# - Wattos (BMRB and CMBI/IMM).
# - FormatConverter and NMRStarExport (PDBe).
# - CCPN framework (http://www.ccpn.ac.uk/).
#
# More information about this process can be found in the references below.
# Please cite the original reference for this PDB entry.
#
# JF Doreleijers, A Nederveen, W Vranken, J Lin, AM Bonvin, R Kaptein, JL
# Markley, and EL Ulrich (2005). BioMagResBank databases DOCR and FRED
# containing converted and filtered sets of experimental NMR restraints and
# coordinates from over 500 protein PDB structures. J. Biomol. NMR 32, 1-12.
#
# WF Vranken, W Boucher, TJ Stevens, RH Fogh, A Pajon, M Llinas, EL Ulrich, JL
# Markley, J Ionides, ED Laue (2005). The CCPN data model for NMR spectroscopy:
# development of a software pipeline. Proteins 59, 687-696.
#
# JF Doreleijers, WF Vranken, C Schulte, J Lin, JR Wedell, CJ Penkett, GW Vuister,
# G Vriend, JL Markley, and EL Ulrich (2009). The NMR Restraints Grid at BMRB for
# 5,266 Protein and Nucleic Acid PDB Entries. J Biomol. NMR 45, 389?396.
save_Conversion_project_for_entry_Name_1
_Study_list.Sf_category study_list
_Study_list.Entry_ID 1
_Study_list.ID 1
loop_
_Study.ID
_Study.Name
_Study.Type
_Study.Details
_Study.Entry_ID
_Study.Study_list_ID
1 "Conversion project for entry 1" NMR . 1 1
stop_
save_
save_originalConstraints_1
_Entry.Sf_category entry_information
_Entry.ID 1
_Entry.Title "Data for entry 1"
_Entry.NMR_STAR_version 3.1.0.8
_Entry.Experimental_method NMR
_Entry.Details .
save_
save_assembly_1hpk
_Assembly.Sf_category assembly
_Assembly.Entry_ID 1
_Assembly.ID 1
_Assembly.Name 1hpk
_Assembly.Number_of_components 2
_Assembly.Organic_ligands .
_Assembly.Metal_ions .
_Assembly.Paramagnetic .
_Assembly.Thiol_state "all disulfide bound"
_Assembly.Molecular_mass 9189.01
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 $PLASMINOGEN A . 1 1
2 . 2 $6_AMINOHEXANOIC_ACID 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 ACA 1 ACA 1 1
stop_
save_
save_PLASMINOGEN
_Entity.Sf_category entity
_Entity.Entry_ID 1
_Entity.ID 1
_Entity.Name PLASMINOGEN
_Entity.Type polymer
_Entity.Polymer_type polypeptide(L)
_Entity.Polymer_seq_one_letter_code CKTGNGKNYRGTMSKTKNGITCQKWSSTSPHRPRFSPATHPSEGLEENYCRNPDNDPQGPWCYTTDPEKRYDYCDILEC
_Entity.Number_of_monomers 79
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 CYS . 1 1
2 LYS . 1 1
3 THR . 1 1
4 GLY . 1 1
5 ASN . 1 1
6 GLY . 1 1
7 LYS . 1 1
8 ASN . 1 1
9 TYR . 1 1
10 ARG . 1 1
11 GLY . 1 1
12 THR . 1 1
13 MET . 1 1
14 SER . 1 1
15 LYS . 1 1
16 THR . 1 1
17 LYS . 1 1
18 ASN . 1 1
19 GLY . 1 1
20 ILE . 1 1
21 THR . 1 1
22 CYS . 1 1
23 GLN . 1 1
24 LYS . 1 1
25 TRP . 1 1
26 SER . 1 1
27 SER . 1 1
28 THR . 1 1
29 SER . 1 1
30 PRO . 1 1
31 HIS . 1 1
32 ARG . 1 1
33 PRO . 1 1
34 ARG . 1 1
35 PHE . 1 1
36 SER . 1 1
37 PRO . 1 1
38 ALA . 1 1
39 THR . 1 1
40 HIS . 1 1
41 PRO . 1 1
42 SER . 1 1
43 GLU . 1 1
44 GLY . 1 1
45 LEU . 1 1
46 GLU . 1 1
47 GLU . 1 1
48 ASN . 1 1
49 TYR . 1 1
50 CYS . 1 1
51 ARG . 1 1
52 ASN . 1 1
53 PRO . 1 1
54 ASP . 1 1
55 ASN . 1 1
56 ASP . 1 1
57 PRO . 1 1
58 GLN . 1 1
59 GLY . 1 1
60 PRO . 1 1
61 TRP . 1 1
62 CYS . 1 1
63 TYR . 1 1
64 THR . 1 1
65 THR . 1 1
66 ASP . 1 1
67 PRO . 1 1
68 GLU . 1 1
69 LYS . 1 1
70 ARG . 1 1
71 TYR . 1 1
72 ASP . 1 1
73 TYR . 1 1
74 CYS . 1 1
75 ASP . 1 1
76 ILE . 1 1
77 LEU . 1 1
78 GLU . 1 1
79 CYS . 1 1
stop_
loop_
_Entity_poly_seq.Mon_ID
_Entity_poly_seq.Num
_Entity_poly_seq.Comp_index_ID
_Entity_poly_seq.Entry_ID
_Entity_poly_seq.Entity_ID
CYS 1 1 1 1
LYS 2 2 1 1
THR 3 3 1 1
GLY 4 4 1 1
ASN 5 5 1 1
GLY 6 6 1 1
LYS 7 7 1 1
ASN 8 8 1 1
TYR 9 9 1 1
ARG 10 10 1 1
GLY 11 11 1 1
THR 12 12 1 1
MET 13 13 1 1
SER 14 14 1 1
LYS 15 15 1 1
THR 16 16 1 1
LYS 17 17 1 1
ASN 18 18 1 1
GLY 19 19 1 1
ILE 20 20 1 1
THR 21 21 1 1
CYS 22 22 1 1
GLN 23 23 1 1
LYS 24 24 1 1
TRP 25 25 1 1
SER 26 26 1 1
SER 27 27 1 1
THR 28 28 1 1
SER 29 29 1 1
PRO 30 30 1 1
HIS 31 31 1 1
ARG 32 32 1 1
PRO 33 33 1 1
ARG 34 34 1 1
PHE 35 35 1 1
SER 36 36 1 1
PRO 37 37 1 1
ALA 38 38 1 1
THR 39 39 1 1
HIS 40 40 1 1
PRO 41 41 1 1
SER 42 42 1 1
GLU 43 43 1 1
GLY 44 44 1 1
LEU 45 45 1 1
GLU 46 46 1 1
GLU 47 47 1 1
ASN 48 48 1 1
TYR 49 49 1 1
CYS 50 50 1 1
ARG 51 51 1 1
ASN 52 52 1 1
PRO 53 53 1 1
ASP 54 54 1 1
ASN 55 55 1 1
ASP 56 56 1 1
PRO 57 57 1 1
GLN 58 58 1 1
GLY 59 59 1 1
PRO 60 60 1 1
TRP 61 61 1 1
CYS 62 62 1 1
TYR 63 63 1 1
THR 64 64 1 1
THR 65 65 1 1
ASP 66 66 1 1
PRO 67 67 1 1
GLU 68 68 1 1
LYS 69 69 1 1
ARG 70 70 1 1
TYR 71 71 1 1
ASP 72 72 1 1
TYR 73 73 1 1
CYS 74 74 1 1
ASP 75 75 1 1
ILE 76 76 1 1
LEU 77 77 1 1
GLU 78 78 1 1
CYS 79 79 1 1
stop_
save_
save_6_AMINOHEXANOIC_ACID
_Entity.Sf_category entity
_Entity.Entry_ID 1
_Entity.ID 2
_Entity.Name "6 AMINOHEXANOIC ACID"
_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 ACA $ACA 1 2
stop_
save_
save_ACA
_Chem_comp.Sf_category chem_comp
_Chem_comp.Entry_ID 1
_Chem_comp.ID ACA
_Chem_comp.Type non-polymer
save_
save_CNS/XPLOR_distance_constraints_5_1
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID 1
_Distance_constraint_list.ID 1
_Distance_constraint_list.Constraint_type NOE
_Distance_constraint_list.Constraint_file_ID .
_Distance_constraint_list.Block_ID .
loop_
_Dist_constraint_tree.Constraint_ID
_Dist_constraint_tree.Node_ID
_Dist_constraint_tree.Down_node_ID
_Dist_constraint_tree.Right_node_ID
_Dist_constraint_tree.Logic_operation
_Dist_constraint_tree.Entry_ID
_Dist_constraint_tree.Distance_constraint_list_ID
1 1 . . . 1 1
2 1 . . . 1 1
3 1 . . . 1 1
4 1 . . . 1 1
5 1 . . . 1 1
6 1 . . . 1 1
7 1 . . . 1 1
8 1 . . . 1 1
9 1 . . . 1 1
10 1 . . . 1 1
11 1 . . . 1 1
12 1 . . . 1 1
13 1 . . . 1 1
14 1 . . . 1 1
15 1 . . . 1 1
16 1 . . . 1 1
17 1 . . . 1 1
18 1 . . . 1 1
19 1 . . . 1 1
20 1 . . . 1 1
21 1 . . . 1 1
22 1 . . . 1 1
23 1 . . . 1 1
24 1 . . . 1 1
25 1 . . . 1 1
26 1 . . . 1 1
27 1 . . . 1 1
28 1 . . . 1 1
29 1 . . . 1 1
30 1 . . . 1 1
31 1 . . . 1 1
32 1 . . . 1 1
33 1 . . . 1 1
34 1 . . . 1 1
35 1 . . . 1 1
36 1 . . . 1 1
37 1 . . . 1 1
38 1 . . . 1 1
39 1 . . . 1 1
40 1 . . . 1 1
41 1 . . . 1 1
42 1 . . . 1 1
43 1 . . . 1 1
44 1 . . . 1 1
45 1 . . . 1 1
46 1 . . . 1 1
47 1 . . . 1 1
48 1 . . . 1 1
49 1 . . . 1 1
50 1 . . . 1 1
51 1 . . . 1 1
52 1 . . . 1 1
53 1 . . . 1 1
54 1 . . . 1 1
55 1 . . . 1 1
56 1 . . . 1 1
57 1 . . . 1 1
58 1 . . . 1 1
59 1 . . . 1 1
60 1 . . . 1 1
61 1 . . . 1 1
62 1 . . . 1 1
63 1 . . . 1 1
64 1 . . . 1 1
65 1 . . . 1 1
66 1 . . . 1 1
67 1 . . . 1 1
68 1 . . . 1 1
69 1 . . . 1 1
70 1 . . . 1 1
71 1 . . . 1 1
72 1 . . . 1 1
73 1 . . . 1 1
74 1 . . . 1 1
75 1 . . . 1 1
76 1 . . . 1 1
77 1 . . . 1 1
78 1 . . . 1 1
79 1 . . . 1 1
80 1 . . . 1 1
81 1 . . . 1 1
82 1 . . . 1 1
83 1 . . . 1 1
84 1 . . . 1 1
85 1 . . . 1 1
86 1 . . . 1 1
87 1 . . . 1 1
88 1 . . . 1 1
89 1 . . . 1 1
90 1 . . . 1 1
91 1 . . . 1 1
92 1 . . . 1 1
93 1 . . . 1 1
94 1 . . . 1 1
95 1 . . . 1 1
96 1 . . . 1 1
97 1 . . . 1 1
98 1 . . . 1 1
99 1 . . . 1 1
100 1 . . . 1 1
101 1 . . . 1 1
102 1 . . . 1 1
103 1 . . . 1 1
104 1 . . . 1 1
105 1 . . . 1 1
106 1 . . . 1 1
107 1 . . . 1 1
108 1 . . . 1 1
109 1 . . . 1 1
110 1 . . . 1 1
111 1 . . . 1 1
112 1 . . . 1 1
113 1 . . . 1 1
114 1 . . . 1 1
115 1 . . . 1 1
116 1 . . . 1 1
117 1 . . . 1 1
118 1 . . . 1 1
119 1 . . . 1 1
120 1 . . . 1 1
121 1 . . . 1 1
122 1 . . . 1 1
123 1 . . . 1 1
124 1 . . . 1 1
125 1 . . . 1 1
126 1 . . . 1 1
127 1 . . . 1 1
128 1 . . . 1 1
129 1 . . . 1 1
130 1 . . . 1 1
131 1 . . . 1 1
132 1 . . . 1 1
133 1 . . . 1 1
134 1 . . . 1 1
135 1 . . . 1 1
136 1 . . . 1 1
137 1 . . . 1 1
138 1 . . . 1 1
139 1 . . . 1 1
140 1 . . . 1 1
141 1 . . . 1 1
142 1 . . . 1 1
143 1 . . . 1 1
144 1 . . . 1 1
145 1 . . . 1 1
146 1 . . . 1 1
147 1 . . . 1 1
148 1 . . . 1 1
149 1 . . . 1 1
150 1 . . . 1 1
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154 1 . . . 1 1
155 1 . . . 1 1
156 1 . . . 1 1
157 1 . . . 1 1
158 1 . . . 1 1
159 1 . . . 1 1
160 1 . . . 1 1
161 1 . . . 1 1
162 1 . . . 1 1
163 1 . . . 1 1
164 1 . . . 1 1
165 1 . . . 1 1
166 1 . . . 1 1
167 1 . . . 1 1
168 1 . . . 1 1
169 1 . . . 1 1
170 1 . . . 1 1
171 1 . . . 1 1
172 1 . . . 1 1
173 1 . . . 1 1
174 1 . . . 1 1
175 1 . . . 1 1
176 1 . . . 1 1
177 1 . . . 1 1
178 1 . . . 1 1
179 1 . . . 1 1
180 1 . . . 1 1
181 1 . . . 1 1
182 1 . . . 1 1
183 1 . . . 1 1
184 1 . . . 1 1
185 1 . . . 1 1
186 1 . . . 1 1
187 1 . . . 1 1
188 1 . . . 1 1
189 1 . . . 1 1
190 1 . . . 1 1
191 1 . . . 1 1
192 1 . . . 1 1
193 1 . . . 1 1
194 1 . . . 1 1
195 1 . . . 1 1
196 1 . . . 1 1
197 1 . . . 1 1
198 1 . . . 1 1
199 1 . . . 1 1
200 1 . . . 1 1
201 1 . . . 1 1
202 1 . . . 1 1
203 1 . . . 1 1
204 1 . . . 1 1
205 1 . . . 1 1
206 1 . . . 1 1
207 1 . . . 1 1
208 1 . . . 1 1
209 1 . . . 1 1
210 1 . . . 1 1
211 1 . . . 1 1
212 1 . . . 1 1
213 1 . . . 1 1
214 1 . . . 1 1
215 1 . . . 1 1
216 1 . . . 1 1
217 1 . . . 1 1
218 1 . . . 1 1
219 1 . . . 1 1
220 1 . . . 1 1
221 1 . . . 1 1
222 1 . . . 1 1
223 1 . . . 1 1
224 1 . . . 1 1
225 1 . . . 1 1
226 1 . . . 1 1
227 1 . . . 1 1
228 1 . . . 1 1
229 1 . . . 1 1
230 1 . . . 1 1
231 1 . . . 1 1
232 1 . . . 1 1
233 1 . . . 1 1
234 1 . . . 1 1
235 1 . . . 1 1
236 1 . . . 1 1
237 1 . . . 1 1
238 1 . . . 1 1
239 1 . . . 1 1
240 1 . . . 1 1
241 1 . . . 1 1
242 1 . . . 1 1
243 1 . . . 1 1
244 1 . . . 1 1
245 1 . . . 1 1
246 1 . . . 1 1
247 1 . . . 1 1
248 1 . . . 1 1
249 1 . . . 1 1
250 1 . . . 1 1
251 1 . . . 1 1
252 1 . . . 1 1
253 1 . . . 1 1
254 1 . . . 1 1
255 1 . . . 1 1
256 1 . . . 1 1
257 1 . . . 1 1
258 1 . . . 1 1
259 1 . . . 1 1
260 1 . . . 1 1
261 1 . . . 1 1
262 1 . . . 1 1
263 1 . . . 1 1
264 1 . . . 1 1
265 1 . . . 1 1
266 1 . . . 1 1
267 1 . . . 1 1
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
329 1 . . . 1 1
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
345 1 . . . 1 1
346 1 . . . 1 1
347 1 . . . 1 1
348 1 . . . 1 1
349 1 . . . 1 1
350 1 . . . 1 1
351 1 . . . 1 1
352 1 . . . 1 1
353 1 . . . 1 1
354 1 . . . 1 1
355 1 . . . 1 1
356 1 . . . 1 1
357 1 . . . 1 1
358 1 . . . 1 1
359 1 . . . 1 1
360 1 . . . 1 1
361 1 . . . 1 1
362 1 . . . 1 1
363 1 . . . 1 1
364 1 . . . 1 1
365 1 . . . 1 1
366 1 . . . 1 1
367 1 . . . 1 1
368 1 . . . 1 1
369 1 . . . 1 1
370 1 . . . 1 1
371 1 . . . 1 1
372 1 . . . 1 1
373 1 . . . 1 1
374 1 . . . 1 1
375 1 . . . 1 1
376 1 . . . 1 1
377 1 . . . 1 1
378 1 . . . 1 1
379 1 . . . 1 1
380 1 . . . 1 1
381 1 . . . 1 1
382 1 . . . 1 1
383 1 . . . 1 1
384 1 . . . 1 1
385 1 . . . 1 1
386 1 . . . 1 1
387 1 . . . 1 1
388 1 . . . 1 1
389 1 . . . 1 1
390 1 . . . 1 1
391 1 . . . 1 1
392 1 . . . 1 1
393 1 . . . 1 1
394 1 . . . 1 1
395 1 . . . 1 1
396 1 . . . 1 1
397 1 . . . 1 1
398 1 . . . 1 1
399 1 . . . 1 1
400 1 . . . 1 1
401 1 . . . 1 1
402 1 . . . 1 1
403 1 . . . 1 1
404 1 . . . 1 1
405 1 . . . 1 1
406 1 . . . 1 1
407 1 . . . 1 1
stop_
loop_
_Dist_constraint.Tree_node_member_constraint_ID
_Dist_constraint.Tree_node_member_node_ID
_Dist_constraint.Constraint_tree_node_member_ID
_Dist_constraint.Entity_assembly_ID
_Dist_constraint.Entity_ID
_Dist_constraint.Comp_index_ID
_Dist_constraint.Comp_ID
_Dist_constraint.Atom_ID
_Dist_constraint.Auth_asym_ID
_Dist_constraint.Auth_seq_ID
_Dist_constraint.Auth_comp_ID
_Dist_constraint.Auth_atom_ID
_Dist_constraint.Entry_ID
_Dist_constraint.Distance_constraint_list_ID
1 1 1 1 1 1 CYS HA . 1 . HA 1 1
1 1 2 1 1 2 LYS H . 2 . HN 1 1
2 1 1 1 1 1 CYS HA . 1 . HA 1 1
2 1 2 1 1 76 ILE MG . 76 . HG2* 1 1
3 1 1 1 1 1 CYS QB . 1 . HB* 1 1
3 1 2 1 1 2 LYS H . 2 . HN 1 1
4 1 1 1 1 1 CYS QB . 1 . HB* 1 1
4 1 2 1 1 79 CYS H . 79 . HN 1 1
5 1 1 1 1 1 CYS QB . 1 . HB* 1 1
5 1 2 1 1 79 CYS QB . 79 . HB* 1 1
6 1 1 1 1 2 LYS CG . 2 . CG 1 1
6 1 2 1 1 2 LYS H . 2 . HN 1 1
7 1 1 1 1 2 LYS H . 2 . HN 1 1
7 1 2 1 1 2 LYS QB . 2 . HB* 1 1
8 1 1 1 1 2 LYS H . 2 . HN 1 1
8 1 2 1 1 76 ILE MG . 76 . HG2* 1 1
9 1 1 1 1 2 LYS HA . 2 . HA 1 1
9 1 2 1 1 3 THR H . 3 . HN 1 1
10 1 1 1 1 2 LYS HA . 2 . HA 1 1
10 1 2 1 1 6 GLY H . 6 . HN 1 1
11 1 1 1 1 2 LYS HA . 2 . HA 1 1
11 1 2 1 1 9 TYR QD . 9 . HD* 1 1
12 1 1 1 1 2 LYS QB . 2 . HB* 1 1
12 1 2 1 1 3 THR H . 3 . HN 1 1
13 1 1 1 1 2 LYS QB . 2 . HB* 1 1
13 1 2 1 1 8 ASN H . 8 . HN 1 1
14 1 1 1 1 2 LYS HB2 . 2 . HB2 1 1
14 1 2 1 1 5 ASN ND2 . 5 . ND2 1 1
15 1 1 1 1 2 LYS HB3 . 2 . HB1 1 1
15 1 2 1 1 5 ASN ND2 . 5 . ND2 1 1
16 1 1 1 1 3 THR H . 3 . HN 1 1
16 1 2 1 1 3 THR HB . 3 . HB 1 1
17 1 1 1 1 3 THR H . 3 . HN 1 1
17 1 2 1 1 3 THR MG . 3 . HG2* 1 1
18 1 1 1 1 3 THR HA . 3 . HA 1 1
18 1 2 1 1 4 GLY H . 4 . HN 1 1
19 1 1 1 1 4 GLY H . 4 . HN 1 1
19 1 2 1 1 4 GLY HA2 . 4 . HA2 1 1
20 1 1 1 1 4 GLY H . 4 . HN 1 1
20 1 2 1 1 4 GLY HA3 . 4 . HA1 1 1
21 1 1 1 1 4 GLY HA2 . 4 . HA2 1 1
21 1 2 1 1 5 ASN H . 5 . HN 1 1
22 1 1 1 1 4 GLY HA3 . 4 . HA1 1 1
22 1 2 1 1 5 ASN H . 5 . HN 1 1
23 1 1 1 1 5 ASN HA . 5 . HA 1 1
23 1 2 1 1 6 GLY H . 6 . HN 1 1
24 1 1 1 1 5 ASN HB2 . 5 . HB2 1 1
24 1 2 1 1 5 ASN QD . 5 . HD2* 1 1
25 1 1 1 1 5 ASN HB3 . 5 . HB1 1 1
25 1 2 1 1 5 ASN QD . 5 . HD2* 1 1
26 1 1 1 1 5 ASN HD21 . 5 . HD21 1 1
26 1 2 1 1 55 ASN HA . 55 . HA 1 1
27 1 1 1 1 5 ASN HD22 . 5 . HD22 1 1
27 1 2 1 1 55 ASN HA . 55 . HA 1 1
28 1 1 1 1 5 ASN ND2 . 5 . ND2 1 1
28 1 2 1 1 52 ASN ND2 . 52 . ND2 1 1
29 1 1 1 1 7 LYS H . 7 . HN 1 1
29 1 2 1 1 7 LYS HA . 7 . HA 1 1
30 1 1 1 1 8 ASN H . 8 . HN 1 1
30 1 2 1 1 9 TYR H . 9 . HN 1 1
31 1 1 1 1 8 ASN HA . 8 . HA 1 1
31 1 2 1 1 9 TYR QD . 9 . HD* 1 1
32 1 1 1 1 9 TYR CZ . 9 . CZ 1 1
32 1 2 1 1 76 ILE CD1 . 76 . CD1 1 1
33 1 1 1 1 9 TYR CZ . 9 . CZ 1 1
33 1 2 1 1 76 ILE MG . 76 . HG2* 1 1
34 1 1 1 1 9 TYR H . 9 . HN 1 1
34 1 2 1 1 9 TYR HA . 9 . HA 1 1
35 1 1 1 1 9 TYR H . 9 . HN 1 1
35 1 2 1 1 9 TYR QB . 9 . HB* 1 1
36 1 1 1 1 9 TYR HA . 9 . HA 1 1
36 1 2 1 1 10 ARG H . 10 . HN 1 1
37 1 1 1 1 9 TYR QD . 9 . HD* 1 1
37 1 2 1 1 10 ARG QB . 10 . HB* 1 1
38 1 1 1 1 9 TYR QD . 9 . HD* 1 1
38 1 2 1 1 11 GLY H . 11 . HN 1 1
39 1 1 1 1 9 TYR QD . 9 . HD* 1 1
39 1 2 1 1 76 ILE CD1 . 76 . CD1 1 1
40 1 1 1 1 9 TYR QD . 9 . HD* 1 1
40 1 2 1 1 76 ILE MG . 76 . HG2* 1 1
41 1 1 1 1 11 GLY CA . 11 . CA 1 1
41 1 2 1 1 75 ASP HA . 75 . HA 1 1
42 1 1 1 1 11 GLY QA . 11 . HA* 1 1
42 1 2 1 1 12 THR H . 12 . HN 1 1
43 1 1 1 1 12 THR H . 12 . HN 1 1
43 1 2 1 1 12 THR HA . 12 . HA 1 1
44 1 1 1 1 12 THR H . 12 . HN 1 1
44 1 2 1 1 12 THR HG1 . 12 . HG1 1 1
45 1 1 1 1 12 THR H . 12 . HN 1 1
45 1 2 1 1 12 THR MG . 12 . HG2* 1 1
46 1 1 1 1 12 THR HA . 12 . HA 1 1
46 1 2 1 1 12 THR MG . 12 . HG2* 1 1
47 1 1 1 1 12 THR HA . 12 . HA 1 1
47 1 2 1 1 49 TYR CZ . 49 . CZ 1 1
48 1 1 1 1 12 THR HA . 12 . HA 1 1
48 1 2 1 1 49 TYR QD . 49 . HD* 1 1
49 1 1 1 1 12 THR HA . 12 . HA 1 1
49 1 2 1 1 50 CYS H . 50 . HN 1 1
50 1 1 1 1 12 THR HB . 12 . HB 1 1
50 1 2 1 1 49 TYR CZ . 49 . CZ 1 1
51 1 1 1 1 12 THR HB . 12 . HB 1 1
51 1 2 1 1 49 TYR QD . 49 . HD* 1 1
52 1 1 1 1 12 THR HB . 12 . HB 1 1
52 1 2 1 1 76 ILE HG12 . 76 . HG12 1 1
53 1 1 1 1 12 THR HB . 12 . HB 1 1
53 1 2 1 1 76 ILE HG13 . 76 . HG11 1 1
54 1 1 1 1 12 THR MG . 12 . HG2* 1 1
54 1 2 1 1 49 TYR CZ . 49 . CZ 1 1
55 1 1 1 1 13 MET HA . 13 . HA 1 1
55 1 2 1 1 14 SER H . 14 . HN 1 1
56 1 1 1 1 14 SER H . 14 . HN 1 1
56 1 2 1 1 14 SER HA . 14 . HA 1 1
57 1 1 1 1 14 SER H . 14 . HN 1 1
57 1 2 1 1 15 LYS H . 15 . HN 1 1
58 1 1 1 1 14 SER HA . 14 . HA 1 1
58 1 2 1 1 15 LYS H . 15 . HN 1 1
59 1 1 1 1 14 SER HA . 14 . HA 1 1
59 1 2 1 1 49 TYR HA . 49 . HA 1 1
60 1 1 1 1 14 SER HA . 14 . HA 1 1
60 1 2 1 1 50 CYS H . 50 . HN 1 1
61 1 1 1 1 14 SER HB2 . 14 . HB2 1 1
61 1 2 1 1 49 TYR QD . 49 . HD* 1 1
62 1 1 1 1 14 SER HB3 . 14 . HB1 1 1
62 1 2 1 1 49 TYR QD . 49 . HD* 1 1
63 1 1 1 1 15 LYS H . 15 . HN 1 1
63 1 2 1 1 15 LYS HA . 15 . HA 1 1
64 1 1 1 1 15 LYS H . 15 . HN 1 1
64 1 2 1 1 15 LYS QG . 15 . HG* 1 1
65 1 1 1 1 15 LYS H . 15 . HN 1 1
65 1 2 1 1 22 CYS QB . 22 . HB* 1 1
66 1 1 1 1 15 LYS HA . 15 . HA 1 1
66 1 2 1 1 16 THR H . 16 . HN 1 1
67 1 1 1 1 15 LYS HA . 15 . HA 1 1
67 1 2 1 1 16 THR MG . 16 . HG2* 1 1
68 1 1 1 1 15 LYS HA . 15 . HA 1 1
68 1 2 1 1 21 THR HA . 21 . HA 1 1
69 1 1 1 1 15 LYS HA . 15 . HA 1 1
69 1 2 1 1 21 THR MG . 21 . HG2* 1 1
70 1 1 1 1 15 LYS HA . 15 . HA 1 1
70 1 2 1 1 22 CYS H . 22 . HN 1 1
71 1 1 1 1 16 THR H . 16 . HN 1 1
71 1 2 1 1 16 THR HA . 16 . HA 1 1
72 1 1 1 1 16 THR H . 16 . HN 1 1
72 1 2 1 1 16 THR MG . 16 . HG2* 1 1
73 1 1 1 1 16 THR H . 16 . HN 1 1
73 1 2 1 1 20 ILE H . 20 . HN 1 1
74 1 1 1 1 16 THR H . 16 . HN 1 1
74 1 2 1 1 20 ILE HB . 20 . HB 1 1
75 1 1 1 1 16 THR HA . 16 . HA 1 1
75 1 2 1 1 17 LYS H . 17 . HN 1 1
76 1 1 1 1 16 THR HG1 . 16 . HG1 1 1
76 1 2 1 1 16 THR MG . 16 . HG2* 1 1
77 1 1 1 1 16 THR HG1 . 16 . HG1 1 1
77 1 2 1 1 20 ILE HB . 20 . HB 1 1
78 1 1 1 1 17 LYS CD . 17 . CD 1 1
78 1 2 1 1 73 TYR CG . 73 . CG 1 1
79 1 1 1 1 17 LYS H . 17 . HN 1 1
79 1 2 1 1 17 LYS QB . 17 . HB* 1 1
80 1 1 1 1 17 LYS H . 17 . HN 1 1
80 1 2 1 1 17 LYS QG . 17 . HG* 1 1
81 1 1 1 1 17 LYS H . 17 . HN 1 1
81 1 2 1 1 18 ASN H . 18 . HN 1 1
82 1 1 1 1 17 LYS HA . 17 . HA 1 1
82 1 2 1 1 17 LYS QB . 17 . HB* 1 1
83 1 1 1 1 17 LYS HA . 17 . HA 1 1
83 1 2 1 1 75 ASP H . 75 . HN 1 1
84 1 1 1 1 17 LYS HA . 17 . HA 1 1
84 1 2 1 1 75 ASP QB . 75 . HB* 1 1
85 1 1 1 1 17 LYS QB . 17 . HB* 1 1
85 1 2 1 1 73 TYR CZ . 73 . CZ 1 1
86 1 1 1 1 18 ASN H . 18 . HN 1 1
86 1 2 1 1 18 ASN QB . 18 . HB* 1 1
87 1 1 1 1 18 ASN H . 18 . HN 1 1
87 1 2 1 1 19 GLY H . 19 . HN 1 1
88 1 1 1 1 18 ASN HA . 18 . HA 1 1
88 1 2 1 1 19 GLY H . 19 . HN 1 1
89 1 1 1 1 18 ASN HB2 . 18 . HB2 1 1
89 1 2 1 1 18 ASN HD21 . 18 . HD21 1 1
90 1 1 1 1 18 ASN HB2 . 18 . HB2 1 1
90 1 2 1 1 18 ASN HD22 . 18 . HD22 1 1
91 1 1 1 1 19 GLY H . 19 . HN 1 1
91 1 2 1 1 19 GLY HA2 . 19 . HA2 1 1
92 1 1 1 1 19 GLY H . 19 . HN 1 1
92 1 2 1 1 19 GLY HA3 . 19 . HA1 1 1
93 1 1 1 1 19 GLY H . 19 . HN 1 1
93 1 2 1 1 20 ILE H . 20 . HN 1 1
94 1 1 1 1 19 GLY QA . 19 . HA* 1 1
94 1 2 1 1 20 ILE H . 20 . HN 1 1
95 1 1 1 1 20 ILE CD1 . 20 . CD1 1 1
95 1 2 1 1 20 ILE H . 20 . HN 1 1
96 1 1 1 1 20 ILE CD1 . 20 . CD1 1 1
96 1 2 1 1 20 ILE HA . 20 . HA 1 1
97 1 1 1 1 20 ILE CD1 . 20 . CD1 1 1
97 1 2 1 1 21 THR H . 21 . HN 1 1
98 1 1 1 1 20 ILE CD1 . 20 . CD1 1 1
98 1 2 1 1 22 CYS H . 22 . HN 1 1
99 1 1 1 1 20 ILE H . 20 . HN 1 1
99 1 2 1 1 20 ILE HB . 20 . HB 1 1
100 1 1 1 1 20 ILE H . 20 . HN 1 1
100 1 2 1 1 20 ILE QG . 20 . HG1* 1 1
101 1 1 1 1 20 ILE H . 20 . HN 1 1
101 1 2 1 1 72 ASP QB . 72 . HB* 1 1
102 1 1 1 1 20 ILE HA . 20 . HA 1 1
102 1 2 1 1 20 ILE HB . 20 . HB 1 1
103 1 1 1 1 20 ILE MG . 20 . HG2* 1 1
103 1 2 1 1 21 THR H . 21 . HN 1 1
104 1 1 1 1 20 ILE MG . 20 . HG2* 1 1
104 1 2 1 1 23 GLN H . 23 . HN 1 1
105 1 1 1 1 21 THR H . 21 . HN 1 1
105 1 2 1 1 21 THR HA . 21 . HA 1 1
106 1 1 1 1 21 THR H . 21 . HN 1 1
106 1 2 1 1 21 THR HB . 21 . HB 1 1
107 1 1 1 1 21 THR H . 21 . HN 1 1
107 1 2 1 1 21 THR MG . 21 . HG2* 1 1
108 1 1 1 1 21 THR MG . 21 . HG2* 1 1
108 1 2 1 1 48 ASN ND2 . 48 . ND2 1 1
109 1 1 1 1 22 CYS HA . 22 . HA 1 1
109 1 2 1 1 23 GLN H . 23 . HN 1 1
110 1 1 1 1 22 CYS HA . 22 . HA 1 1
110 1 2 1 1 64 THR HB . 64 . HB 1 1
111 1 1 1 1 22 CYS QB . 22 . HB* 1 1
111 1 2 1 1 23 GLN H . 23 . HN 1 1
112 1 1 1 1 23 GLN CG . 23 . CG 1 1
112 1 2 1 1 25 TRP H . 25 . HN 1 1
113 1 1 1 1 23 GLN H . 23 . HN 1 1
113 1 2 1 1 23 GLN HA . 23 . HA 1 1
114 1 1 1 1 23 GLN H . 23 . HN 1 1
114 1 2 1 1 23 GLN QB . 23 . HB* 1 1
115 1 1 1 1 23 GLN H . 23 . HN 1 1
115 1 2 1 1 23 GLN QG . 23 . HG* 1 1
116 1 1 1 1 23 GLN H . 23 . HN 1 1
116 1 2 1 1 64 THR HA . 64 . HA 1 1
117 1 1 1 1 23 GLN HA . 23 . HA 1 1
117 1 2 1 1 23 GLN QG . 23 . HG* 1 1
118 1 1 1 1 23 GLN QB . 23 . HB* 1 1
118 1 2 1 1 23 GLN QE . 23 . HE2* 1 1
119 1 1 1 1 23 GLN QB . 23 . HB* 1 1
119 1 2 1 1 25 TRP HZ3 . 25 . HZ3 1 1
120 1 1 1 1 23 GLN HB2 . 23 . HB2 1 1
120 1 2 1 1 23 GLN QE . 23 . HE2* 1 1
121 1 1 1 1 23 GLN HB3 . 23 . HB1 1 1
121 1 2 1 1 23 GLN QE . 23 . HE2* 1 1
122 1 1 1 1 23 GLN QG . 23 . HG* 1 1
122 1 2 1 1 26 SER QB . 26 . HB* 1 1
123 1 1 1 1 23 GLN QG . 23 . HG* 1 1
123 1 2 1 1 31 HIS HD2 . 31 . HD2 1 1
124 1 1 1 1 23 GLN NE2 . 23 . NE2 1 1
124 1 2 1 1 31 HIS H . 31 . HN 1 1
125 1 1 1 1 23 GLN NE2 . 23 . NE2 1 1
125 1 2 1 1 67 PRO QD . 67 . HD1 1 1
126 1 1 1 1 24 LYS CD . 24 . CD 1 1
126 1 2 1 1 24 LYS H . 24 . HN 1 1
127 1 1 1 1 24 LYS CG . 24 . CG 1 1
127 1 2 1 1 25 TRP H . 25 . HN 1 1
128 1 1 1 1 24 LYS H . 24 . HN 1 1
128 1 2 1 1 24 LYS HA . 24 . HA 1 1
129 1 1 1 1 24 LYS H . 24 . HN 1 1
129 1 2 1 1 24 LYS HB2 . 24 . HB2 1 1
130 1 1 1 1 24 LYS H . 24 . HN 1 1
130 1 2 1 1 24 LYS HB3 . 24 . HB1 1 1
131 1 1 1 1 24 LYS H . 24 . HN 1 1
131 1 2 1 1 25 TRP HE3 . 25 . HE3 1 1
132 1 1 1 1 24 LYS QB . 24 . HB* 1 1
132 1 2 1 1 25 TRP H . 25 . HN 1 1
133 1 1 1 1 25 TRP HA . 25 . HA 1 1
133 1 2 1 1 25 TRP HD1 . 25 . HD1 1 1
134 1 1 1 1 25 TRP HB2 . 25 . HB2 1 1
134 1 2 1 1 25 TRP HD1 . 25 . HD1 1 1
135 1 1 1 1 25 TRP HB3 . 25 . HB1 1 1
135 1 2 1 1 25 TRP HD1 . 25 . HD1 1 1
136 1 1 1 1 25 TRP HD1 . 25 . HD1 1 1
136 1 2 1 1 45 LEU MD1 . 45 . HD1* 1 1
137 1 1 1 1 25 TRP HD1 . 25 . HD1 1 1
137 1 2 1 1 45 LEU MD2 . 45 . HD2* 1 1
138 1 1 1 1 25 TRP HE1 . 25 . HE1 1 1
138 1 2 1 1 49 TYR H . 49 . HN 1 1
139 1 1 1 1 25 TRP HE1 . 25 . HE1 1 1
139 1 2 1 1 51 ARG QB . 51 . HB* 1 1
140 1 1 1 1 25 TRP HE3 . 25 . HE3 1 1
140 1 2 1 1 45 LEU CG . 45 . CG 1 1
141 1 1 1 1 25 TRP HE3 . 25 . HE3 1 1
141 1 2 1 1 45 LEU MD1 . 45 . HD1* 1 1
142 1 1 1 1 25 TRP HE3 . 25 . HE3 1 1
142 1 2 1 1 45 LEU MD2 . 45 . HD2* 1 1
143 1 1 1 1 25 TRP HZ2 . 25 . HZ2 1 1
143 1 2 1 1 45 LEU CG . 45 . CG 1 1
144 1 1 1 1 25 TRP HZ2 . 25 . HZ2 1 1
144 1 2 1 1 45 LEU QB . 45 . HB* 1 1
145 1 1 1 1 25 TRP HZ2 . 25 . HZ2 1 1
145 1 2 1 1 62 CYS HA . 62 . HA 1 1
146 1 1 1 1 25 TRP HZ3 . 25 . HZ3 1 1
146 1 2 1 1 35 PHE QB . 35 . HB* 1 1
147 1 1 1 1 26 SER H . 26 . HN 1 1
147 1 2 1 1 26 SER HB2 . 26 . HB2 1 1
148 1 1 1 1 26 SER H . 26 . HN 1 1
148 1 2 1 1 26 SER HB3 . 26 . HB1 1 1
149 1 1 1 1 26 SER H . 26 . HN 1 1
149 1 2 1 1 27 SER H . 27 . HN 1 1
150 1 1 1 1 26 SER QB . 26 . HB* 1 1
150 1 2 1 1 29 SER H . 29 . HN 1 1
151 1 1 1 1 27 SER H . 27 . HN 1 1
151 1 2 1 1 27 SER HA . 27 . HA 1 1
152 1 1 1 1 28 THR MG . 28 . HG2* 1 1
152 1 2 1 1 29 SER H . 29 . HN 1 1
153 1 1 1 1 28 THR MG . 28 . HG2* 1 1
153 1 2 1 1 29 SER HA . 29 . HA 1 1
154 1 1 1 1 28 THR MG . 28 . HG2* 1 1
154 1 2 1 1 29 SER QB . 29 . HB* 1 1
155 1 1 1 1 28 THR MG . 28 . HG2* 1 1
155 1 2 1 1 30 PRO HA . 30 . HA 1 1
156 1 1 1 1 30 PRO CD . 30 . CD 1 1
156 1 2 1 1 31 HIS H . 31 . HN 1 1
157 1 1 1 1 30 PRO HA . 30 . HA 1 1
157 1 2 1 1 31 HIS H . 31 . HN 1 1
158 1 1 1 1 31 HIS H . 31 . HN 1 1
158 1 2 1 1 31 HIS HA . 31 . HA 1 1
159 1 1 1 1 31 HIS H . 31 . HN 1 1
159 1 2 1 1 32 ARG CG . 32 . CG 1 1
160 1 1 1 1 31 HIS H . 31 . HN 1 1
160 1 2 1 1 32 ARG QD . 32 . HD* 1 1
161 1 1 1 1 31 HIS H . 31 . HN 1 1
161 1 2 1 1 32 ARG HE . 32 . HE 1 1
162 1 1 1 1 31 HIS H . 31 . HN 1 1
162 1 2 1 1 67 PRO QD . 67 . HD* 1 1
163 1 1 1 1 31 HIS HA . 31 . HA 1 1
163 1 2 1 1 32 ARG H . 32 . HN 1 1
164 1 1 1 1 31 HIS QB . 31 . HB* 1 1
164 1 2 1 1 32 ARG H . 32 . HN 1 1
165 1 1 1 1 31 HIS QB . 31 . HB* 1 1
165 1 2 1 1 67 PRO CD . 67 . CD 1 1
166 1 1 1 1 31 HIS HD2 . 31 . HD2 1 1
166 1 2 1 1 32 ARG QB . 32 . HB* 1 1
167 1 1 1 1 31 HIS HD2 . 31 . HD2 1 1
167 1 2 1 1 63 TYR QB . 63 . HB* 1 1
168 1 1 1 1 31 HIS HD2 . 31 . HD2 1 1
168 1 2 1 1 64 THR HG1 . 64 . HG1 1 1
169 1 1 1 1 31 HIS HD2 . 31 . HD2 1 1
169 1 2 1 1 65 THR MG . 65 . HG2* 1 1
170 1 1 1 1 31 HIS HD2 . 31 . HD2 1 1
170 1 2 1 1 67 PRO CD . 67 . CD 1 1
171 1 1 1 1 31 HIS HD2 . 31 . HD2 1 1
171 1 2 1 1 70 ARG QD . 70 . HD* 1 1
172 1 1 1 1 31 HIS HE1 . 31 . HE1 1 1
172 1 2 1 1 32 ARG CG . 32 . CG 1 1
173 1 1 1 1 31 HIS HE1 . 31 . HE1 1 1
173 1 2 1 1 67 PRO HA . 67 . HA 1 1
174 1 1 1 1 32 ARG H . 32 . HN 1 1
174 1 2 1 1 32 ARG HA . 32 . HA 1 1
175 1 1 1 1 32 ARG H . 32 . HN 1 1
175 1 2 1 1 32 ARG QB . 32 . HB* 1 1
176 1 1 1 1 32 ARG HA . 32 . HA 1 1
176 1 2 1 1 33 PRO HD2 . 33 . HD2 1 1
177 1 1 1 1 32 ARG HA . 32 . HA 1 1
177 1 2 1 1 33 PRO HD3 . 33 . HD1 1 1
178 1 1 1 1 34 ARG CD . 34 . CD 1 1
178 1 2 1 1 34 ARG H . 34 . HN 1 1
179 1 1 1 1 34 ARG CG . 34 . CG 1 1
179 1 2 1 1 34 ARG H . 34 . HN 1 1
180 1 1 1 1 34 ARG CG . 34 . CG 1 1
180 1 2 1 1 35 PHE QD . 35 . HD* 1 1
181 1 1 1 1 34 ARG H . 34 . HN 1 1
181 1 2 1 1 35 PHE H . 35 . HN 1 1
182 1 1 1 1 35 PHE CZ . 35 . CZ 1 1
182 1 2 1 1 37 PRO CG . 37 . CG 1 1
183 1 1 1 1 35 PHE CZ . 35 . CZ 1 1
183 1 2 1 1 53 PRO CG . 53 . CG 1 1
184 1 1 1 1 35 PHE HA . 35 . HA 1 1
184 1 2 1 1 36 SER H . 36 . HN 1 1
185 1 1 1 1 35 PHE HA . 35 . HA 1 1
185 1 2 1 1 40 HIS HD2 . 40 . HD2 1 1
186 1 1 1 1 35 PHE HB2 . 35 . HB2 1 1
186 1 2 1 1 35 PHE QD . 35 . HD* 1 1
187 1 1 1 1 35 PHE HB3 . 35 . HB1 1 1
187 1 2 1 1 35 PHE QD . 35 . HD* 1 1
188 1 1 1 1 35 PHE QD . 35 . HD* 1 1
188 1 2 1 1 40 HIS HE1 . 40 . HE1 1 1
189 1 1 1 1 35 PHE QD . 35 . HD* 1 1
189 1 2 1 1 43 GLU HA . 43 . HA 1 1
190 1 1 1 1 35 PHE QD . 35 . HD* 1 1
190 1 2 1 1 45 LEU HG . 45 . HG 1 1
191 1 1 1 1 35 PHE QD . 35 . HD* 1 1
191 1 2 1 1 61 TRP HZ2 . 61 . HZ2 1 1
192 1 1 1 1 35 PHE QE . 35 . HE* 1 1
192 1 2 1 1 61 TRP HZ2 . 61 . HZ2 1 1
193 1 1 1 1 35 PHE HZ . 35 . HZ 1 1
193 1 2 1 1 40 HIS QB . 40 . HB* 1 1
194 1 1 1 1 35 PHE HZ . 35 . HZ 1 1
194 1 2 1 1 49 TYR QB . 49 . HB* 1 1
195 1 1 1 1 36 SER H . 36 . HN 1 1
195 1 2 1 1 36 SER HA . 36 . HA 1 1
196 1 1 1 1 36 SER H . 36 . HN 1 1
196 1 2 1 1 37 PRO CG . 37 . CG 1 1
197 1 1 1 1 36 SER HA . 36 . HA 1 1
197 1 2 1 1 37 PRO HD2 . 37 . HD2 1 1
198 1 1 1 1 36 SER HA . 36 . HA 1 1
198 1 2 1 1 37 PRO HD3 . 37 . HD1 1 1
199 1 1 1 1 36 SER HA . 36 . HA 1 1
199 1 2 1 1 37 PRO HG2 . 37 . HG2 1 1
200 1 1 1 1 36 SER HA . 36 . HA 1 1
200 1 2 1 1 37 PRO HG3 . 37 . HG1 1 1
201 1 1 1 1 36 SER HA . 36 . HA 1 1
201 1 2 1 1 45 LEU QB . 45 . HB* 1 1
202 1 1 1 1 37 PRO CD . 37 . CD 1 1
202 1 2 1 1 45 LEU CG . 45 . CG 1 1
203 1 1 1 1 37 PRO HA . 37 . HA 1 1
203 1 2 1 1 38 ALA H . 38 . HN 1 1
204 1 1 1 1 38 ALA H . 38 . HN 1 1
204 1 2 1 1 38 ALA HA . 38 . HA 1 1
205 1 1 1 1 38 ALA H . 38 . HN 1 1
205 1 2 1 1 38 ALA MB . 38 . HB* 1 1
206 1 1 1 1 38 ALA MB . 38 . HB* 1 1
206 1 2 1 1 39 THR H . 39 . HN 1 1
207 1 1 1 1 39 THR H . 39 . HN 1 1
207 1 2 1 1 39 THR HA . 39 . HA 1 1
208 1 1 1 1 39 THR H . 39 . HN 1 1
208 1 2 1 1 39 THR MG . 39 . HG2* 1 1
209 1 1 1 1 39 THR H . 39 . HN 1 1
209 1 2 1 1 40 HIS H . 40 . HN 1 1
210 1 1 1 1 39 THR MG . 39 . HG2* 1 1
210 1 2 1 1 40 HIS HE1 . 40 . HE1 1 1
211 1 1 1 1 40 HIS H . 40 . HN 1 1
211 1 2 1 1 40 HIS HA . 40 . HA 1 1
212 1 1 1 1 40 HIS H . 40 . HN 1 1
212 1 2 1 1 41 PRO HD2 . 41 . HD2 1 1
213 1 1 1 1 40 HIS H . 40 . HN 1 1
213 1 2 1 1 41 PRO HD3 . 41 . HD1 1 1
214 1 1 1 1 40 HIS HA . 40 . HA 1 1
214 1 2 1 1 40 HIS HD2 . 40 . HD2 1 1
215 1 1 1 1 40 HIS HA . 40 . HA 1 1
215 1 2 1 1 41 PRO HD2 . 41 . HD2 1 1
216 1 1 1 1 40 HIS HA . 40 . HA 1 1
216 1 2 1 1 41 PRO HD3 . 41 . HD1 1 1
217 1 1 1 1 40 HIS HB2 . 40 . HB2 1 1
217 1 2 1 1 40 HIS HD2 . 40 . HD2 1 1
218 1 1 1 1 40 HIS HB3 . 40 . HB1 1 1
218 1 2 1 1 40 HIS HD2 . 40 . HD2 1 1
219 1 1 1 1 41 PRO CD . 41 . CD 1 1
219 1 2 1 1 52 ASN HB3 . 52 . HB1 1 1
220 1 1 1 1 43 GLU H . 43 . HN 1 1
220 1 2 1 1 51 ARG CG . 51 . CG 1 1
221 1 1 1 1 43 GLU HA . 43 . HA 1 1
221 1 2 1 1 44 GLY H . 44 . HN 1 1
222 1 1 1 1 43 GLU HA . 43 . HA 1 1
222 1 2 1 1 45 LEU QB . 45 . HB* 1 1
223 1 1 1 1 43 GLU HA . 43 . HA 1 1
223 1 2 1 1 51 ARG CG . 51 . CG 1 1
224 1 1 1 1 44 GLY H . 44 . HN 1 1
224 1 2 1 1 45 LEU CG . 45 . CG 1 1
225 1 1 1 1 44 GLY H . 44 . HN 1 1
225 1 2 1 1 45 LEU H . 45 . HN 1 1
226 1 1 1 1 44 GLY HA2 . 44 . HA2 1 1
226 1 2 1 1 45 LEU H . 45 . HN 1 1
227 1 1 1 1 44 GLY HA3 . 44 . HA1 1 1
227 1 2 1 1 45 LEU H . 45 . HN 1 1
228 1 1 1 1 45 LEU CD1 . 45 . CD1 1 1
228 1 2 1 1 53 PRO HD2 . 53 . HD2 1 1
229 1 1 1 1 45 LEU CD1 . 45 . CD1 1 1
229 1 2 1 1 53 PRO HD3 . 53 . HD1 1 1
230 1 1 1 1 45 LEU CD2 . 45 . CD2 1 1
230 1 2 1 1 53 PRO HD2 . 53 . HD2 1 1
231 1 1 1 1 45 LEU CD2 . 45 . CD2 1 1
231 1 2 1 1 53 PRO HD3 . 53 . HD1 1 1
232 1 1 1 1 45 LEU CG . 45 . CG 1 1
232 1 2 1 1 51 ARG CG . 51 . CG 1 1
233 1 1 1 1 45 LEU CG . 45 . CG 1 1
233 1 2 1 1 51 ARG QB . 51 . HB* 1 1
234 1 1 1 1 45 LEU H . 45 . HN 1 1
234 1 2 1 1 45 LEU HA . 45 . HA 1 1
235 1 1 1 1 45 LEU H . 45 . HN 1 1
235 1 2 1 1 45 LEU HG . 45 . HG 1 1
236 1 1 1 1 45 LEU HA . 45 . HA 1 1
236 1 2 1 1 45 LEU MD1 . 45 . HD1* 1 1
237 1 1 1 1 45 LEU HA . 45 . HA 1 1
237 1 2 1 1 45 LEU MD2 . 45 . HD2* 1 1
238 1 1 1 1 45 LEU HA . 45 . HA 1 1
238 1 2 1 1 46 GLU H . 46 . HN 1 1
239 1 1 1 1 45 LEU QB . 45 . HB* 1 1
239 1 2 1 1 45 LEU QD . 45 . HD* 1 1
240 1 1 1 1 45 LEU HG . 45 . HG 1 1
240 1 2 1 1 61 TRP HE1 . 61 . HE1 1 1
241 1 1 1 1 45 LEU HG . 45 . HG 1 1
241 1 2 1 1 61 TRP HZ2 . 61 . HZ2 1 1
242 1 1 1 1 46 GLU H . 46 . HN 1 1
242 1 2 1 1 46 GLU HA . 46 . HA 1 1
243 1 1 1 1 46 GLU H . 46 . HN 1 1
243 1 2 1 1 46 GLU QG . 46 . HG* 1 1
244 1 1 1 1 46 GLU HA . 46 . HA 1 1
244 1 2 1 1 47 GLU H . 47 . HN 1 1
245 1 1 1 1 46 GLU QB . 46 . HB* 1 1
245 1 2 1 1 49 TYR CZ . 49 . CZ 1 1
246 1 1 1 1 46 GLU QB . 46 . HB* 1 1
246 1 2 1 1 49 TYR QD . 49 . HD* 1 1
247 1 1 1 1 46 GLU HG2 . 46 . HG2 1 1
247 1 2 1 1 48 ASN H . 48 . HN 1 1
248 1 1 1 1 46 GLU HG3 . 46 . HG1 1 1
248 1 2 1 1 48 ASN H . 48 . HN 1 1
249 1 1 1 1 47 GLU H . 47 . HN 1 1
249 1 2 1 1 47 GLU HA . 47 . HA 1 1
250 1 1 1 1 47 GLU H . 47 . HN 1 1
250 1 2 1 1 47 GLU QG . 47 . HG* 1 1
251 1 1 1 1 47 GLU HA . 47 . HA 1 1
251 1 2 1 1 48 ASN H . 48 . HN 1 1
252 1 1 1 1 47 GLU QB . 47 . HB* 1 1
252 1 2 1 1 48 ASN H . 48 . HN 1 1
253 1 1 1 1 47 GLU QB . 47 . HB* 1 1
253 1 2 1 1 49 TYR CZ . 49 . CZ 1 1
254 1 1 1 1 47 GLU QB . 47 . HB* 1 1
254 1 2 1 1 49 TYR H . 49 . HN 1 1
255 1 1 1 1 48 ASN H . 48 . HN 1 1
255 1 2 1 1 49 TYR H . 49 . HN 1 1
256 1 1 1 1 49 TYR H . 49 . HN 1 1
256 1 2 1 1 49 TYR HA . 49 . HA 1 1
257 1 1 1 1 49 TYR H . 49 . HN 1 1
257 1 2 1 1 49 TYR HB2 . 49 . HB2 1 1
258 1 1 1 1 49 TYR H . 49 . HN 1 1
258 1 2 1 1 49 TYR HB3 . 49 . HB1 1 1
259 1 1 1 1 49 TYR HA . 49 . HA 1 1
259 1 2 1 1 49 TYR QD . 49 . HD* 1 1
260 1 1 1 1 49 TYR HA . 49 . HA 1 1
260 1 2 1 1 50 CYS H . 50 . HN 1 1
261 1 1 1 1 49 TYR QB . 49 . HB* 1 1
261 1 2 1 1 50 CYS H . 50 . HN 1 1
262 1 1 1 1 49 TYR QB . 49 . HB* 1 1
262 1 2 1 1 61 TRP HE1 . 61 . HE1 1 1
263 1 1 1 1 49 TYR HB2 . 49 . HB2 1 1
263 1 2 1 1 49 TYR QD . 49 . HD* 1 1
264 1 1 1 1 49 TYR HB3 . 49 . HB1 1 1
264 1 2 1 1 49 TYR QD . 49 . HD* 1 1
265 1 1 1 1 49 TYR QD . 49 . HD* 1 1
265 1 2 1 1 50 CYS H . 50 . HN 1 1
266 1 1 1 1 50 CYS H . 50 . HN 1 1
266 1 2 1 1 50 CYS HA . 50 . HA 1 1
267 1 1 1 1 50 CYS HA . 50 . HA 1 1
267 1 2 1 1 51 ARG H . 51 . HN 1 1
268 1 1 1 1 51 ARG CD . 51 . CD 1 1
268 1 2 1 1 52 ASN ND2 . 52 . ND2 1 1
269 1 1 1 1 51 ARG CD . 51 . CD 1 1
269 1 2 1 1 76 ILE MG . 76 . HG2* 1 1
270 1 1 1 1 51 ARG H . 51 . HN 1 1
270 1 2 1 1 61 TRP H . 61 . HN 1 1
271 1 1 1 1 51 ARG HA . 51 . HA 1 1
271 1 2 1 1 52 ASN H . 52 . HN 1 1
272 1 1 1 1 51 ARG QB . 51 . HB* 1 1
272 1 2 1 1 52 ASN H . 52 . HN 1 1
273 1 1 1 1 52 ASN HA . 52 . HA 1 1
273 1 2 1 1 53 PRO HD2 . 53 . HD2 1 1
274 1 1 1 1 52 ASN HA . 52 . HA 1 1
274 1 2 1 1 53 PRO HD3 . 53 . HD1 1 1
275 1 1 1 1 52 ASN HA . 52 . HA 1 1
275 1 2 1 1 60 PRO HA . 60 . HA 1 1
276 1 1 1 1 52 ASN HA . 52 . HA 1 1
276 1 2 1 1 61 TRP HD1 . 61 . HD1 1 1
277 1 1 1 1 52 ASN HA . 52 . HA 1 1
277 1 2 1 1 61 TRP HE1 . 61 . HE1 1 1
278 1 1 1 1 52 ASN QB . 52 . HB* 1 1
278 1 2 1 1 54 ASP QB . 54 . HB* 1 1
279 1 1 1 1 52 ASN ND2 . 52 . ND2 1 1
279 1 2 1 1 55 ASN HA . 55 . HA 1 1
280 1 1 1 1 52 ASN ND2 . 52 . ND2 1 1
280 1 2 1 1 56 ASP H . 56 . HN 1 1
281 1 1 1 1 53 PRO CD . 53 . CD 1 1
281 1 2 1 1 61 TRP HE1 . 61 . HE1 1 1
282 1 1 1 1 53 PRO CD . 53 . CD 1 1
282 1 2 1 1 61 TRP HZ2 . 61 . HZ2 1 1
283 1 1 1 1 53 PRO HA . 53 . HA 1 1
283 1 2 1 1 54 ASP H . 54 . HN 1 1
284 1 1 1 1 54 ASP H . 54 . HN 1 1
284 1 2 1 1 55 ASN H . 55 . HN 1 1
285 1 1 1 1 54 ASP H . 54 . HN 1 1
285 1 2 1 1 56 ASP H . 56 . HN 1 1
286 1 1 1 1 54 ASP H . 54 . HN 1 1
286 1 2 1 1 61 TRP HE1 . 61 . HE1 1 1
287 1 1 1 1 54 ASP H . 54 . HN 1 1
287 1 2 1 1 61 TRP HZ2 . 61 . HZ2 1 1
288 1 1 1 1 54 ASP HA . 54 . HA 1 1
288 1 2 1 1 55 ASN H . 55 . HN 1 1
289 1 1 1 1 55 ASN H . 55 . HN 1 1
289 1 2 1 1 55 ASN HA . 55 . HA 1 1
290 1 1 1 1 55 ASN H . 55 . HN 1 1
290 1 2 1 1 55 ASN QB . 55 . HB* 1 1
291 1 1 1 1 55 ASN H . 55 . HN 1 1
291 1 2 1 1 56 ASP H . 56 . HN 1 1
292 1 1 1 1 55 ASN HA . 55 . HA 1 1
292 1 2 1 1 56 ASP H . 56 . HN 1 1
293 1 1 1 1 56 ASP H . 56 . HN 1 1
293 1 2 1 1 56 ASP HA . 56 . HA 1 1
294 1 1 1 1 56 ASP H . 56 . HN 1 1
294 1 2 1 1 56 ASP HB2 . 56 . HB2 1 1
295 1 1 1 1 56 ASP H . 56 . HN 1 1
295 1 2 1 1 56 ASP HB3 . 56 . HB1 1 1
296 1 1 1 1 57 PRO CD . 57 . CD 1 1
296 1 2 1 1 58 GLN H . 58 . HN 1 1
297 1 1 1 1 57 PRO HA . 57 . HA 1 1
297 1 2 1 1 58 GLN H . 58 . HN 1 1
298 1 1 1 1 57 PRO QB . 57 . HB* 1 1
298 1 2 1 1 58 GLN H . 58 . HN 1 1
299 1 1 1 1 58 GLN CG . 58 . CG 1 1
299 1 2 1 1 61 TRP H . 61 . HN 1 1
300 1 1 1 1 58 GLN H . 58 . HN 1 1
300 1 2 1 1 58 GLN HA . 58 . HA 1 1
301 1 1 1 1 58 GLN H . 58 . HN 1 1
301 1 2 1 1 58 GLN QB . 58 . HB* 1 1
302 1 1 1 1 58 GLN H . 58 . HN 1 1
302 1 2 1 1 58 GLN QG . 58 . HG* 1 1
303 1 1 1 1 58 GLN H . 58 . HN 1 1
303 1 2 1 1 59 GLY H . 59 . HN 1 1
304 1 1 1 1 58 GLN HA . 58 . HA 1 1
304 1 2 1 1 59 GLY H . 59 . HN 1 1
305 1 1 1 1 59 GLY CA . 59 . CA 1 1
305 1 2 1 1 73 TYR CG . 73 . CG 1 1
306 1 1 1 1 59 GLY QA . 59 . HA* 1 1
306 1 2 1 1 60 PRO QD . 60 . HD* 1 1
307 1 1 1 1 60 PRO CD . 60 . CD 1 1
307 1 2 1 1 76 ILE CD1 . 76 . CD1 1 1
308 1 1 1 1 60 PRO HA . 60 . HA 1 1
308 1 2 1 1 61 TRP H . 61 . HN 1 1
309 1 1 1 1 60 PRO HA . 60 . HA 1 1
309 1 2 1 1 61 TRP HD1 . 61 . HD1 1 1
310 1 1 1 1 60 PRO QB . 60 . HB* 1 1
310 1 2 1 1 76 ILE CD1 . 76 . CD1 1 1
311 1 1 1 1 61 TRP H . 61 . HN 1 1
311 1 2 1 1 61 TRP HD1 . 61 . HD1 1 1
312 1 1 1 1 61 TRP HA . 61 . HA 1 1
312 1 2 1 1 62 CYS H . 62 . HN 1 1
313 1 1 1 1 61 TRP HA . 61 . HA 1 1
313 1 2 1 1 74 CYS H . 74 . HN 1 1
314 1 1 1 1 61 TRP HB2 . 61 . HB2 1 1
314 1 2 1 1 61 TRP HE3 . 61 . HE3 1 1
315 1 1 1 1 61 TRP HD1 . 61 . HD1 1 1
315 1 2 1 1 62 CYS QB . 62 . HB* 1 1
316 1 1 1 1 61 TRP HD1 . 61 . HD1 1 1
316 1 2 1 1 73 TYR CZ . 73 . CZ 1 1
317 1 1 1 1 61 TRP HE3 . 61 . HE3 1 1
317 1 2 1 1 62 CYS H . 62 . HN 1 1
318 1 1 1 1 61 TRP HE3 . 61 . HE3 1 1
318 1 2 1 1 71 TYR HA . 71 . HA 1 1
319 1 1 1 1 61 TRP HE3 . 61 . HE3 1 1
319 1 2 1 1 72 ASP H . 72 . HN 1 1
320 1 1 1 1 62 CYS H . 62 . HN 1 1
320 1 2 1 1 72 ASP H . 72 . HN 1 1
321 1 1 1 1 62 CYS HA . 62 . HA 1 1
321 1 2 1 1 63 TYR H . 63 . HN 1 1
322 1 1 1 1 62 CYS QB . 62 . HB* 1 1
322 1 2 1 1 63 TYR H . 63 . HN 1 1
323 1 1 1 1 63 TYR H . 63 . HN 1 1
323 1 2 1 1 63 TYR HA . 63 . HA 1 1
324 1 1 1 1 63 TYR H . 63 . HN 1 1
324 1 2 1 1 63 TYR QB . 63 . HB* 1 1
325 1 1 1 1 63 TYR HA . 63 . HA 1 1
325 1 2 1 1 64 THR H . 64 . HN 1 1
326 1 1 1 1 63 TYR HA . 63 . HA 1 1
326 1 2 1 1 64 THR MG . 64 . HG2* 1 1
327 1 1 1 1 63 TYR HA . 63 . HA 1 1
327 1 2 1 1 71 TYR HB2 . 71 . HB2 1 1
328 1 1 1 1 63 TYR HA . 63 . HA 1 1
328 1 2 1 1 71 TYR HB3 . 71 . HB1 1 1
329 1 1 1 1 63 TYR QB . 63 . HB* 1 1
329 1 2 1 1 64 THR H . 64 . HN 1 1
330 1 1 1 1 64 THR H . 64 . HN 1 1
330 1 2 1 1 64 THR HG1 . 64 . HG1 1 1
331 1 1 1 1 64 THR H . 64 . HN 1 1
331 1 2 1 1 70 ARG QG . 70 . HG* 1 1
332 1 1 1 1 64 THR HA . 64 . HA 1 1
332 1 2 1 1 64 THR HB . 64 . HB 1 1
333 1 1 1 1 64 THR HA . 64 . HA 1 1
333 1 2 1 1 64 THR MG . 64 . HG2* 1 1
334 1 1 1 1 64 THR HA . 64 . HA 1 1
334 1 2 1 1 65 THR H . 65 . HN 1 1
335 1 1 1 1 64 THR HG1 . 64 . HG1 1 1
335 1 2 1 1 66 ASP H . 66 . HN 1 1
336 1 1 1 1 64 THR HG1 . 64 . HG1 1 1
336 1 2 1 1 66 ASP HB3 . 66 . HB1 1 1
337 1 1 1 1 64 THR HG1 . 64 . HG1 1 1
337 1 2 1 1 70 ARG H . 70 . HN 1 1
338 1 1 1 1 64 THR HG1 . 64 . HG1 1 1
338 1 2 1 1 70 ARG QB . 70 . HB* 1 1
339 1 1 1 1 65 THR H . 65 . HN 1 1
339 1 2 1 1 65 THR MG . 65 . HG2* 1 1
340 1 1 1 1 65 THR H . 65 . HN 1 1
340 1 2 1 1 66 ASP H . 66 . HN 1 1
341 1 1 1 1 65 THR HA . 65 . HA 1 1
341 1 2 1 1 65 THR HB . 65 . HB 1 1
342 1 1 1 1 65 THR HA . 65 . HA 1 1
342 1 2 1 1 65 THR MG . 65 . HG2* 1 1
343 1 1 1 1 66 ASP H . 66 . HN 1 1
343 1 2 1 1 66 ASP HA . 66 . HA 1 1
344 1 1 1 1 66 ASP H . 66 . HN 1 1
344 1 2 1 1 66 ASP HB2 . 66 . HB2 1 1
345 1 1 1 1 66 ASP H . 66 . HN 1 1
345 1 2 1 1 66 ASP QB . 66 . HB* 1 1
346 1 1 1 1 66 ASP H . 66 . HN 1 1
346 1 2 1 1 66 ASP HB3 . 66 . HB1 1 1
347 1 1 1 1 66 ASP H . 66 . HN 1 1
347 1 2 1 1 69 LYS H . 69 . HN 1 1
348 1 1 1 1 66 ASP HA . 66 . HA 1 1
348 1 2 1 1 67 PRO QD . 67 . HD1 1 1
349 1 1 1 1 66 ASP QB . 66 . HB* 1 1
349 1 2 1 1 67 PRO QD . 67 . HD* 1 1
350 1 1 1 1 69 LYS H . 69 . HN 1 1
350 1 2 1 1 69 LYS HA . 69 . HA 1 1
351 1 1 1 1 69 LYS H . 69 . HN 1 1
351 1 2 1 1 69 LYS HB2 . 69 . HB2 1 1
352 1 1 1 1 69 LYS H . 69 . HN 1 1
352 1 2 1 1 69 LYS HB3 . 69 . HB1 1 1
353 1 1 1 1 69 LYS H . 69 . HN 1 1
353 1 2 1 1 70 ARG H . 70 . HN 1 1
354 1 1 1 1 69 LYS H . 69 . HN 1 1
354 1 2 1 1 70 ARG QG . 70 . HG* 1 1
355 1 1 1 1 69 LYS NZ . 69 . NZ 1 1
355 1 2 1 1 71 TYR H . 71 . HN 1 1
356 1 1 1 1 70 ARG H . 70 . HN 1 1
356 1 2 1 1 70 ARG QB . 70 . HB* 1 1
357 1 1 1 1 70 ARG HA . 70 . HA 1 1
357 1 2 1 1 70 ARG HB2 . 70 . HB2 1 1
358 1 1 1 1 70 ARG HA . 70 . HA 1 1
358 1 2 1 1 70 ARG HB3 . 70 . HB1 1 1
359 1 1 1 1 70 ARG QG . 70 . HG* 1 1
359 1 2 1 1 72 ASP H . 72 . HN 1 1
360 1 1 1 1 71 TYR CG . 71 . CG 1 1
360 1 2 1 1 72 ASP HA . 72 . HA 1 1
361 1 1 1 1 71 TYR CZ . 71 . CZ 1 1
361 1 2 1 1 72 ASP H . 72 . HN 1 1
362 1 1 1 1 71 TYR CZ . 71 . CZ 1 1
362 1 2 1 1 73 TYR CZ . 73 . CZ 1 1
363 1 1 1 1 71 TYR H . 71 . HN 1 1
363 1 2 1 1 71 TYR HA . 71 . HA 1 1
364 1 1 1 1 71 TYR H . 71 . HN 1 1
364 1 2 1 1 71 TYR QD . 71 . HD* 1 1
365 1 1 1 1 71 TYR HA . 71 . HA 1 1
365 1 2 1 1 72 ASP H . 72 . HN 1 1
366 1 1 1 1 71 TYR HB2 . 71 . HB2 1 1
366 1 2 1 1 72 ASP H . 72 . HN 1 1
367 1 1 1 1 71 TYR HB3 . 71 . HB1 1 1
367 1 2 1 1 72 ASP H . 72 . HN 1 1
368 1 1 1 1 72 ASP H . 72 . HN 1 1
368 1 2 1 1 72 ASP HA . 72 . HA 1 1
369 1 1 1 1 72 ASP H . 72 . HN 1 1
369 1 2 1 1 72 ASP QB . 72 . HB* 1 1
370 1 1 1 1 72 ASP HA . 72 . HA 1 1
370 1 2 1 1 73 TYR H . 73 . HN 1 1
371 1 1 1 1 73 TYR CG . 73 . CG 1 1
371 1 2 1 1 74 CYS H . 74 . HN 1 1
372 1 1 1 1 73 TYR CG . 73 . CG 1 1
372 1 2 1 1 75 ASP HA . 75 . HA 1 1
373 1 1 1 1 73 TYR H . 73 . HN 1 1
373 1 2 1 1 73 TYR QB . 73 . HB* 1 1
374 1 1 1 1 73 TYR H . 73 . HN 1 1
374 1 2 1 1 73 TYR QD . 73 . HD* 1 1
375 1 1 1 1 73 TYR HA . 73 . HA 1 1
375 1 2 1 1 74 CYS H . 74 . HN 1 1
376 1 1 1 1 73 TYR QB . 73 . HB* 1 1
376 1 2 1 1 74 CYS H . 74 . HN 1 1
377 1 1 1 1 73 TYR QB . 73 . HB* 1 1
377 1 2 1 1 76 ILE CD1 . 76 . CD1 1 1
378 1 1 1 1 74 CYS HA . 74 . HA 1 1
378 1 2 1 1 75 ASP H . 75 . HN 1 1
379 1 1 1 1 74 CYS HA . 74 . HA 1 1
379 1 2 1 1 75 ASP QB . 75 . HB* 1 1
380 1 1 1 1 74 CYS QB . 74 . HB* 1 1
380 1 2 1 1 76 ILE CD1 . 76 . CD1 1 1
381 1 1 1 1 75 ASP H . 75 . HN 1 1
381 1 2 1 1 75 ASP HA . 75 . HA 1 1
382 1 1 1 1 75 ASP H . 75 . HN 1 1
382 1 2 1 1 75 ASP HB2 . 75 . HB2 1 1
383 1 1 1 1 75 ASP H . 75 . HN 1 1
383 1 2 1 1 75 ASP HB3 . 75 . HB1 1 1
384 1 1 1 1 75 ASP H . 75 . HN 1 1
384 1 2 1 1 76 ILE CD1 . 76 . CD1 1 1
385 1 1 1 1 75 ASP HA . 75 . HA 1 1
385 1 2 1 1 76 ILE H . 76 . HN 1 1
386 1 1 1 1 75 ASP QB . 75 . HB* 1 1
386 1 2 1 1 76 ILE CD1 . 76 . CD1 1 1
387 1 1 1 1 76 ILE CD1 . 76 . CD1 1 1
387 1 2 1 1 79 CYS QB . 79 . HB* 1 1
388 1 1 1 1 76 ILE H . 76 . HN 1 1
388 1 2 1 1 76 ILE HA . 76 . HA 1 1
389 1 1 1 1 76 ILE H . 76 . HN 1 1
389 1 2 1 1 76 ILE HB . 76 . HB 1 1
390 1 1 1 1 76 ILE H . 76 . HN 1 1
390 1 2 1 1 76 ILE MG . 76 . HG2* 1 1
391 1 1 1 1 76 ILE H . 76 . HN 1 1
391 1 2 1 1 77 LEU CD2 . 77 . CD2 1 1
392 1 1 1 1 76 ILE HA . 76 . HA 1 1
392 1 2 1 1 76 ILE MD . 76 . HD1* 1 1
393 1 1 1 1 76 ILE HA . 76 . HA 1 1
393 1 2 1 1 76 ILE HG12 . 76 . HG12 1 1
394 1 1 1 1 76 ILE HA . 76 . HA 1 1
394 1 2 1 1 76 ILE HG13 . 76 . HG11 1 1
395 1 1 1 1 76 ILE HA . 76 . HA 1 1
395 1 2 1 1 76 ILE MG . 76 . HG2* 1 1
396 1 1 1 1 76 ILE HA . 76 . HA 1 1
396 1 2 1 1 77 LEU H . 77 . HN 1 1
397 1 1 1 1 76 ILE MG . 76 . HG2* 1 1
397 1 2 1 1 77 LEU H . 77 . HN 1 1
398 1 1 1 1 77 LEU H . 77 . HN 1 1
398 1 2 1 1 77 LEU MD1 . 77 . HD1* 1 1
399 1 1 1 1 77 LEU H . 77 . HN 1 1
399 1 2 1 1 77 LEU MD2 . 77 . HD2* 1 1
400 1 1 1 1 77 LEU HA . 77 . HA 1 1
400 1 2 1 1 78 GLU H . 78 . HN 1 1
401 1 1 1 1 77 LEU QB . 77 . HB* 1 1
401 1 2 1 1 78 GLU H . 78 . HN 1 1
402 1 1 1 1 77 LEU QD . 77 . HD* 1 1
402 1 2 1 1 78 GLU H . 78 . HN 1 1
403 1 1 1 1 78 GLU H . 78 . HN 1 1
403 1 2 1 1 78 GLU HA . 78 . HA 1 1
404 1 1 1 1 78 GLU H . 78 . HN 1 1
404 1 2 1 1 78 GLU QB . 78 . HB* 1 1
405 1 1 1 1 78 GLU HA . 78 . HA 1 1
405 1 2 1 1 79 CYS H . 79 . HN 1 1
406 1 1 1 1 78 GLU HB2 . 78 . HB2 1 1
406 1 2 1 1 79 CYS H . 79 . HN 1 1
407 1 1 1 1 78 GLU HB3 . 78 . HB1 1 1
407 1 2 1 1 79 CYS H . 79 . HN 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 . . . . . 2.4 1.8 3.0 1 1
2 1 . . . . . 2.1 1.8 5.2 1 1
3 1 . . . . . 2.4 1.8 3.6 1 1
4 1 . . . . . 4.0 1.8 7.0 1 1
5 1 . . . . . 4.0 1.8 8.0 1 1
6 1 . . . . . 4.0 1.8 6.0 1 1
7 1 . . . . . 2.4 1.8 4.1 1 1
8 1 . . . . . 3.0 1.8 4.8 1 1
9 1 . . . . . 2.4 1.8 2.9 1 1
10 1 . . . . . 4.0 1.8 5.0 1 1
11 1 . . . . . 2.4 1.8 5.7 1 1
12 1 . . . . . 2.0 1.8 4.4 1 1
13 1 . . . . . 4.0 1.8 7.0 1 1
14 1 . . . . . 3.0 1.8 4.0 1 1
15 1 . . . . . 3.0 1.8 4.0 1 1
16 1 . . . . . 2.0 1.8 3.6 1 1
17 1 . . . . . 4.0 1.8 4.6 1 1
18 1 . . . . . 2.0 1.8 2.7 1 1
19 1 . . . . . 2.0 1.8 2.7 1 1
20 1 . . . . . 2.0 1.8 2.7 1 1
21 1 . . . . . 2.0 1.8 3.3 1 1
22 1 . . . . . 2.0 1.8 3.3 1 1
23 1 . . . . . 3.0 1.8 3.3 1 1
24 1 . . . . . 3.0 1.8 3.3 1 1
25 1 . . . . . 3.0 1.8 3.3 1 1
26 1 . . . . . 4.0 1.8 7.5 1 1
27 1 . . . . . 4.0 1.8 7.0 1 1
28 1 . . . . . 4.0 1.8 8.0 1 1
29 1 . . . . . 2.4 1.8 2.7 1 1
30 1 . . . . . 4.0 1.8 5.2 1 1
31 1 . . . . . 4.0 1.8 8.0 1 1
32 1 . . . . . 4.0 3.0 7.0 1 1
33 1 . . . . . 4.0 1.8 8.0 1 1
34 1 . . . . . 3.0 1.8 3.1 1 1
35 1 . . . . . 2.4 1.8 4.4 1 1
36 1 . . . . . 3.0 1.8 3.3 1 1
37 1 . . . . . 4.0 1.8 9.0 1 1
38 1 . . . . . 4.0 1.8 8.0 1 1
39 1 . . . . . 4.0 3.0 8.0 1 1
40 1 . . . . . 4.0 1.8 8.0 1 1
41 1 . . . . . 4.0 1.8 5.3 1 1
42 1 . . . . . 4.0 1.8 4.2 1 1
43 1 . . . . . 3.0 1.8 3.5 1 1
44 1 . . . . . 4.0 1.8 6.0 1 1
45 1 . . . . . 4.0 1.8 6.0 1 1
46 1 . . . . . 3.0 1.8 5.3 1 1
47 1 . . . . . 4.0 1.8 8.0 1 1
48 1 . . . . . 4.0 1.8 8.0 1 1
49 1 . . . . . 3.0 1.8 3.3 1 1
50 1 . . . . . 3.0 1.8 4.3 1 1
51 1 . . . . . 4.0 1.8 8.0 1 1
52 1 . . . . . 3.0 1.8 3.3 1 1
53 1 . . . . . 3.0 1.8 3.3 1 1
54 1 . . . . . 4.0 1.8 10.0 1 1
55 1 . . . . . 3.0 1.8 3.1 1 1
56 1 . . . . . 3.0 1.8 3.1 1 1
57 1 . . . . . 2.4 1.8 3.4 1 1
58 1 . . . . . 3.0 1.8 3.9 1 1
59 1 . . . . . 4.0 1.8 6.0 1 1
60 1 . . . . . 4.0 1.8 6.0 1 1
61 1 . . . . . 4.0 1.8 8.0 1 1
62 1 . . . . . 4.0 1.8 8.0 1 1
63 1 . . . . . 3.0 1.8 3.1 1 1
64 1 . . . . . 4.0 1.8 5.0 1 1
65 1 . . . . . 4.0 1.8 7.0 1 1
66 1 . . . . . 2.4 1.8 2.8 1 1
67 1 . . . . . 4.0 1.8 7.5 1 1
68 1 . . . . . 2.4 1.8 2.9 1 1
69 1 . . . . . 3.0 1.8 5.4 1 1
70 1 . . . . . 2.4 1.8 2.8 1 1
71 1 . . . . . 3.0 1.8 3.1 1 1
72 1 . . . . . 2.4 1.8 4.2 1 1
73 1 . . . . . 4.0 1.8 5.0 1 1
74 1 . . . . . 4.0 1.8 7.0 1 1
75 1 . . . . . 3.0 1.8 3.3 1 1
76 1 . . . . . 3.0 1.8 4.0 1 1
77 1 . . . . . 4.0 1.8 4.0 1 1
78 1 . . . . . 4.0 1.8 8.0 1 1
79 1 . . . . . 2.4 1.8 3.7 1 1
80 1 . . . . . 4.0 1.8 6.0 1 1
81 1 . . . . . 4.0 1.8 6.0 1 1
82 1 . . . . . 2.0 1.8 2.7 1 1
83 1 . . . . . 4.0 1.8 5.0 1 1
84 1 . . . . . 4.0 1.8 7.0 1 1
85 1 . . . . . 2.4 1.8 5.7 1 1
86 1 . . . . . 2.4 1.8 3.7 1 1
87 1 . . . . . 3.0 1.8 3.8 1 1
88 1 . . . . . 3.0 1.8 3.5 1 1
89 1 . . . . . 3.0 1.8 3.9 1 1
90 1 . . . . . 3.0 0.8 3.9 1 1
91 1 . . . . . 2.0 1.8 2.6 1 1
92 1 . . . . . 2.0 1.8 2.6 1 1
93 1 . . . . . 3.0 1.8 3.8 1 1
94 1 . . . . . 3.0 1.8 4.1 1 1
95 1 . . . . . 4.0 1.8 8.8 1 1
96 1 . . . . . 2.4 1.8 4.2 1 1
97 1 . . . . . 4.0 1.8 8.0 1 1
98 1 . . . . . 4.0 1.8 8.0 1 1
99 1 . . . . . 2.4 1.8 2.9 1 1
100 1 . . . . . 2.0 1.8 2.8 1 1
101 1 . . . . . 4.0 1.8 8.0 1 1
102 1 . . . . . 2.0 1.8 2.8 1 1
103 1 . . . . . 3.0 1.8 5.3 1 1
104 1 . . . . . 4.0 1.8 8.0 1 1
105 1 . . . . . 1.9 1.8 2.5 1 1
106 1 . . . . . 2.4 1.8 3.1 1 1
107 1 . . . . . 2.4 1.8 4.2 1 1
108 1 . . . . . 4.0 1.8 8.0 1 1
109 1 . . . . . 3.0 1.8 3.3 1 1
110 1 . . . . . 4.0 1.8 6.0 1 1
111 1 . . . . . 3.0 1.8 4.0 1 1
112 1 . . . . . 3.0 1.8 4.7 1 1
113 1 . . . . . 3.0 1.8 3.3 1 1
114 1 . . . . . 2.4 1.8 3.7 1 1
115 1 . . . . . 3.0 1.8 3.9 1 1
116 1 . . . . . 3.0 1.8 3.4 1 1
117 1 . . . . . 3.0 1.8 3.6 1 1
118 1 . . . . . 3.0 1.8 4.0 1 1
119 1 . . . . . 4.0 1.8 7.0 1 1
120 1 . . . . . 3.0 1.8 4.0 1 1
121 1 . . . . . 3.0 1.8 4.0 1 1
122 1 . . . . . 4.0 1.8 8.0 1 1
123 1 . . . . . 4.0 1.8 7.0 1 1
124 1 . . . . . 4.0 1.8 7.0 1 1
125 1 . . . . . 4.0 1.8 8.0 1 1
126 1 . . . . . 4.0 1.8 6.0 1 1
127 1 . . . . . 3.0 1.8 3.7 1 1
128 1 . . . . . 3.0 1.8 3.8 1 1
129 1 . . . . . 3.0 1.8 3.8 1 1
130 1 . . . . . 3.0 1.8 3.8 1 1
131 1 . . . . . 4.0 1.8 5.0 1 1
132 1 . . . . . 2.4 1.8 3.9 1 1
133 1 . . . . . 4.0 1.8 6.0 1 1
134 1 . . . . . 3.0 1.8 3.4 1 1
135 1 . . . . . 3.0 1.8 3.4 1 1
136 1 . . . . . 4.0 1.8 7.5 1 1
137 1 . . . . . 4.0 1.8 7.5 1 1
138 1 . . . . . 4.0 1.8 5.0 1 1
139 1 . . . . . 4.0 1.8 7.0 1 1
140 1 . . . . . 4.0 1.8 8.9 1 1
141 1 . . . . . 4.0 1.8 6.5 1 1
142 1 . . . . . 4.0 1.8 6.5 1 1
143 1 . . . . . 4.0 1.8 8.9 1 1
144 1 . . . . . 4.0 1.8 7.0 1 1
145 1 . . . . . 4.0 1.8 5.0 1 1
146 1 . . . . . 4.0 1.8 7.0 1 1
147 1 . . . . . 3.0 1.8 3.8 1 1
148 1 . . . . . 3.0 1.8 3.8 1 1
149 1 . . . . . 2.4 1.8 3.3 1 1
150 1 . . . . . 4.0 1.8 6.0 1 1
151 1 . . . . . 3.0 1.8 3.6 1 1
152 1 . . . . . 4.0 1.8 6.5 1 1
153 1 . . . . . 3.0 1.8 6.5 1 1
154 1 . . . . . 3.0 1.8 4.8 1 1
155 1 . . . . . 4.0 1.8 6.5 1 1
156 1 . . . . . 4.0 1.8 7.0 1 1
157 1 . . . . . 3.0 2.5 3.3 1 1
158 1 . . . . . 2.0 1.8 3.0 1 1
159 1 . . . . . 4.0 1.8 7.0 1 1
160 1 . . . . . 4.0 1.8 7.0 1 1
161 1 . . . . . 3.0 1.8 3.3 1 1
162 1 . . . . . 4.0 1.8 7.0 1 1
163 1 . . . . . 2.3 1.7 3.3 1 1
164 1 . . . . . 4.0 1.8 7.0 1 1
165 1 . . . . . 4.0 1.8 8.0 1 1
166 1 . . . . . 4.0 1.8 6.0 1 1
167 1 . . . . . 4.0 1.8 7.0 1 1
168 1 . . . . . 4.0 1.8 6.0 1 1
169 1 . . . . . 4.0 1.8 7.5 1 1
170 1 . . . . . 4.0 1.8 5.3 1 1
171 1 . . . . . 4.0 1.8 7.0 1 1
172 1 . . . . . 4.0 1.8 8.0 1 1
173 1 . . . . . 3.0 1.8 3.3 1 1
174 1 . . . . . 2.4 1.8 2.7 1 1
175 1 . . . . . 2.4 1.8 3.4 1 1
176 1 . . . . . 2.0 1.8 2.5 1 1
177 1 . . . . . 2.0 1.8 2.5 1 1
178 1 . . . . . 2.4 1.8 2.9 1 1
179 1 . . . . . 4.0 1.8 5.0 1 1
180 1 . . . . . 4.0 1.8 9.0 1 1
181 1 . . . . . 2.4 1.8 2.7 1 1
182 1 . . . . . 4.0 1.8 8.0 1 1
183 1 . . . . . 4.0 1.8 9.0 1 1
184 1 . . . . . 3.0 1.8 4.0 1 1
185 1 . . . . . 4.0 1.8 6.5 1 1
186 1 . . . . . 3.0 1.8 4.0 1 1
187 1 . . . . . 3.0 1.8 4.0 1 1
188 1 . . . . . 4.0 1.8 8.0 1 1
189 1 . . . . . 4.0 1.8 8.0 1 1
190 1 . . . . . 2.4 1.8 5.0 1 1
191 1 . . . . . 4.0 1.8 8.0 1 1
192 1 . . . . . 4.0 1.8 8.0 1 1
193 1 . . . . . 4.0 1.8 6.0 1 1
194 1 . . . . . 4.0 1.8 8.0 1 1
195 1 . . . . . 3.0 1.8 3.8 1 1
196 1 . . . . . 4.0 1.8 7.0 1 1
197 1 . . . . . 3.0 1.8 3.7 1 1
198 1 . . . . . 3.0 1.8 3.7 1 1
199 1 . . . . . 3.0 1.8 5.5 1 1
200 1 . . . . . 3.0 1.8 5.5 1 1
201 1 . . . . . 4.0 1.8 4.4 1 1
202 1 . . . . . 4.0 1.8 8.5 1 1
203 1 . . . . . 3.0 1.8 3.6 1 1
204 1 . . . . . 2.5 1.8 3.0 1 1
205 1 . . . . . 2.0 1.8 2.9 1 1
206 1 . . . . . 3.0 1.8 3.7 1 1
207 1 . . . . . 2.4 1.8 2.7 1 1
208 1 . . . . . 3.0 1.8 3.7 1 1
209 1 . . . . . 2.4 1.8 2.7 1 1
210 1 . . . . . 4.0 1.8 5.5 1 1
211 1 . . . . . 3.0 1.8 3.3 1 1
212 1 . . . . . 4.0 1.8 5.0 1 1
213 1 . . . . . 4.0 1.8 5.0 1 1
214 1 . . . . . 3.0 1.8 4.0 1 1
215 1 . . . . . 2.4 1.8 2.8 1 1
216 1 . . . . . 2.4 1.8 2.8 1 1
217 1 . . . . . 3.0 1.8 3.5 1 1
218 1 . . . . . 3.0 1.8 3.5 1 1
219 1 . . . . . 4.0 1.8 6.0 1 1
220 1 . . . . . 4.0 1.8 6.0 1 1
221 1 . . . . . 2.4 1.8 2.7 1 1
222 1 . . . . . 4.0 1.8 7.0 1 1
223 1 . . . . . 4.0 1.8 6.0 1 1
224 1 . . . . . 4.0 1.8 7.1 1 1
225 1 . . . . . 3.0 1.8 3.3 1 1
226 1 . . . . . 3.0 1.8 4.0 1 1
227 1 . . . . . 3.0 1.8 4.0 1 1
228 1 . . . . . 4.0 1.8 5.8 1 1
229 1 . . . . . 4.0 1.8 5.8 1 1
230 1 . . . . . 4.0 1.8 5.8 1 1
231 1 . . . . . 4.0 1.8 5.8 1 1
232 1 . . . . . 4.0 1.8 7.3 1 1
233 1 . . . . . 4.0 1.8 9.0 1 1
234 1 . . . . . 2.4 1.8 2.7 1 1
235 1 . . . . . 2.4 1.8 2.9 1 1
236 1 . . . . . 3.0 1.8 3.6 1 1
237 1 . . . . . 3.0 1.8 3.6 1 1
238 1 . . . . . 2.4 1.8 3.0 1 1
239 1 . . . . . 2.0 1.8 2.7 1 1
240 1 . . . . . 4.0 1.8 6.0 1 1
241 1 . . . . . 2.4 1.8 3.0 1 1
242 1 . . . . . 2.0 1.8 2.7 1 1
243 1 . . . . . 4.0 1.8 6.0 1 1
244 1 . . . . . 2.4 1.8 2.8 1 1
245 1 . . . . . 4.0 1.8 6.0 1 1
246 1 . . . . . 3.0 1.8 4.5 1 1
247 1 . . . . . 3.0 1.8 3.3 1 1
248 1 . . . . . 3.0 1.8 3.3 1 1
249 1 . . . . . 2.4 1.8 2.7 1 1
250 1 . . . . . 2.4 1.8 3.7 1 1
251 1 . . . . . 3.0 1.8 3.3 1 1
252 1 . . . . . 2.4 1.8 3.9 1 1
253 1 . . . . . 4.0 1.8 7.4 1 1
254 1 . . . . . 4.0 1.8 7.0 1 1
255 1 . . . . . 3.0 1.8 3.3 1 1
256 1 . . . . . 2.0 1.8 2.7 1 1
257 1 . . . . . 2.4 1.8 3.0 1 1
258 1 . . . . . 2.4 1.8 3.0 1 1
259 1 . . . . . 2.4 1.8 4.8 1 1
260 1 . . . . . 2.4 1.8 2.9 1 1
261 1 . . . . . 4.0 1.8 5.5 1 1
262 1 . . . . . 4.0 1.8 7.0 1 1
263 1 . . . . . 3.0 1.8 3.2 1 1
264 1 . . . . . 3.0 1.8 3.2 1 1
265 1 . . . . . 4.0 1.8 7.5 1 1
266 1 . . . . . 2.0 1.8 3.0 1 1
267 1 . . . . . 2.4 1.8 2.7 1 1
268 1 . . . . . 4.0 1.8 9.0 1 1
269 1 . . . . . 4.0 1.8 8.5 1 1
270 1 . . . . . 4.0 1.8 4.0 1 1
271 1 . . . . . 3.0 1.8 3.6 1 1
272 1 . . . . . 2.4 1.8 2.7 1 1
273 1 . . . . . 2.4 1.8 2.8 1 1
274 1 . . . . . 2.4 1.8 2.8 1 1
275 1 . . . . . 3.0 1.8 3.3 1 1
276 1 . . . . . 2.4 1.8 2.7 1 1
277 1 . . . . . 4.0 1.8 6.0 1 1
278 1 . . . . . 4.0 1.8 8.0 1 1
279 1 . . . . . 4.0 1.8 6.0 1 1
280 1 . . . . . 4.0 1.8 5.0 1 1
281 1 . . . . . 3.0 1.8 5.0 1 1
282 1 . . . . . 3.0 1.8 4.3 1 1
283 1 . . . . . 3.0 1.8 3.3 1 1
284 1 . . . . . 2.4 1.8 3.6 1 1
285 1 . . . . . 4.0 1.8 6.0 1 1
286 1 . . . . . 4.0 1.8 6.0 1 1
287 1 . . . . . 4.0 1.8 5.0 1 1
288 1 . . . . . 3.0 1.8 4.0 1 1
289 1 . . . . . 2.4 1.8 2.7 1 1
290 1 . . . . . 3.0 1.8 4.3 1 1
291 1 . . . . . 3.0 1.8 3.9 1 1
292 1 . . . . . 3.0 1.8 3.1 1 1
293 1 . . . . . 3.0 1.8 3.1 1 1
294 1 . . . . . 3.0 2.8 4.0 1 1
295 1 . . . . . 3.0 2.8 4.0 1 1
296 1 . . . . . 2.4 1.8 4.7 1 1
297 1 . . . . . 3.0 1.8 4.0 1 1
298 1 . . . . . 4.0 1.8 4.6 1 1
299 1 . . . . . 4.0 1.8 7.0 1 1
300 1 . . . . . 2.4 1.8 2.7 1 1
301 1 . . . . . 3.0 1.8 4.4 1 1
302 1 . . . . . 3.0 1.8 3.8 1 1
303 1 . . . . . 2.4 1.8 2.7 1 1
304 1 . . . . . 3.0 1.8 4.0 1 1
305 1 . . . . . 3.0 1.8 3.7 1 1
306 1 . . . . . 3.0 1.8 3.7 1 1
307 1 . . . . . 4.0 1.8 6.6 1 1
308 1 . . . . . 2.4 1.8 2.4 1 1
309 1 . . . . . 3.0 1.8 4.1 1 1
310 1 . . . . . 4.0 1.8 6.4 1 1
311 1 . . . . . 3.0 1.8 3.3 1 1
312 1 . . . . . 2.4 1.8 3.4 1 1
313 1 . . . . . 3.0 1.8 4.2 1 1
314 1 . . . . . 3.0 1.8 3.9 1 1
315 1 . . . . . 4.0 1.8 6.0 1 1
316 1 . . . . . 4.0 1.8 6.8 1 1
317 1 . . . . . 3.0 1.8 3.4 1 1
318 1 . . . . . 4.0 1.8 6.0 1 1
319 1 . . . . . 4.0 1.8 6.0 1 1
320 1 . . . . . 3.0 1.8 3.7 1 1
321 1 . . . . . 2.4 1.8 2.7 1 1
322 1 . . . . . 4.0 1.8 4.1 1 1
323 1 . . . . . 3.0 1.8 4.0 1 1
324 1 . . . . . 3.0 1.8 3.8 1 1
325 1 . . . . . 2.4 1.8 2.7 1 1
326 1 . . . . . 4.0 1.8 5.2 1 1
327 1 . . . . . 2.4 1.8 3.0 1 1
328 1 . . . . . 2.4 1.8 2.8 1 1
329 1 . . . . . 3.0 1.8 4.8 1 1
330 1 . . . . . 3.0 1.8 4.0 1 1
331 1 . . . . . 4.0 1.8 6.0 1 1
332 1 . . . . . 2.4 1.8 2.7 1 1
333 1 . . . . . 3.0 1.8 5.2 1 1
334 1 . . . . . 2.4 1.8 3.4 1 1
335 1 . . . . . 2.4 1.8 2.6 1 1
336 1 . . . . . 4.0 1.8 4.2 1 1
337 1 . . . . . 4.0 1.8 4.3 1 1
338 1 . . . . . 4.0 1.8 5.0 1 1
339 1 . . . . . 2.4 1.8 4.2 1 1
340 1 . . . . . 4.0 1.8 5.0 1 1
341 1 . . . . . 3.0 1.8 4.0 1 1
342 1 . . . . . 3.0 1.8 3.3 1 1
343 1 . . . . . 3.0 1.8 3.2 1 1
344 1 . . . . . 3.0 1.8 3.7 1 1
345 1 . . . . . 2.4 1.8 2.7 1 1
346 1 . . . . . 3.0 1.8 3.7 1 1
347 1 . . . . . 4.0 1.8 7.0 1 1
348 1 . . . . . 2.4 1.8 2.5 1 1
349 1 . . . . . 3.0 1.8 5.3 1 1
350 1 . . . . . 3.0 1.8 3.3 1 1
351 1 . . . . . 3.0 1.8 3.7 1 1
352 1 . . . . . 3.0 1.8 3.7 1 1
353 1 . . . . . 2.4 1.8 2.9 1 1
354 1 . . . . . 4.0 1.8 6.0 1 1
355 1 . . . . . 4.0 1.8 6.3 1 1
356 1 . . . . . 2.4 1.8 3.4 1 1
357 1 . . . . . 3.0 1.8 3.4 1 1
358 1 . . . . . 3.0 1.8 3.4 1 1
359 1 . . . . . 3.0 1.8 5.3 1 1
360 1 . . . . . 4.0 1.8 8.0 1 1
361 1 . . . . . 4.0 1.8 8.0 1 1
362 1 . . . . . 3.0 1.8 7.3 1 1
363 1 . . . . . 2.0 1.8 2.7 1 1
364 1 . . . . . 4.0 1.8 7.0 1 1
365 1 . . . . . 2.4 1.8 2.8 1 1
366 1 . . . . . 3.0 0.8 3.7 1 1
367 1 . . . . . 3.0 1.8 3.7 1 1
368 1 . . . . . 3.0 1.8 3.3 1 1
369 1 . . . . . 3.0 1.8 3.7 1 1
370 1 . . . . . 2.4 1.8 2.9 1 1
371 1 . . . . . 4.0 1.8 8.0 1 1
372 1 . . . . . 4.0 1.8 8.0 1 1
373 1 . . . . . 3.0 1.8 3.4 1 1
374 1 . . . . . 3.0 1.8 4.7 1 1
375 1 . . . . . 3.0 0.8 3.6 1 1
376 1 . . . . . 4.0 1.8 4.8 1 1
377 1 . . . . . 4.0 1.8 8.5 1 1
378 1 . . . . . 3.0 1.8 3.3 1 1
379 1 . . . . . 4.0 1.8 7.0 1 1
380 1 . . . . . 4.0 1.8 8.5 1 1
381 1 . . . . . 2.0 1.8 2.8 1 1
382 1 . . . . . 3.0 1.8 3.1 1 1
383 1 . . . . . 3.0 1.8 3.1 1 1
384 1 . . . . . 4.0 1.8 6.5 1 1
385 1 . . . . . 2.4 1.8 2.9 1 1
386 1 . . . . . 4.0 1.8 9.0 1 1
387 1 . . . . . 4.0 1.8 9.0 1 1
388 1 . . . . . 3.0 1.8 3.3 1 1
389 1 . . . . . 3.0 1.8 3.3 1 1
390 1 . . . . . 4.0 1.8 4.2 1 1
391 1 . . . . . 4.0 1.8 7.0 1 1
392 1 . . . . . 4.0 1.8 4.3 1 1
393 1 . . . . . 3.0 1.8 3.3 1 1
394 1 . . . . . 3.0 1.8 3.3 1 1
395 1 . . . . . 2.4 1.8 3.3 1 1
396 1 . . . . . 2.0 1.8 2.4 1 1
397 1 . . . . . 3.0 1.8 5.3 1 1
398 1 . . . . . 4.0 1.8 7.0 1 1
399 1 . . . . . 4.0 1.8 7.0 1 1
400 1 . . . . . 2.4 1.8 2.7 1 1
401 1 . . . . . 4.0 1.8 7.0 1 1
402 1 . . . . . 4.0 1.8 7.0 1 1
403 1 . . . . . 3.0 1.8 4.3 1 1
404 1 . . . . . 2.4 1.8 3.8 1 1
405 1 . . . . . 2.4 1.8 3.3 1 1
406 1 . . . . . 3.0 1.8 3.8 1 1
407 1 . . . . . 3.0 1.8 3.8 1 1
stop_
save_
save_CNS/XPLOR_dihedral_3
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID 1
_Torsion_angle_constraint_list.ID 1
_Torsion_angle_constraint_list.Constraint_file_ID .
_Torsion_angle_constraint_list.Block_ID .
loop_
_Torsion_angle_constraint.ID
_Torsion_angle_constraint.Torsion_angle_name
_Torsion_angle_constraint.Entity_assembly_ID_1
_Torsion_angle_constraint.Entity_ID_1
_Torsion_angle_constraint.Comp_index_ID_1
_Torsion_angle_constraint.Comp_ID_1
_Torsion_angle_constraint.Atom_ID_1
_Torsion_angle_constraint.Entity_assembly_ID_2
_Torsion_angle_constraint.Entity_ID_2
_Torsion_angle_constraint.Comp_index_ID_2
_Torsion_angle_constraint.Comp_ID_2
_Torsion_angle_constraint.Atom_ID_2
_Torsion_angle_constraint.Entity_assembly_ID_3
_Torsion_angle_constraint.Entity_ID_3
_Torsion_angle_constraint.Comp_index_ID_3
_Torsion_angle_constraint.Comp_ID_3
_Torsion_angle_constraint.Atom_ID_3
_Torsion_angle_constraint.Entity_assembly_ID_4
_Torsion_angle_constraint.Entity_ID_4
_Torsion_angle_constraint.Comp_index_ID_4
_Torsion_angle_constraint.Comp_ID_4
_Torsion_angle_constraint.Atom_ID_4
_Torsion_angle_constraint.Angle_lower_bound_val
_Torsion_angle_constraint.Angle_upper_bound_val
_Torsion_angle_constraint.Auth_asym_ID_1
_Torsion_angle_constraint.Auth_seq_ID_1
_Torsion_angle_constraint.Auth_comp_ID_1
_Torsion_angle_constraint.Auth_atom_ID_1
_Torsion_angle_constraint.Auth_asym_ID_2
_Torsion_angle_constraint.Auth_seq_ID_2
_Torsion_angle_constraint.Auth_comp_ID_2
_Torsion_angle_constraint.Auth_atom_ID_2
_Torsion_angle_constraint.Auth_asym_ID_3
_Torsion_angle_constraint.Auth_seq_ID_3
_Torsion_angle_constraint.Auth_comp_ID_3
_Torsion_angle_constraint.Auth_atom_ID_3
_Torsion_angle_constraint.Auth_asym_ID_4
_Torsion_angle_constraint.Auth_seq_ID_4
_Torsion_angle_constraint.Auth_comp_ID_4
_Torsion_angle_constraint.Auth_atom_ID_4
_Torsion_angle_constraint.Entry_ID
_Torsion_angle_constraint.Torsion_angle_constraint_list_ID
1 . 1 1 32 ARG CA 1 1 32 ARG C 1 1 33 PRO N 1 1 33 PRO CA 174.99998 185.0 . 32 . CA . 32 . C . 33 . N . 33 . CA 1 1
2 . 1 1 36 SER CA 1 1 36 SER C 1 1 37 PRO N 1 1 37 PRO CA 174.99998 185.0 . 36 . CA . 36 . C . 37 . N . 37 . CA 1 1
3 . 1 1 40 HIS CA 1 1 40 HIS C 1 1 41 PRO N 1 1 41 PRO CA 174.99998 185.0 . 40 . CA . 40 . C . 41 . N . 41 . CA 1 1
4 . 1 1 52 ASN CA 1 1 52 ASN C 1 1 53 PRO N 1 1 53 PRO CA 174.99998 185.0 . 52 . CA . 52 . C . 53 . N . 53 . CA 1 1
5 . 1 1 56 ASP CA 1 1 56 ASP C 1 1 57 PRO N 1 1 57 PRO CA 174.99998 185.0 . 56 . CA . 56 . C . 57 . N . 57 . CA 1 1
6 . 1 1 59 GLY CA 1 1 59 GLY C 1 1 60 PRO N 1 1 60 PRO CA 174.99998 185.0 . 59 . CA . 59 . C . 60 . N . 60 . CA 1 1
7 . 1 1 66 ASP CA 1 1 66 ASP C 1 1 67 PRO N 1 1 67 PRO CA 174.99998 185.0 . 66 . CA . 66 . C . 67 . N . 67 . CA 1 1
8 . 1 1 29 SER CA 1 1 29 SER C 1 1 30 PRO N 1 1 30 PRO CA -5.0 5.0 . 29 . CA . 29 . C . 30 . N . 30 . CA 1 1
9 . 1 1 1 CYS C 1 1 2 LYS N 1 1 2 LYS CA 1 1 2 LYS C -179.99998 -80.0 . 1 . C . 2 . N . 2 . CA . 2 . C 1 1
10 . 1 1 2 LYS C 1 1 3 THR N 1 1 3 THR CA 1 1 3 THR C -179.99998 -80.0 . 2 . C . 3 . N . 3 . CA . 3 . C 1 1
11 . 1 1 4 GLY C 1 1 5 ASN N 1 1 5 ASN CA 1 1 5 ASN C -179.99998 -80.0 . 4 . C . 5 . N . 5 . CA . 5 . C 1 1
12 . 1 1 7 LYS C 1 1 8 ASN N 1 1 8 ASN CA 1 1 8 ASN C -179.99998 -80.0 . 7 . C . 8 . N . 8 . CA . 8 . C 1 1
13 . 1 1 9 TYR C 1 1 10 ARG N 1 1 10 ARG CA 1 1 10 ARG C -179.99998 -80.0 . 9 . C . 10 . N . 10 . CA . 10 . C 1 1
14 . 1 1 11 GLY C 1 1 12 THR N 1 1 12 THR CA 1 1 12 THR C -179.99998 -80.0 . 11 . C . 12 . N . 12 . CA . 12 . C 1 1
15 . 1 1 13 MET C 1 1 14 SER N 1 1 14 SER CA 1 1 14 SER C -179.99998 -80.0 . 13 . C . 14 . N . 14 . CA . 14 . C 1 1
16 . 1 1 14 SER C 1 1 15 LYS N 1 1 15 LYS CA 1 1 15 LYS C -179.99998 -80.0 . 14 . C . 15 . N . 15 . CA . 15 . C 1 1
17 . 1 1 14 SER C 1 1 17 LYS N 1 1 17 LYS CA 1 1 17 LYS C -89.99999 -30.0 . 14 . C . 17 . N . 17 . CA . 17 . C 1 1
18 . 1 1 17 LYS C 1 1 18 ASN N 1 1 18 ASN CA 1 1 18 ASN C -179.99998 -80.0 . 17 . C . 18 . N . 18 . CA . 18 . C 1 1
19 . 1 1 17 LYS C 1 1 21 THR N 1 1 21 THR CA 1 1 21 THR C -89.99999 -30.0 . 17 . C . 21 . N . 21 . CA . 21 . C 1 1
20 . 1 1 23 GLN C 1 1 24 LYS N 1 1 24 LYS CA 1 1 24 LYS C -179.99998 -80.0 . 23 . C . 24 . N . 24 . CA . 24 . C 1 1
21 . 1 1 25 TRP C 1 1 26 SER N 1 1 26 SER CA 1 1 26 SER C -179.99998 -80.0 . 25 . C . 26 . N . 26 . CA . 26 . C 1 1
22 . 1 1 28 THR C 1 1 29 SER N 1 1 29 SER CA 1 1 29 SER C -179.99998 -80.0 . 28 . C . 29 . N . 29 . CA . 29 . C 1 1
23 . 1 1 30 PRO C 1 1 31 HIS N 1 1 31 HIS CA 1 1 31 HIS C -179.99998 -80.0 . 30 . C . 31 . N . 31 . CA . 31 . C 1 1
24 . 1 1 33 PRO C 1 1 34 ARG N 1 1 34 ARG CA 1 1 34 ARG C -179.99998 -80.0 . 33 . C . 34 . N . 34 . CA . 34 . C 1 1
25 . 1 1 34 ARG C 1 1 35 PHE N 1 1 35 PHE CA 1 1 35 PHE C -179.99998 -80.0 . 34 . C . 35 . N . 35 . CA . 35 . C 1 1
26 . 1 1 34 ARG C 1 1 38 ALA N 1 1 38 ALA CA 1 1 38 ALA C -89.99999 -30.0 . 34 . C . 38 . N . 38 . CA . 38 . C 1 1
27 . 1 1 38 ALA C 1 1 39 THR N 1 1 39 THR CA 1 1 39 THR C -179.99998 -80.0 . 38 . C . 39 . N . 39 . CA . 39 . C 1 1
28 . 1 1 39 THR C 1 1 40 HIS N 1 1 40 HIS CA 1 1 40 HIS C -179.99998 -80.0 . 39 . C . 40 . N . 40 . CA . 40 . C 1 1
29 . 1 1 42 SER C 1 1 43 GLU N 1 1 43 GLU CA 1 1 43 GLU C -179.99998 -80.0 . 42 . C . 43 . N . 43 . CA . 43 . C 1 1
30 . 1 1 44 GLY C 1 1 45 LEU N 1 1 45 LEU CA 1 1 45 LEU C -179.99998 -80.0 . 44 . C . 45 . N . 45 . CA . 45 . C 1 1
31 . 1 1 45 LEU C 1 1 46 GLU N 1 1 46 GLU CA 1 1 46 GLU C -179.99998 -80.0 . 45 . C . 46 . N . 46 . CA . 46 . C 1 1
32 . 1 1 50 CYS C 1 1 51 ARG N 1 1 51 ARG CA 1 1 51 ARG C -179.99998 -80.0 . 50 . C . 51 . N . 51 . CA . 51 . C 1 1
33 . 1 1 51 ARG C 1 1 52 ASN N 1 1 52 ASN CA 1 1 52 ASN C -179.99998 -80.0 . 51 . C . 52 . N . 52 . CA . 52 . C 1 1
34 . 1 1 53 PRO C 1 1 54 ASP N 1 1 54 ASP CA 1 1 54 ASP C -179.99998 -80.0 . 53 . C . 54 . N . 54 . CA . 54 . C 1 1
35 . 1 1 60 PRO C 1 1 61 TRP N 1 1 61 TRP CA 1 1 61 TRP C -179.99998 -80.0 . 60 . C . 61 . N . 61 . CA . 61 . C 1 1
36 . 1 1 62 CYS C 1 1 63 TYR N 1 1 63 TYR CA 1 1 63 TYR C -179.99998 -80.0 . 62 . C . 63 . N . 63 . CA . 63 . C 1 1
37 . 1 1 65 THR C 1 1 66 ASP N 1 1 66 ASP CA 1 1 66 ASP C -179.99998 -80.0 . 65 . C . 66 . N . 66 . CA . 66 . C 1 1
38 . 1 1 68 GLU C 1 1 69 LYS N 1 1 69 LYS CA 1 1 69 LYS C -179.99998 -80.0 . 68 . C . 69 . N . 69 . CA . 69 . C 1 1
39 . 1 1 69 LYS C 1 1 70 ARG N 1 1 70 ARG CA 1 1 70 ARG C -179.99998 -80.0 . 69 . C . 70 . N . 70 . CA . 70 . C 1 1
40 . 1 1 70 ARG C 1 1 71 TYR N 1 1 71 TYR CA 1 1 71 TYR C -179.99998 -80.0 . 70 . C . 71 . N . 71 . CA . 71 . C 1 1
41 . 1 1 70 ARG C 1 1 73 TYR N 1 1 73 TYR CA 1 1 73 TYR C -89.99999 -30.0 . 70 . C . 73 . N . 73 . CA . 73 . C 1 1
42 . 1 1 73 TYR C 1 1 74 CYS N 1 1 74 CYS CA 1 1 74 CYS C -179.99998 -80.0 . 73 . C . 74 . N . 74 . CA . 74 . C 1 1
43 . 1 1 74 CYS C 1 1 75 ASP N 1 1 75 ASP CA 1 1 75 ASP C -179.99998 -80.0 . 74 . C . 75 . N . 75 . CA . 75 . C 1 1
44 . 1 1 75 ASP C 1 1 76 ILE N 1 1 76 ILE CA 1 1 76 ILE C -179.99998 -80.0 . 75 . C . 76 . N . 76 . CA . 76 . C 1 1
45 . 1 1 75 ASP C 1 1 77 LEU N 1 1 77 LEU CA 1 1 77 LEU C -89.99999 -30.0 . 75 . C . 77 . N . 77 . CA . 77 . C 1 1
46 . 1 1 51 ARG N 1 1 51 ARG CA 1 1 51 ARG CB 1 1 51 ARG CG -195.0 -44.999996 . 51 . N . 51 . CA . 51 . CB . 51 . CG 1 1
47 . 1 1 22 CYS N 1 1 22 CYS CA 1 1 22 CYS CB 1 1 22 CYS SG -195.0 -44.999996 . 22 . N . 22 . CA . 22 . CB . 22 . SG 1 1
48 . 1 1 31 HIS N 1 1 31 HIS CA 1 1 31 HIS CB 1 1 31 HIS CG -195.0 -44.999996 . 31 . N . 31 . CA . 31 . CB . 31 . CG 1 1
49 . 1 1 78 GLU N 1 1 78 GLU CA 1 1 78 GLU CB 1 1 78 GLU CG -195.0 -44.999996 . 78 . N . 78 . CA . 78 . CB . 78 . CG 1 1
50 . 1 1 40 HIS N 1 1 40 HIS CA 1 1 40 HIS CB 1 1 40 HIS CG -195.0 -44.999996 . 40 . N . 40 . CA . 40 . CB . 40 . CG 1 1
51 . 1 1 50 CYS N 1 1 50 CYS CA 1 1 50 CYS CB 1 1 50 CYS SG -195.0 -44.999996 . 50 . N . 50 . CA . 50 . CB . 50 . SG 1 1
52 . 1 1 25 TRP N 1 1 25 TRP CA 1 1 25 TRP CB 1 1 25 TRP CG -195.0 -44.999996 . 25 . N . 25 . CA . 25 . CB . 25 . CG 1 1
53 . 1 1 56 ASP N 1 1 56 ASP CA 1 1 56 ASP CB 1 1 56 ASP CG -195.0 -44.999996 . 56 . N . 56 . CA . 56 . CB . 56 . CG 1 1
54 . 1 1 73 TYR N 1 1 73 TYR CA 1 1 73 TYR CB 1 1 73 TYR CG -195.0 -44.999996 . 73 . N . 73 . CA . 73 . CB . 73 . CG 1 1
55 . 1 1 74 CYS N 1 1 74 CYS CA 1 1 74 CYS CB 1 1 74 CYS SG -195.0 -44.999996 . 74 . N . 74 . CA . 74 . CB . 74 . SG 1 1
56 . 1 1 63 TYR N 1 1 63 TYR CA 1 1 63 TYR CB 1 1 63 TYR CG -195.0 -44.999996 . 63 . N . 63 . CA . 63 . CB . 63 . CG 1 1
57 . 1 1 49 TYR N 1 1 49 TYR CA 1 1 49 TYR CB 1 1 49 TYR CG -195.0 -44.999996 . 49 . N . 49 . CA . 49 . CB . 49 . CG 1 1
58 . 1 1 35 PHE N 1 1 35 PHE CA 1 1 35 PHE CB 1 1 35 PHE CG -195.0 -44.999996 . 35 . N . 35 . CA . 35 . CB . 35 . CG 1 1
59 . 1 1 79 CYS N 1 1 79 CYS CA 1 1 79 CYS CB 1 1 79 CYS SG -195.0 -44.999996 . 79 . N . 79 . CA . 79 . CB . 79 . SG 1 1
60 . 1 1 2 LYS N 1 1 2 LYS CA 1 1 2 LYS CB 1 1 2 LYS CG -60.0 179.99998 . 2 . N . 2 . CA . 2 . CB . 2 . CG 1 1
61 . 1 1 52 ASN N 1 1 52 ASN CA 1 1 52 ASN CB 1 1 52 ASN CG -120.0 0.0 . 52 . N . 52 . CA . 52 . CB . 52 . CG 1 1
62 . 1 1 14 SER N 1 1 14 SER CA 1 1 14 SER CB 1 1 14 SER OG 0.0 120.0 . 14 . N . 14 . CA . 14 . CB . 14 . OG 1 1
63 . 1 1 66 ASP N 1 1 66 ASP CA 1 1 66 ASP CB 1 1 66 ASP CG 120.0 240.0 . 66 . N . 66 . CA . 66 . CB . 66 . CG 1 1
64 . 1 1 20 ILE N 1 1 20 ILE CA 1 1 20 ILE CB 1 1 20 ILE CG1 -120.0 0.0 . 20 . N . 20 . CA . 20 . CB . 20 . CG1 1 1
65 . 1 1 55 ASN N 1 1 55 ASN CA 1 1 55 ASN CB 1 1 55 ASN CG 120.0 240.0 . 55 . N . 55 . CA . 55 . CB . 55 . CG 1 1
66 . 1 1 18 ASN N 1 1 18 ASN CA 1 1 18 ASN CB 1 1 18 ASN CG -120.0 0.0 . 18 . N . 18 . CA . 18 . CB . 18 . CG 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 CYS C C -9.901 -0.265 2.432 1.00 . A A . 1 CYS C 1 1
1 2 1 1 1 CYS CA C -9.906 0.975 3.322 1.00 . A A . 1 CYS CA 1 1
1 3 1 1 1 CYS CB C -11.361 1.367 3.604 1.00 . A A . 1 CYS CB 1 1
1 4 1 1 1 CYS H1 H -8.326 1.740 2.217 1.00 . A A . 1 CYS H1 1 1
1 5 1 1 1 CYS H2 H -9.817 2.492 1.910 1.00 . A A . 1 CYS H2 1 1
1 6 1 1 1 CYS H3 H -8.977 2.829 3.347 1.00 . A A . 1 CYS H3 1 1
1 7 1 1 1 CYS HA H -9.383 0.741 4.249 1.00 . A A . 1 CYS HA 1 1
1 8 1 1 1 CYS HB2 H -11.360 2.170 4.326 1.00 . A A . 1 CYS HB2 1 1
1 9 1 1 1 CYS HB3 H -11.788 1.748 2.693 1.00 . A A . 1 CYS HB3 1 1
1 10 1 1 1 CYS N N -9.204 2.093 2.649 1.00 . A A . 1 CYS N 1 1
1 11 1 1 1 CYS O O -9.406 -0.238 1.334 1.00 . A A . 1 CYS O 1 1
1 12 1 1 1 CYS SG S -12.462 0.077 4.222 1.00 . A A . 1 CYS SG 1 1
1 13 1 1 2 LYS C C -11.881 -2.814 1.543 1.00 . A A . 2 LYS C 1 1
1 14 1 1 2 LYS CA C -10.514 -2.591 2.151 1.00 . A A . 2 LYS CA 1 1
1 15 1 1 2 LYS CB C -10.257 -3.741 3.120 1.00 . A A . 2 LYS CB 1 1
1 16 1 1 2 LYS CD C -11.544 -4.789 4.987 1.00 . A A . 2 LYS CD 1 1
1 17 1 1 2 LYS CE C -12.301 -4.516 6.289 1.00 . A A . 2 LYS CE 1 1
1 18 1 1 2 LYS CG C -11.032 -3.464 4.414 1.00 . A A . 2 LYS CG 1 1
1 19 1 1 2 LYS H H -10.853 -1.288 3.828 1.00 . A A . 2 LYS H 1 1
1 20 1 1 2 LYS HA H -9.762 -2.585 1.349 1.00 . A A . 2 LYS HA 1 1
1 21 1 1 2 LYS HB2 H -10.596 -4.672 2.678 1.00 . A A . 2 LYS HB2 1 1
1 22 1 1 2 LYS HB3 H -9.200 -3.814 3.333 1.00 . A A . 2 LYS HB3 1 1
1 23 1 1 2 LYS HD2 H -12.206 -5.260 4.275 1.00 . A A . 2 LYS HD2 1 1
1 24 1 1 2 LYS HD3 H -10.710 -5.445 5.183 1.00 . A A . 2 LYS HD3 1 1
1 25 1 1 2 LYS HE2 H -12.311 -5.409 6.895 1.00 . A A . 2 LYS HE2 1 1
1 26 1 1 2 LYS HE3 H -11.810 -3.724 6.835 1.00 . A A . 2 LYS HE3 1 1
1 27 1 1 2 LYS HG2 H -10.382 -2.985 5.130 1.00 . A A . 2 LYS HG2 1 1
1 28 1 1 2 LYS HG3 H -11.868 -2.813 4.203 1.00 . A A . 2 LYS HG3 1 1
1 29 1 1 2 LYS HZ1 H -13.848 -4.063 4.971 1.00 . A A . 2 LYS HZ1 1 1
1 30 1 1 2 LYS HZ2 H -14.359 -4.806 6.410 1.00 . A A . 2 LYS HZ2 1 1
1 31 1 1 2 LYS HZ3 H -13.888 -3.174 6.417 1.00 . A A . 2 LYS HZ3 1 1
1 32 1 1 2 LYS N N -10.463 -1.323 2.934 1.00 . A A . 2 LYS N 1 1
1 33 1 1 2 LYS NZ N -13.705 -4.109 6.000 1.00 . A A . 2 LYS NZ 1 1
1 34 1 1 2 LYS O O -12.675 -3.565 2.077 1.00 . A A . 2 LYS O 1 1
1 35 1 1 3 THR C C -13.418 -3.659 -0.930 1.00 . A A . 3 THR C 1 1
1 36 1 1 3 THR CA C -13.489 -2.352 -0.180 1.00 . A A . 3 THR CA 1 1
1 37 1 1 3 THR CB C -13.753 -1.209 -1.167 1.00 . A A . 3 THR CB 1 1
1 38 1 1 3 THR CG2 C -15.239 -0.822 -1.168 1.00 . A A . 3 THR CG2 1 1
1 39 1 1 3 THR H H -11.503 -1.545 0.052 1.00 . A A . 3 THR H 1 1
1 40 1 1 3 THR HA H -14.255 -2.413 0.590 1.00 . A A . 3 THR HA 1 1
1 41 1 1 3 THR HB H -13.376 -1.437 -2.159 1.00 . A A . 3 THR HB 1 1
1 42 1 1 3 THR HG1 H -13.716 0.386 -0.064 1.00 . A A . 3 THR HG1 1 1
1 43 1 1 3 THR HG21 H -15.543 -0.542 -0.170 1.00 . A A . 3 THR HG21 1 1
1 44 1 1 3 THR HG22 H -15.397 0.013 -1.835 1.00 . A A . 3 THR HG22 1 1
1 45 1 1 3 THR HG23 H -15.834 -1.660 -1.500 1.00 . A A . 3 THR HG23 1 1
1 46 1 1 3 THR N N -12.159 -2.156 0.449 1.00 . A A . 3 THR N 1 1
1 47 1 1 3 THR O O -13.948 -3.820 -2.009 1.00 . A A . 3 THR O 1 1
1 48 1 1 3 THR OG1 O -13.092 -0.084 -0.622 1.00 . A A . 3 THR OG1 1 1
1 49 1 1 4 GLY C C -11.054 -6.183 -0.667 1.00 . A A . 4 GLY C 1 1
1 50 1 1 4 GLY CA C -12.537 -5.892 -0.835 1.00 . A A . 4 GLY CA 1 1
1 51 1 1 4 GLY H H -12.361 -4.361 0.544 1.00 . A A . 4 GLY H 1 1
1 52 1 1 4 GLY HA2 H -13.125 -6.612 -0.284 1.00 . A A . 4 GLY HA2 1 1
1 53 1 1 4 GLY HA3 H -12.800 -5.908 -1.865 1.00 . A A . 4 GLY HA3 1 1
1 54 1 1 4 GLY N N -12.740 -4.566 -0.300 1.00 . A A . 4 GLY N 1 1
1 55 1 1 4 GLY O O -10.234 -5.546 -1.292 1.00 . A A . 4 GLY O 1 1
1 56 1 1 5 ASN C C -8.850 -8.278 -0.763 1.00 . A A . 5 ASN C 1 1
1 57 1 1 5 ASN CA C -9.302 -7.427 0.390 1.00 . A A . 5 ASN CA 1 1
1 58 1 1 5 ASN CB C -9.136 -8.178 1.732 1.00 . A A . 5 ASN CB 1 1
1 59 1 1 5 ASN CG C -8.626 -7.198 2.803 1.00 . A A . 5 ASN CG 1 1
1 60 1 1 5 ASN H H -11.416 -7.586 0.672 1.00 . A A . 5 ASN H 1 1
1 61 1 1 5 ASN HA H -8.731 -6.500 0.381 1.00 . A A . 5 ASN HA 1 1
1 62 1 1 5 ASN HB2 H -10.086 -8.584 2.044 1.00 . A A . 5 ASN HB2 1 1
1 63 1 1 5 ASN HB3 H -8.424 -8.981 1.625 1.00 . A A . 5 ASN HB3 1 1
1 64 1 1 5 ASN HD21 H -8.104 -8.641 4.059 1.00 . A A . 5 ASN HD21 1 1
1 65 1 1 5 ASN HD22 H -7.803 -7.061 4.606 1.00 . A A . 5 ASN HD22 1 1
1 66 1 1 5 ASN N N -10.731 -7.107 0.188 1.00 . A A . 5 ASN N 1 1
1 67 1 1 5 ASN ND2 N -8.140 -7.672 3.915 1.00 . A A . 5 ASN ND2 1 1
1 68 1 1 5 ASN O O -8.452 -9.418 -0.621 1.00 . A A . 5 ASN O 1 1
1 69 1 1 5 ASN OD1 O -8.667 -5.997 2.637 1.00 . A A . 5 ASN OD1 1 1
1 70 1 1 6 GLY C C -9.775 -8.576 -4.030 1.00 . A A . 6 GLY C 1 1
1 71 1 1 6 GLY CA C -8.539 -8.359 -3.155 1.00 . A A . 6 GLY CA 1 1
1 72 1 1 6 GLY H H -9.275 -6.744 -1.922 1.00 . A A . 6 GLY H 1 1
1 73 1 1 6 GLY HA2 H -7.827 -7.751 -3.685 1.00 . A A . 6 GLY HA2 1 1
1 74 1 1 6 GLY HA3 H -8.092 -9.313 -2.922 1.00 . A A . 6 GLY HA3 1 1
1 75 1 1 6 GLY N N -8.939 -7.673 -1.900 1.00 . A A . 6 GLY N 1 1
1 76 1 1 6 GLY O O -9.987 -9.652 -4.553 1.00 . A A . 6 GLY O 1 1
1 77 1 1 7 LYS C C -12.224 -6.329 -5.578 1.00 . A A . 7 LYS C 1 1
1 78 1 1 7 LYS CA C -11.781 -7.673 -4.997 1.00 . A A . 7 LYS CA 1 1
1 79 1 1 7 LYS CB C -12.911 -8.228 -4.118 1.00 . A A . 7 LYS CB 1 1
1 80 1 1 7 LYS CD C -15.255 -9.048 -4.353 1.00 . A A . 7 LYS CD 1 1
1 81 1 1 7 LYS CE C -15.979 -10.345 -4.721 1.00 . A A . 7 LYS CE 1 1
1 82 1 1 7 LYS CG C -13.862 -9.055 -4.986 1.00 . A A . 7 LYS CG 1 1
1 83 1 1 7 LYS H H -10.362 -6.702 -3.746 1.00 . A A . 7 LYS H 1 1
1 84 1 1 7 LYS HA H -11.564 -8.345 -5.807 1.00 . A A . 7 LYS HA 1 1
1 85 1 1 7 LYS HB2 H -12.494 -8.851 -3.341 1.00 . A A . 7 LYS HB2 1 1
1 86 1 1 7 LYS HB3 H -13.452 -7.411 -3.664 1.00 . A A . 7 LYS HB3 1 1
1 87 1 1 7 LYS HD2 H -15.166 -8.974 -3.280 1.00 . A A . 7 LYS HD2 1 1
1 88 1 1 7 LYS HD3 H -15.817 -8.202 -4.721 1.00 . A A . 7 LYS HD3 1 1
1 89 1 1 7 LYS HE2 H -17.047 -10.189 -4.675 1.00 . A A . 7 LYS HE2 1 1
1 90 1 1 7 LYS HE3 H -15.709 -10.639 -5.724 1.00 . A A . 7 LYS HE3 1 1
1 91 1 1 7 LYS HG2 H -13.912 -8.628 -5.977 1.00 . A A . 7 LYS HG2 1 1
1 92 1 1 7 LYS HG3 H -13.500 -10.070 -5.056 1.00 . A A . 7 LYS HG3 1 1
1 93 1 1 7 LYS HZ1 H -14.591 -11.369 -3.554 1.00 . A A . 7 LYS HZ1 1 1
1 94 1 1 7 LYS HZ2 H -16.160 -11.343 -2.902 1.00 . A A . 7 LYS HZ2 1 1
1 95 1 1 7 LYS HZ3 H -15.803 -12.358 -4.217 1.00 . A A . 7 LYS HZ3 1 1
1 96 1 1 7 LYS N N -10.570 -7.543 -4.171 1.00 . A A . 7 LYS N 1 1
1 97 1 1 7 LYS NZ N -15.605 -11.436 -3.777 1.00 . A A . 7 LYS NZ 1 1
1 98 1 1 7 LYS O O -12.461 -6.222 -6.765 1.00 . A A . 7 LYS O 1 1
1 99 1 1 8 ASN C C -12.135 -2.844 -4.488 1.00 . A A . 8 ASN C 1 1
1 100 1 1 8 ASN CA C -12.762 -3.994 -5.270 1.00 . A A . 8 ASN CA 1 1
1 101 1 1 8 ASN CB C -14.290 -3.899 -5.147 1.00 . A A . 8 ASN CB 1 1
1 102 1 1 8 ASN CG C -14.940 -4.677 -6.294 1.00 . A A . 8 ASN CG 1 1
1 103 1 1 8 ASN H H -12.129 -5.439 -3.780 1.00 . A A . 8 ASN H 1 1
1 104 1 1 8 ASN HA H -12.457 -3.915 -6.312 1.00 . A A . 8 ASN HA 1 1
1 105 1 1 8 ASN HB2 H -14.609 -4.322 -4.207 1.00 . A A . 8 ASN HB2 1 1
1 106 1 1 8 ASN HB3 H -14.599 -2.865 -5.197 1.00 . A A . 8 ASN HB3 1 1
1 107 1 1 8 ASN HD21 H -14.443 -3.328 -7.663 1.00 . A A . 8 ASN HD21 1 1
1 108 1 1 8 ASN HD22 H -15.302 -4.670 -8.246 1.00 . A A . 8 ASN HD22 1 1
1 109 1 1 8 ASN N N -12.331 -5.322 -4.741 1.00 . A A . 8 ASN N 1 1
1 110 1 1 8 ASN ND2 N -14.891 -4.184 -7.501 1.00 . A A . 8 ASN ND2 1 1
1 111 1 1 8 ASN O O -11.935 -2.937 -3.293 1.00 . A A . 8 ASN O 1 1
1 112 1 1 8 ASN OD1 O -15.497 -5.739 -6.101 1.00 . A A . 8 ASN OD1 1 1
1 113 1 1 9 TYR C C -11.012 0.556 -5.485 1.00 . A A . 9 TYR C 1 1
1 114 1 1 9 TYR CA C -11.216 -0.601 -4.507 1.00 . A A . 9 TYR CA 1 1
1 115 1 1 9 TYR CB C -9.848 -1.027 -3.967 1.00 . A A . 9 TYR CB 1 1
1 116 1 1 9 TYR CD1 C -9.122 -2.162 -6.104 1.00 . A A . 9 TYR CD1 1 1
1 117 1 1 9 TYR CD2 C -9.152 -3.452 -4.107 1.00 . A A . 9 TYR CD2 1 1
1 118 1 1 9 TYR CE1 C -8.690 -3.264 -6.810 1.00 . A A . 9 TYR CE1 1 1
1 119 1 1 9 TYR CE2 C -8.720 -4.554 -4.813 1.00 . A A . 9 TYR CE2 1 1
1 120 1 1 9 TYR CG C -9.357 -2.247 -4.747 1.00 . A A . 9 TYR CG 1 1
1 121 1 1 9 TYR CZ C -8.486 -4.469 -6.170 1.00 . A A . 9 TYR CZ 1 1
1 122 1 1 9 TYR H H -12.013 -1.747 -6.149 1.00 . A A . 9 TYR H 1 1
1 123 1 1 9 TYR HA H -11.867 -0.274 -3.700 1.00 . A A . 9 TYR HA 1 1
1 124 1 1 9 TYR HB2 H -9.142 -0.221 -4.087 1.00 . A A . 9 TYR HB2 1 1
1 125 1 1 9 TYR HB3 H -9.933 -1.280 -2.922 1.00 . A A . 9 TYR HB3 1 1
1 126 1 1 9 TYR HD1 H -9.282 -1.225 -6.617 1.00 . A A . 9 TYR HD1 1 1
1 127 1 1 9 TYR HD2 H -9.331 -3.534 -3.045 1.00 . A A . 9 TYR HD2 1 1
1 128 1 1 9 TYR HE1 H -8.510 -3.184 -7.872 1.00 . A A . 9 TYR HE1 1 1
1 129 1 1 9 TYR HE2 H -8.569 -5.491 -4.300 1.00 . A A . 9 TYR HE2 1 1
1 130 1 1 9 TYR HH H -8.669 -6.290 -6.711 1.00 . A A . 9 TYR HH 1 1
1 131 1 1 9 TYR N N -11.833 -1.774 -5.186 1.00 . A A . 9 TYR N 1 1
1 132 1 1 9 TYR O O -11.316 0.441 -6.656 1.00 . A A . 9 TYR O 1 1
1 133 1 1 9 TYR OH O -8.054 -5.572 -6.877 1.00 . A A . 9 TYR OH 1 1
1 134 1 1 10 ARG C C -8.969 3.562 -5.494 1.00 . A A . 10 ARG C 1 1
1 135 1 1 10 ARG CA C -10.262 2.831 -5.869 1.00 . A A . 10 ARG CA 1 1
1 136 1 1 10 ARG CB C -11.442 3.810 -5.704 1.00 . A A . 10 ARG CB 1 1
1 137 1 1 10 ARG CD C -13.531 2.543 -5.155 1.00 . A A . 10 ARG CD 1 1
1 138 1 1 10 ARG CG C -12.726 3.192 -6.284 1.00 . A A . 10 ARG CG 1 1
1 139 1 1 10 ARG CZ C -15.503 1.876 -6.376 1.00 . A A . 10 ARG CZ 1 1
1 140 1 1 10 ARG H H -10.262 1.699 -4.032 1.00 . A A . 10 ARG H 1 1
1 141 1 1 10 ARG HA H -10.182 2.489 -6.899 1.00 . A A . 10 ARG HA 1 1
1 142 1 1 10 ARG HB2 H -11.587 4.027 -4.656 1.00 . A A . 10 ARG HB2 1 1
1 143 1 1 10 ARG HB3 H -11.221 4.731 -6.224 1.00 . A A . 10 ARG HB3 1 1
1 144 1 1 10 ARG HD2 H -12.863 2.080 -4.444 1.00 . A A . 10 ARG HD2 1 1
1 145 1 1 10 ARG HD3 H -14.126 3.291 -4.655 1.00 . A A . 10 ARG HD3 1 1
1 146 1 1 10 ARG HE H -14.215 0.555 -5.636 1.00 . A A . 10 ARG HE 1 1
1 147 1 1 10 ARG HG2 H -13.319 3.965 -6.750 1.00 . A A . 10 ARG HG2 1 1
1 148 1 1 10 ARG HG3 H -12.477 2.448 -7.023 1.00 . A A . 10 ARG HG3 1 1
1 149 1 1 10 ARG HH11 H -14.464 2.793 -7.820 1.00 . A A . 10 ARG HH11 1 1
1 150 1 1 10 ARG HH12 H -16.187 2.853 -7.983 1.00 . A A . 10 ARG HH12 1 1
1 151 1 1 10 ARG HH21 H -16.731 1.024 -5.043 1.00 . A A . 10 ARG HH21 1 1
1 152 1 1 10 ARG HH22 H -17.505 1.825 -6.369 1.00 . A A . 10 ARG HH22 1 1
1 153 1 1 10 ARG N N -10.494 1.654 -4.983 1.00 . A A . 10 ARG N 1 1
1 154 1 1 10 ARG NE N -14.429 1.506 -5.735 1.00 . A A . 10 ARG NE 1 1
1 155 1 1 10 ARG NH1 N -15.375 2.561 -7.479 1.00 . A A . 10 ARG NH1 1 1
1 156 1 1 10 ARG NH2 N -16.671 1.549 -5.892 1.00 . A A . 10 ARG NH2 1 1
1 157 1 1 10 ARG O O -8.100 3.747 -6.322 1.00 . A A . 10 ARG O 1 1
1 158 1 1 11 GLY C C -6.404 3.765 -3.880 1.00 . A A . 11 GLY C 1 1
1 159 1 1 11 GLY CA C -7.626 4.689 -3.815 1.00 . A A . 11 GLY CA 1 1
1 160 1 1 11 GLY H H -9.590 3.797 -3.618 1.00 . A A . 11 GLY H 1 1
1 161 1 1 11 GLY HA2 H -7.463 5.534 -4.468 1.00 . A A . 11 GLY HA2 1 1
1 162 1 1 11 GLY HA3 H -7.747 5.042 -2.812 1.00 . A A . 11 GLY HA3 1 1
1 163 1 1 11 GLY N N -8.865 3.965 -4.253 1.00 . A A . 11 GLY N 1 1
1 164 1 1 11 GLY O O -5.347 4.119 -3.417 1.00 . A A . 11 GLY O 1 1
1 165 1 1 12 THR C C -4.464 2.117 -5.639 1.00 . A A . 12 THR C 1 1
1 166 1 1 12 THR CA C -5.418 1.666 -4.570 1.00 . A A . 12 THR CA 1 1
1 167 1 1 12 THR CB C -5.938 0.291 -4.957 1.00 . A A . 12 THR CB 1 1
1 168 1 1 12 THR CG2 C -6.459 0.279 -6.404 1.00 . A A . 12 THR CG2 1 1
1 169 1 1 12 THR H H -7.438 2.364 -4.851 1.00 . A A . 12 THR H 1 1
1 170 1 1 12 THR HA H -4.884 1.623 -3.613 1.00 . A A . 12 THR HA 1 1
1 171 1 1 12 THR HB H -6.654 -0.078 -4.252 1.00 . A A . 12 THR HB 1 1
1 172 1 1 12 THR HG1 H -4.250 -0.258 -5.717 1.00 . A A . 12 THR HG1 1 1
1 173 1 1 12 THR HG21 H -7.102 1.132 -6.566 1.00 . A A . 12 THR HG21 1 1
1 174 1 1 12 THR HG22 H -5.632 0.321 -7.094 1.00 . A A . 12 THR HG22 1 1
1 175 1 1 12 THR HG23 H -7.020 -0.626 -6.580 1.00 . A A . 12 THR HG23 1 1
1 176 1 1 12 THR N N -6.569 2.608 -4.475 1.00 . A A . 12 THR N 1 1
1 177 1 1 12 THR O O -3.414 1.530 -5.814 1.00 . A A . 12 THR O 1 1
1 178 1 1 12 THR OG1 O -4.798 -0.529 -4.977 1.00 . A A . 12 THR OG1 1 1
1 179 1 1 13 MET C C -2.569 3.697 -6.865 1.00 . A A . 13 MET C 1 1
1 180 1 1 13 MET CA C -3.956 3.639 -7.415 1.00 . A A . 13 MET CA 1 1
1 181 1 1 13 MET CB C -4.398 5.055 -7.814 1.00 . A A . 13 MET CB 1 1
1 182 1 1 13 MET CE C -8.196 5.326 -9.440 1.00 . A A . 13 MET CE 1 1
1 183 1 1 13 MET CG C -5.593 4.958 -8.764 1.00 . A A . 13 MET CG 1 1
1 184 1 1 13 MET H H -5.710 3.578 -6.185 1.00 . A A . 13 MET H 1 1
1 185 1 1 13 MET HA H -3.977 2.974 -8.243 1.00 . A A . 13 MET HA 1 1
1 186 1 1 13 MET HB2 H -4.680 5.609 -6.931 1.00 . A A . 13 MET HB2 1 1
1 187 1 1 13 MET HB3 H -3.583 5.565 -8.306 1.00 . A A . 13 MET HB3 1 1
1 188 1 1 13 MET HE1 H -8.377 4.411 -8.896 1.00 . A A . 13 MET HE1 1 1
1 189 1 1 13 MET HE2 H -9.094 5.926 -9.444 1.00 . A A . 13 MET HE2 1 1
1 190 1 1 13 MET HE3 H -7.915 5.091 -10.456 1.00 . A A . 13 MET HE3 1 1
1 191 1 1 13 MET HG2 H -5.218 4.961 -9.777 1.00 . A A . 13 MET HG2 1 1
1 192 1 1 13 MET HG3 H -6.078 4.007 -8.598 1.00 . A A . 13 MET HG3 1 1
1 193 1 1 13 MET N N -4.846 3.146 -6.354 1.00 . A A . 13 MET N 1 1
1 194 1 1 13 MET O O -1.741 2.860 -7.152 1.00 . A A . 13 MET O 1 1
1 195 1 1 13 MET SD S -6.858 6.247 -8.643 1.00 . A A . 13 MET SD 1 1
1 196 1 1 14 SER C C -1.009 6.098 -4.574 1.00 . A A . 14 SER C 1 1
1 197 1 1 14 SER CA C -1.036 4.856 -5.449 1.00 . A A . 14 SER CA 1 1
1 198 1 1 14 SER CB C 0.003 4.968 -6.545 1.00 . A A . 14 SER CB 1 1
1 199 1 1 14 SER H H -3.083 5.298 -5.888 1.00 . A A . 14 SER H 1 1
1 200 1 1 14 SER HA H -0.833 3.989 -4.821 1.00 . A A . 14 SER HA 1 1
1 201 1 1 14 SER HB2 H 0.898 5.446 -6.180 1.00 . A A . 14 SER HB2 1 1
1 202 1 1 14 SER HB3 H 0.226 3.992 -6.931 1.00 . A A . 14 SER HB3 1 1
1 203 1 1 14 SER HG H -0.927 5.185 -8.239 1.00 . A A . 14 SER HG 1 1
1 204 1 1 14 SER N N -2.361 4.676 -6.070 1.00 . A A . 14 SER N 1 1
1 205 1 1 14 SER O O -0.231 7.006 -4.788 1.00 . A A . 14 SER O 1 1
1 206 1 1 14 SER OG O -0.618 5.768 -7.541 1.00 . A A . 14 SER OG 1 1
1 207 1 1 15 LYS C C -2.150 6.716 -1.257 1.00 . A A . 15 LYS C 1 1
1 208 1 1 15 LYS CA C -1.950 7.250 -2.673 1.00 . A A . 15 LYS CA 1 1
1 209 1 1 15 LYS CB C -3.157 8.117 -3.069 1.00 . A A . 15 LYS CB 1 1
1 210 1 1 15 LYS CD C -4.645 8.819 -4.944 1.00 . A A . 15 LYS CD 1 1
1 211 1 1 15 LYS CE C -4.017 10.095 -5.509 1.00 . A A . 15 LYS CE 1 1
1 212 1 1 15 LYS CG C -3.534 7.851 -4.532 1.00 . A A . 15 LYS CG 1 1
1 213 1 1 15 LYS H H -2.473 5.338 -3.483 1.00 . A A . 15 LYS H 1 1
1 214 1 1 15 LYS HA H -1.020 7.817 -2.718 1.00 . A A . 15 LYS HA 1 1
1 215 1 1 15 LYS HB2 H -3.995 7.879 -2.433 1.00 . A A . 15 LYS HB2 1 1
1 216 1 1 15 LYS HB3 H -2.903 9.158 -2.951 1.00 . A A . 15 LYS HB3 1 1
1 217 1 1 15 LYS HD2 H -5.267 8.358 -5.697 1.00 . A A . 15 LYS HD2 1 1
1 218 1 1 15 LYS HD3 H -5.252 9.063 -4.085 1.00 . A A . 15 LYS HD3 1 1
1 219 1 1 15 LYS HE2 H -3.095 10.306 -4.987 1.00 . A A . 15 LYS HE2 1 1
1 220 1 1 15 LYS HE3 H -3.804 9.960 -6.559 1.00 . A A . 15 LYS HE3 1 1
1 221 1 1 15 LYS HG2 H -2.673 8.000 -5.164 1.00 . A A . 15 LYS HG2 1 1
1 222 1 1 15 LYS HG3 H -3.885 6.835 -4.640 1.00 . A A . 15 LYS HG3 1 1
1 223 1 1 15 LYS HZ1 H -5.754 10.963 -4.757 1.00 . A A . 15 LYS HZ1 1 1
1 224 1 1 15 LYS HZ2 H -4.443 12.035 -4.885 1.00 . A A . 15 LYS HZ2 1 1
1 225 1 1 15 LYS HZ3 H -5.286 11.555 -6.279 1.00 . A A . 15 LYS HZ3 1 1
1 226 1 1 15 LYS N N -1.870 6.102 -3.602 1.00 . A A . 15 LYS N 1 1
1 227 1 1 15 LYS NZ N -4.945 11.249 -5.345 1.00 . A A . 15 LYS NZ 1 1
1 228 1 1 15 LYS O O -2.864 5.762 -1.067 1.00 . A A . 15 LYS O 1 1
1 229 1 1 16 THR C C -3.115 7.206 1.677 1.00 . A A . 16 THR C 1 1
1 230 1 1 16 THR CA C -1.729 6.802 1.092 1.00 . A A . 16 THR CA 1 1
1 231 1 1 16 THR CB C -0.574 7.283 1.961 1.00 . A A . 16 THR CB 1 1
1 232 1 1 16 THR CG2 C 0.174 6.107 2.594 1.00 . A A . 16 THR CG2 1 1
1 233 1 1 16 THR H H -0.976 8.108 -0.448 1.00 . A A . 16 THR H 1 1
1 234 1 1 16 THR HA H -1.700 5.728 1.008 1.00 . A A . 16 THR HA 1 1
1 235 1 1 16 THR HB H -0.879 8.034 2.681 1.00 . A A . 16 THR HB 1 1
1 236 1 1 16 THR HG1 H 0.297 7.253 0.241 1.00 . A A . 16 THR HG1 1 1
1 237 1 1 16 THR HG21 H 0.449 5.394 1.830 1.00 . A A . 16 THR HG21 1 1
1 238 1 1 16 THR HG22 H 1.069 6.466 3.079 1.00 . A A . 16 THR HG22 1 1
1 239 1 1 16 THR HG23 H -0.445 5.630 3.310 1.00 . A A . 16 THR HG23 1 1
1 240 1 1 16 THR N N -1.537 7.327 -0.281 1.00 . A A . 16 THR N 1 1
1 241 1 1 16 THR O O -3.763 8.097 1.140 1.00 . A A . 16 THR O 1 1
1 242 1 1 16 THR OG1 O 0.362 7.777 1.043 1.00 . A A . 16 THR OG1 1 1
1 243 1 1 17 LYS C C -5.450 8.161 3.146 1.00 . A A . 17 LYS C 1 1
1 244 1 1 17 LYS CA C -4.795 6.861 3.551 1.00 . A A . 17 LYS CA 1 1
1 245 1 1 17 LYS CB C -4.584 6.876 5.098 1.00 . A A . 17 LYS CB 1 1
1 246 1 1 17 LYS CD C -5.901 6.824 7.215 1.00 . A A . 17 LYS CD 1 1
1 247 1 1 17 LYS CE C -6.667 7.833 8.072 1.00 . A A . 17 LYS CE 1 1
1 248 1 1 17 LYS CG C -5.893 7.305 5.763 1.00 . A A . 17 LYS CG 1 1
1 249 1 1 17 LYS H H -2.849 5.969 3.234 1.00 . A A . 17 LYS H 1 1
1 250 1 1 17 LYS HA H -5.474 6.061 3.294 1.00 . A A . 17 LYS HA 1 1
1 251 1 1 17 LYS HB2 H -4.304 5.869 5.464 1.00 . A A . 17 LYS HB2 1 1
1 252 1 1 17 LYS HB3 H -3.812 7.578 5.356 1.00 . A A . 17 LYS HB3 1 1
1 253 1 1 17 LYS HD2 H -6.381 5.858 7.275 1.00 . A A . 17 LYS HD2 1 1
1 254 1 1 17 LYS HD3 H -4.887 6.738 7.574 1.00 . A A . 17 LYS HD3 1 1
1 255 1 1 17 LYS HE2 H -6.047 8.698 8.254 1.00 . A A . 17 LYS HE2 1 1
1 256 1 1 17 LYS HE3 H -7.562 8.144 7.552 1.00 . A A . 17 LYS HE3 1 1
1 257 1 1 17 LYS HG2 H -5.978 8.381 5.737 1.00 . A A . 17 LYS HG2 1 1
1 258 1 1 17 LYS HG3 H -6.729 6.871 5.233 1.00 . A A . 17 LYS HG3 1 1
1 259 1 1 17 LYS HZ1 H -6.384 6.462 9.612 1.00 . A A . 17 LYS HZ1 1 1
1 260 1 1 17 LYS HZ2 H -7.021 7.952 10.120 1.00 . A A . 17 LYS HZ2 1 1
1 261 1 1 17 LYS HZ3 H -8.012 6.837 9.310 1.00 . A A . 17 LYS HZ3 1 1
1 262 1 1 17 LYS N N -3.465 6.596 2.840 1.00 . A A . 17 LYS N 1 1
1 263 1 1 17 LYS NZ N -7.050 7.225 9.377 1.00 . A A . 17 LYS NZ 1 1
1 264 1 1 17 LYS O O -6.633 8.181 2.872 1.00 . A A . 17 LYS O 1 1
1 265 1 1 18 ASN C C -5.302 10.650 1.227 1.00 . A A . 18 ASN C 1 1
1 266 1 1 18 ASN CA C -5.369 10.479 2.714 1.00 . A A . 18 ASN CA 1 1
1 267 1 1 18 ASN CB C -4.589 11.610 3.255 1.00 . A A . 18 ASN CB 1 1
1 268 1 1 18 ASN CG C -5.468 12.467 4.169 1.00 . A A . 18 ASN CG 1 1
1 269 1 1 18 ASN H H -3.775 9.178 3.344 1.00 . A A . 18 ASN H 1 1
1 270 1 1 18 ASN HA H -6.402 10.506 3.049 1.00 . A A . 18 ASN HA 1 1
1 271 1 1 18 ASN HB2 H -3.731 11.247 3.802 1.00 . A A . 18 ASN HB2 1 1
1 272 1 1 18 ASN HB3 H -4.266 12.181 2.409 1.00 . A A . 18 ASN HB3 1 1
1 273 1 1 18 ASN HD21 H -6.253 10.900 5.102 1.00 . A A . 18 ASN HD21 1 1
1 274 1 1 18 ASN HD22 H -6.809 12.414 5.632 1.00 . A A . 18 ASN HD22 1 1
1 275 1 1 18 ASN N N -4.727 9.211 3.112 1.00 . A A . 18 ASN N 1 1
1 276 1 1 18 ASN ND2 N -6.241 11.878 5.040 1.00 . A A . 18 ASN ND2 1 1
1 277 1 1 18 ASN O O -6.293 10.872 0.560 1.00 . A A . 18 ASN O 1 1
1 278 1 1 18 ASN OD1 O -5.458 13.680 4.098 1.00 . A A . 18 ASN OD1 1 1
1 279 1 1 19 GLY C C -2.398 10.956 -0.943 1.00 . A A . 19 GLY C 1 1
1 280 1 1 19 GLY CA C -3.885 10.689 -0.676 1.00 . A A . 19 GLY CA 1 1
1 281 1 1 19 GLY H H -3.373 10.380 1.321 1.00 . A A . 19 GLY H 1 1
1 282 1 1 19 GLY HA2 H -4.191 9.794 -1.168 1.00 . A A . 19 GLY HA2 1 1
1 283 1 1 19 GLY HA3 H -4.462 11.509 -1.034 1.00 . A A . 19 GLY HA3 1 1
1 284 1 1 19 GLY N N -4.111 10.547 0.741 1.00 . A A . 19 GLY N 1 1
1 285 1 1 19 GLY O O -2.051 11.614 -1.903 1.00 . A A . 19 GLY O 1 1
1 286 1 1 20 ILE C C 0.521 9.716 -1.342 1.00 . A A . 20 ILE C 1 1
1 287 1 1 20 ILE CA C -0.076 10.670 -0.294 1.00 . A A . 20 ILE CA 1 1
1 288 1 1 20 ILE CB C 0.617 10.503 1.066 1.00 . A A . 20 ILE CB 1 1
1 289 1 1 20 ILE CD1 C 1.143 11.671 3.206 1.00 . A A . 20 ILE CD1 1 1
1 290 1 1 20 ILE CG1 C 0.524 11.813 1.806 1.00 . A A . 20 ILE CG1 1 1
1 291 1 1 20 ILE CG2 C 2.117 10.105 0.876 1.00 . A A . 20 ILE CG2 1 1
1 292 1 1 20 ILE H H -1.864 9.914 0.694 1.00 . A A . 20 ILE H 1 1
1 293 1 1 20 ILE HA H 0.051 11.681 -0.649 1.00 . A A . 20 ILE HA 1 1
1 294 1 1 20 ILE HB H 0.087 9.784 1.627 1.00 . A A . 20 ILE HB 1 1
1 295 1 1 20 ILE HD11 H 1.106 10.640 3.524 1.00 . A A . 20 ILE HD11 1 1
1 296 1 1 20 ILE HD12 H 2.171 11.999 3.184 1.00 . A A . 20 ILE HD12 1 1
1 297 1 1 20 ILE HD13 H 0.592 12.278 3.909 1.00 . A A . 20 ILE HD13 1 1
1 298 1 1 20 ILE HG12 H 1.039 12.584 1.255 1.00 . A A . 20 ILE HG12 1 1
1 299 1 1 20 ILE HG13 H -0.526 12.075 1.894 1.00 . A A . 20 ILE HG13 1 1
1 300 1 1 20 ILE HG21 H 2.581 10.779 0.177 1.00 . A A . 20 ILE HG21 1 1
1 301 1 1 20 ILE HG22 H 2.647 10.152 1.825 1.00 . A A . 20 ILE HG22 1 1
1 302 1 1 20 ILE HG23 H 2.192 9.096 0.498 1.00 . A A . 20 ILE HG23 1 1
1 303 1 1 20 ILE N N -1.544 10.439 -0.084 1.00 . A A . 20 ILE N 1 1
1 304 1 1 20 ILE O O 0.598 8.524 -1.142 1.00 . A A . 20 ILE O 1 1
1 305 1 1 21 THR C C 2.403 8.337 -3.013 1.00 . A A . 21 THR C 1 1
1 306 1 1 21 THR CA C 1.526 9.475 -3.542 1.00 . A A . 21 THR CA 1 1
1 307 1 1 21 THR CB C 2.395 10.400 -4.399 1.00 . A A . 21 THR CB 1 1
1 308 1 1 21 THR CG2 C 2.280 10.033 -5.886 1.00 . A A . 21 THR CG2 1 1
1 309 1 1 21 THR H H 0.835 11.242 -2.568 1.00 . A A . 21 THR H 1 1
1 310 1 1 21 THR HA H 0.723 9.061 -4.128 1.00 . A A . 21 THR HA 1 1
1 311 1 1 21 THR HB H 3.423 10.427 -4.050 1.00 . A A . 21 THR HB 1 1
1 312 1 1 21 THR HG1 H 2.322 12.293 -4.811 1.00 . A A . 21 THR HG1 1 1
1 313 1 1 21 THR HG21 H 1.246 10.087 -6.195 1.00 . A A . 21 THR HG21 1 1
1 314 1 1 21 THR HG22 H 2.865 10.722 -6.477 1.00 . A A . 21 THR HG22 1 1
1 315 1 1 21 THR HG23 H 2.645 9.029 -6.043 1.00 . A A . 21 THR HG23 1 1
1 316 1 1 21 THR N N 0.932 10.285 -2.451 1.00 . A A . 21 THR N 1 1
1 317 1 1 21 THR O O 3.512 8.557 -2.575 1.00 . A A . 21 THR O 1 1
1 318 1 1 21 THR OG1 O 1.794 11.676 -4.300 1.00 . A A . 21 THR OG1 1 1
1 319 1 1 22 CYS C C 3.975 5.769 -3.389 1.00 . A A . 22 CYS C 1 1
1 320 1 1 22 CYS CA C 2.652 5.961 -2.586 1.00 . A A . 22 CYS CA 1 1
1 321 1 1 22 CYS CB C 1.733 4.715 -2.712 1.00 . A A . 22 CYS CB 1 1
1 322 1 1 22 CYS H H 0.976 7.022 -3.425 1.00 . A A . 22 CYS H 1 1
1 323 1 1 22 CYS HA H 2.911 6.134 -1.541 1.00 . A A . 22 CYS HA 1 1
1 324 1 1 22 CYS HB2 H 1.004 4.917 -3.476 1.00 . A A . 22 CYS HB2 1 1
1 325 1 1 22 CYS HB3 H 2.313 3.877 -3.041 1.00 . A A . 22 CYS HB3 1 1
1 326 1 1 22 CYS N N 1.880 7.140 -3.074 1.00 . A A . 22 CYS N 1 1
1 327 1 1 22 CYS O O 4.488 6.708 -3.964 1.00 . A A . 22 CYS O 1 1
1 328 1 1 22 CYS SG S 0.831 4.200 -1.221 1.00 . A A . 22 CYS SG 1 1
1 329 1 1 23 GLN C C 5.578 3.329 -5.325 1.00 . A A . 23 GLN C 1 1
1 330 1 1 23 GLN CA C 5.769 4.262 -4.149 1.00 . A A . 23 GLN CA 1 1
1 331 1 1 23 GLN CB C 6.733 3.564 -3.193 1.00 . A A . 23 GLN CB 1 1
1 332 1 1 23 GLN CD C 6.883 2.230 -1.121 1.00 . A A . 23 GLN CD 1 1
1 333 1 1 23 GLN CG C 6.005 2.516 -2.343 1.00 . A A . 23 GLN CG 1 1
1 334 1 1 23 GLN H H 4.032 3.832 -2.935 1.00 . A A . 23 GLN H 1 1
1 335 1 1 23 GLN HA H 6.189 5.186 -4.498 1.00 . A A . 23 GLN HA 1 1
1 336 1 1 23 GLN HB2 H 7.489 3.070 -3.750 1.00 . A A . 23 GLN HB2 1 1
1 337 1 1 23 GLN HB3 H 7.194 4.288 -2.566 1.00 . A A . 23 GLN HB3 1 1
1 338 1 1 23 GLN HE21 H 7.272 4.149 -0.761 1.00 . A A . 23 GLN HE21 1 1
1 339 1 1 23 GLN HE22 H 7.997 3.081 0.320 1.00 . A A . 23 GLN HE22 1 1
1 340 1 1 23 GLN HG2 H 5.064 2.872 -2.016 1.00 . A A . 23 GLN HG2 1 1
1 341 1 1 23 GLN HG3 H 5.871 1.610 -2.912 1.00 . A A . 23 GLN HG3 1 1
1 342 1 1 23 GLN N N 4.489 4.551 -3.405 1.00 . A A . 23 GLN N 1 1
1 343 1 1 23 GLN NE2 N 7.432 3.248 -0.464 1.00 . A A . 23 GLN NE2 1 1
1 344 1 1 23 GLN O O 4.494 3.054 -5.694 1.00 . A A . 23 GLN O 1 1
1 345 1 1 23 GLN OE1 O 7.097 1.095 -0.765 1.00 . A A . 23 GLN OE1 1 1
1 346 1 1 24 LYS C C 7.243 0.587 -6.668 1.00 . A A . 24 LYS C 1 1
1 347 1 1 24 LYS CA C 6.632 1.931 -7.043 1.00 . A A . 24 LYS CA 1 1
1 348 1 1 24 LYS CB C 7.480 2.521 -8.154 1.00 . A A . 24 LYS CB 1 1
1 349 1 1 24 LYS CD C 9.587 3.788 -8.582 1.00 . A A . 24 LYS CD 1 1
1 350 1 1 24 LYS CE C 8.937 4.198 -9.906 1.00 . A A . 24 LYS CE 1 1
1 351 1 1 24 LYS CG C 8.494 3.493 -7.549 1.00 . A A . 24 LYS CG 1 1
1 352 1 1 24 LYS H H 7.574 3.121 -5.521 1.00 . A A . 24 LYS H 1 1
1 353 1 1 24 LYS HA H 5.612 1.801 -7.353 1.00 . A A . 24 LYS HA 1 1
1 354 1 1 24 LYS HB2 H 8.000 1.727 -8.654 1.00 . A A . 24 LYS HB2 1 1
1 355 1 1 24 LYS HB3 H 6.849 3.036 -8.855 1.00 . A A . 24 LYS HB3 1 1
1 356 1 1 24 LYS HD2 H 10.216 4.589 -8.224 1.00 . A A . 24 LYS HD2 1 1
1 357 1 1 24 LYS HD3 H 10.190 2.905 -8.733 1.00 . A A . 24 LYS HD3 1 1
1 358 1 1 24 LYS HE2 H 8.085 4.833 -9.710 1.00 . A A . 24 LYS HE2 1 1
1 359 1 1 24 LYS HE3 H 9.651 4.742 -10.506 1.00 . A A . 24 LYS HE3 1 1
1 360 1 1 24 LYS HG2 H 7.998 4.411 -7.272 1.00 . A A . 24 LYS HG2 1 1
1 361 1 1 24 LYS HG3 H 8.941 3.053 -6.672 1.00 . A A . 24 LYS HG3 1 1
1 362 1 1 24 LYS HZ1 H 8.847 2.138 -10.196 1.00 . A A . 24 LYS HZ1 1 1
1 363 1 1 24 LYS HZ2 H 7.445 2.966 -10.677 1.00 . A A . 24 LYS HZ2 1 1
1 364 1 1 24 LYS HZ3 H 8.846 3.040 -11.634 1.00 . A A . 24 LYS HZ3 1 1
1 365 1 1 24 LYS N N 6.692 2.858 -5.882 1.00 . A A . 24 LYS N 1 1
1 366 1 1 24 LYS NZ N 8.484 2.995 -10.660 1.00 . A A . 24 LYS NZ 1 1
1 367 1 1 24 LYS O O 7.484 -0.259 -7.505 1.00 . A A . 24 LYS O 1 1
1 368 1 1 25 TRP C C 9.501 -0.950 -5.377 1.00 . A A . 25 TRP C 1 1
1 369 1 1 25 TRP CA C 8.074 -0.815 -4.869 1.00 . A A . 25 TRP CA 1 1
1 370 1 1 25 TRP CB C 7.283 -2.100 -5.288 1.00 . A A . 25 TRP CB 1 1
1 371 1 1 25 TRP CD1 C 4.852 -2.577 -5.887 1.00 . A A . 25 TRP CD1 1 1
1 372 1 1 25 TRP CD2 C 5.085 -1.580 -3.925 1.00 . A A . 25 TRP CD2 1 1
1 373 1 1 25 TRP CE2 C 3.717 -1.816 -4.076 1.00 . A A . 25 TRP CE2 1 1
1 374 1 1 25 TRP CE3 C 5.495 -0.968 -2.736 1.00 . A A . 25 TRP CE3 1 1
1 375 1 1 25 TRP CG C 5.734 -2.048 -5.024 1.00 . A A . 25 TRP CG 1 1
1 376 1 1 25 TRP CH2 C 3.241 -0.862 -1.954 1.00 . A A . 25 TRP CH2 1 1
1 377 1 1 25 TRP CZ2 C 2.814 -1.463 -3.106 1.00 . A A . 25 TRP CZ2 1 1
1 378 1 1 25 TRP CZ3 C 4.574 -0.615 -1.767 1.00 . A A . 25 TRP CZ3 1 1
1 379 1 1 25 TRP H H 7.272 1.182 -4.816 1.00 . A A . 25 TRP H 1 1
1 380 1 1 25 TRP HA H 8.139 -0.730 -3.803 1.00 . A A . 25 TRP HA 1 1
1 381 1 1 25 TRP HB2 H 7.440 -2.278 -6.341 1.00 . A A . 25 TRP HB2 1 1
1 382 1 1 25 TRP HB3 H 7.686 -2.942 -4.745 1.00 . A A . 25 TRP HB3 1 1
1 383 1 1 25 TRP HD1 H 5.054 -3.026 -6.848 1.00 . A A . 25 TRP HD1 1 1
1 384 1 1 25 TRP HE1 H 2.820 -2.742 -5.683 1.00 . A A . 25 TRP HE1 1 1
1 385 1 1 25 TRP HE3 H 6.511 -0.791 -2.552 1.00 . A A . 25 TRP HE3 1 1
1 386 1 1 25 TRP HH2 H 2.529 -0.586 -1.191 1.00 . A A . 25 TRP HH2 1 1
1 387 1 1 25 TRP HZ2 H 1.774 -1.694 -3.239 1.00 . A A . 25 TRP HZ2 1 1
1 388 1 1 25 TRP HZ3 H 4.910 -0.141 -0.857 1.00 . A A . 25 TRP HZ3 1 1
1 389 1 1 25 TRP N N 7.474 0.443 -5.412 1.00 . A A . 25 TRP N 1 1
1 390 1 1 25 TRP NE1 N 3.666 -2.423 -5.289 1.00 . A A . 25 TRP NE1 1 1
1 391 1 1 25 TRP O O 9.942 -2.021 -5.744 1.00 . A A . 25 TRP O 1 1
1 392 1 1 26 SER C C 12.494 -0.385 -4.734 1.00 . A A . 26 SER C 1 1
1 393 1 1 26 SER CA C 11.597 0.148 -5.856 1.00 . A A . 26 SER CA 1 1
1 394 1 1 26 SER CB C 11.983 1.599 -6.227 1.00 . A A . 26 SER CB 1 1
1 395 1 1 26 SER H H 9.786 0.981 -5.086 1.00 . A A . 26 SER H 1 1
1 396 1 1 26 SER HA H 11.676 -0.512 -6.720 1.00 . A A . 26 SER HA 1 1
1 397 1 1 26 SER HB2 H 11.093 2.220 -6.313 1.00 . A A . 26 SER HB2 1 1
1 398 1 1 26 SER HB3 H 12.669 2.022 -5.510 1.00 . A A . 26 SER HB3 1 1
1 399 1 1 26 SER HG H 13.486 1.101 -7.354 1.00 . A A . 26 SER HG 1 1
1 400 1 1 26 SER N N 10.194 0.154 -5.386 1.00 . A A . 26 SER N 1 1
1 401 1 1 26 SER O O 12.844 -1.548 -4.733 1.00 . A A . 26 SER O 1 1
1 402 1 1 26 SER OG O 12.613 1.475 -7.493 1.00 . A A . 26 SER OG 1 1
1 403 1 1 27 SER C C 14.236 1.045 -1.759 1.00 . A A . 27 SER C 1 1
1 404 1 1 27 SER CA C 13.722 -0.040 -2.690 1.00 . A A . 27 SER CA 1 1
1 405 1 1 27 SER CB C 14.914 -0.798 -3.290 1.00 . A A . 27 SER CB 1 1
1 406 1 1 27 SER H H 12.565 1.393 -3.819 1.00 . A A . 27 SER H 1 1
1 407 1 1 27 SER HA H 13.115 -0.698 -2.078 1.00 . A A . 27 SER HA 1 1
1 408 1 1 27 SER HB2 H 15.067 -0.519 -4.321 1.00 . A A . 27 SER HB2 1 1
1 409 1 1 27 SER HB3 H 15.810 -0.618 -2.713 1.00 . A A . 27 SER HB3 1 1
1 410 1 1 27 SER HG H 13.582 -2.205 -3.129 1.00 . A A . 27 SER HG 1 1
1 411 1 1 27 SER N N 12.856 0.459 -3.793 1.00 . A A . 27 SER N 1 1
1 412 1 1 27 SER O O 14.105 2.228 -2.003 1.00 . A A . 27 SER O 1 1
1 413 1 1 27 SER OG O 14.539 -2.164 -3.200 1.00 . A A . 27 SER OG 1 1
1 414 1 1 28 THR C C 16.539 2.324 -0.130 1.00 . A A . 28 THR C 1 1
1 415 1 1 28 THR CA C 15.382 1.474 0.331 1.00 . A A . 28 THR CA 1 1
1 416 1 1 28 THR CB C 15.927 0.603 1.461 1.00 . A A . 28 THR CB 1 1
1 417 1 1 28 THR CG2 C 17.136 1.293 2.134 1.00 . A A . 28 THR CG2 1 1
1 418 1 1 28 THR H H 14.892 -0.394 -0.575 1.00 . A A . 28 THR H 1 1
1 419 1 1 28 THR HA H 14.601 2.111 0.705 1.00 . A A . 28 THR HA 1 1
1 420 1 1 28 THR HB H 16.149 -0.405 1.126 1.00 . A A . 28 THR HB 1 1
1 421 1 1 28 THR HG1 H 14.623 -0.307 2.571 1.00 . A A . 28 THR HG1 1 1
1 422 1 1 28 THR HG21 H 16.842 2.291 2.453 1.00 . A A . 28 THR HG21 1 1
1 423 1 1 28 THR HG22 H 17.440 0.729 2.991 1.00 . A A . 28 THR HG22 1 1
1 424 1 1 28 THR HG23 H 17.991 1.366 1.425 1.00 . A A . 28 THR HG23 1 1
1 425 1 1 28 THR N N 14.821 0.576 -0.696 1.00 . A A . 28 THR N 1 1
1 426 1 1 28 THR O O 16.886 3.278 0.537 1.00 . A A . 28 THR O 1 1
1 427 1 1 28 THR OG1 O 14.919 0.598 2.453 1.00 . A A . 28 THR OG1 1 1
1 428 1 1 29 SER C C 17.646 4.314 -1.719 1.00 . A A . 29 SER C 1 1
1 429 1 1 29 SER CA C 18.200 2.975 -1.558 1.00 . A A . 29 SER CA 1 1
1 430 1 1 29 SER CB C 18.950 2.452 -2.753 1.00 . A A . 29 SER CB 1 1
1 431 1 1 29 SER H H 16.795 1.373 -1.853 1.00 . A A . 29 SER H 1 1
1 432 1 1 29 SER HA H 18.859 2.996 -0.683 1.00 . A A . 29 SER HA 1 1
1 433 1 1 29 SER HB2 H 19.247 3.248 -3.407 1.00 . A A . 29 SER HB2 1 1
1 434 1 1 29 SER HB3 H 19.810 1.901 -2.400 1.00 . A A . 29 SER HB3 1 1
1 435 1 1 29 SER HG H 18.554 0.882 -3.830 1.00 . A A . 29 SER HG 1 1
1 436 1 1 29 SER N N 17.094 2.087 -1.248 1.00 . A A . 29 SER N 1 1
1 437 1 1 29 SER O O 18.032 5.219 -1.005 1.00 . A A . 29 SER O 1 1
1 438 1 1 29 SER OG O 18.042 1.565 -3.390 1.00 . A A . 29 SER OG 1 1
1 439 1 1 30 PRO C C 15.270 5.719 -1.417 1.00 . A A . 30 PRO C 1 1
1 440 1 1 30 PRO CA C 16.076 5.737 -2.694 1.00 . A A . 30 PRO CA 1 1
1 441 1 1 30 PRO CB C 15.159 5.741 -3.932 1.00 . A A . 30 PRO CB 1 1
1 442 1 1 30 PRO CD C 16.333 3.570 -3.758 1.00 . A A . 30 PRO CD 1 1
1 443 1 1 30 PRO CG C 15.240 4.309 -4.539 1.00 . A A . 30 PRO CG 1 1
1 444 1 1 30 PRO HA H 16.795 6.510 -2.674 1.00 . A A . 30 PRO HA 1 1
1 445 1 1 30 PRO HB2 H 14.142 5.967 -3.640 1.00 . A A . 30 PRO HB2 1 1
1 446 1 1 30 PRO HB3 H 15.504 6.471 -4.649 1.00 . A A . 30 PRO HB3 1 1
1 447 1 1 30 PRO HD2 H 15.961 2.646 -3.348 1.00 . A A . 30 PRO HD2 1 1
1 448 1 1 30 PRO HD3 H 17.175 3.393 -4.401 1.00 . A A . 30 PRO HD3 1 1
1 449 1 1 30 PRO HG2 H 14.299 3.800 -4.426 1.00 . A A . 30 PRO HG2 1 1
1 450 1 1 30 PRO HG3 H 15.502 4.362 -5.586 1.00 . A A . 30 PRO HG3 1 1
1 451 1 1 30 PRO N N 16.697 4.508 -2.685 1.00 . A A . 30 PRO N 1 1
1 452 1 1 30 PRO O O 15.579 6.395 -0.457 1.00 . A A . 30 PRO O 1 1
1 453 1 1 31 HIS C C 12.229 3.783 -0.651 1.00 . A A . 31 HIS C 1 1
1 454 1 1 31 HIS CA C 13.353 4.733 -0.301 1.00 . A A . 31 HIS CA 1 1
1 455 1 1 31 HIS CB C 12.728 6.026 0.184 1.00 . A A . 31 HIS CB 1 1
1 456 1 1 31 HIS CD2 C 11.211 4.831 1.957 1.00 . A A . 31 HIS CD2 1 1
1 457 1 1 31 HIS CE1 C 12.143 5.571 3.646 1.00 . A A . 31 HIS CE1 1 1
1 458 1 1 31 HIS CG C 12.221 5.689 1.581 1.00 . A A . 31 HIS CG 1 1
1 459 1 1 31 HIS H H 14.103 4.397 -2.273 1.00 . A A . 31 HIS H 1 1
1 460 1 1 31 HIS HA H 13.927 4.281 0.504 1.00 . A A . 31 HIS HA 1 1
1 461 1 1 31 HIS HB2 H 13.453 6.817 0.235 1.00 . A A . 31 HIS HB2 1 1
1 462 1 1 31 HIS HB3 H 11.903 6.312 -0.451 1.00 . A A . 31 HIS HB3 1 1
1 463 1 1 31 HIS HD1 H 13.472 6.719 2.704 1.00 . A A . 31 HIS HD1 1 1
1 464 1 1 31 HIS HD2 H 10.595 4.277 1.290 1.00 . A A . 31 HIS HD2 1 1
1 465 1 1 31 HIS HE1 H 12.422 5.757 4.653 1.00 . A A . 31 HIS HE1 1 1
1 466 1 1 31 HIS N N 14.263 4.906 -1.456 1.00 . A A . 31 HIS N 1 1
1 467 1 1 31 HIS ND1 N 12.724 6.088 2.646 1.00 . A A . 31 HIS ND1 1 1
1 468 1 1 31 HIS NE2 N 11.162 4.758 3.300 1.00 . A A . 31 HIS NE2 1 1
1 469 1 1 31 HIS O O 11.436 4.075 -1.503 1.00 . A A . 31 HIS O 1 1
1 470 1 1 32 ARG C C 11.561 0.269 0.359 1.00 . A A . 32 ARG C 1 1
1 471 1 1 32 ARG CA C 11.114 1.649 -0.240 1.00 . A A . 32 ARG CA 1 1
1 472 1 1 32 ARG CB C 10.954 1.499 -1.787 1.00 . A A . 32 ARG CB 1 1
1 473 1 1 32 ARG CD C 10.056 3.102 -3.646 1.00 . A A . 32 ARG CD 1 1
1 474 1 1 32 ARG CG C 9.731 2.322 -2.322 1.00 . A A . 32 ARG CG 1 1
1 475 1 1 32 ARG CZ C 11.853 4.597 -4.248 1.00 . A A . 32 ARG CZ 1 1
1 476 1 1 32 ARG H H 12.854 2.482 0.711 1.00 . A A . 32 ARG H 1 1
1 477 1 1 32 ARG HA H 10.209 1.988 0.224 1.00 . A A . 32 ARG HA 1 1
1 478 1 1 32 ARG HB2 H 11.833 1.827 -2.243 1.00 . A A . 32 ARG HB2 1 1
1 479 1 1 32 ARG HB3 H 10.810 0.456 -2.027 1.00 . A A . 32 ARG HB3 1 1
1 480 1 1 32 ARG HD2 H 9.730 2.528 -4.484 1.00 . A A . 32 ARG HD2 1 1
1 481 1 1 32 ARG HD3 H 9.520 4.027 -3.645 1.00 . A A . 32 ARG HD3 1 1
1 482 1 1 32 ARG HE H 12.188 2.751 -3.591 1.00 . A A . 32 ARG HE 1 1
1 483 1 1 32 ARG HG2 H 8.923 1.640 -2.519 1.00 . A A . 32 ARG HG2 1 1
1 484 1 1 32 ARG HG3 H 9.415 3.023 -1.585 1.00 . A A . 32 ARG HG3 1 1
1 485 1 1 32 ARG HH11 H 11.368 5.526 -2.542 1.00 . A A . 32 ARG HH11 1 1
1 486 1 1 32 ARG HH12 H 11.989 6.543 -3.796 1.00 . A A . 32 ARG HH12 1 1
1 487 1 1 32 ARG HH21 H 12.396 3.882 -6.038 1.00 . A A . 32 ARG HH21 1 1
1 488 1 1 32 ARG HH22 H 12.584 5.591 -5.825 1.00 . A A . 32 ARG HH22 1 1
1 489 1 1 32 ARG N N 12.185 2.660 0.026 1.00 . A A . 32 ARG N 1 1
1 490 1 1 32 ARG NE N 11.506 3.417 -3.802 1.00 . A A . 32 ARG NE 1 1
1 491 1 1 32 ARG NH1 N 11.727 5.636 -3.467 1.00 . A A . 32 ARG NH1 1 1
1 492 1 1 32 ARG NH2 N 12.314 4.698 -5.465 1.00 . A A . 32 ARG NH2 1 1
1 493 1 1 32 ARG O O 12.677 -0.147 0.138 1.00 . A A . 32 ARG O 1 1
1 494 1 1 33 PRO C C 11.407 -2.789 0.651 1.00 . A A . 33 PRO C 1 1
1 495 1 1 33 PRO CA C 11.060 -1.726 1.710 1.00 . A A . 33 PRO CA 1 1
1 496 1 1 33 PRO CB C 9.803 -2.175 2.491 1.00 . A A . 33 PRO CB 1 1
1 497 1 1 33 PRO CD C 9.327 0.036 1.450 1.00 . A A . 33 PRO CD 1 1
1 498 1 1 33 PRO CG C 8.705 -1.098 2.275 1.00 . A A . 33 PRO CG 1 1
1 499 1 1 33 PRO HA H 11.902 -1.593 2.381 1.00 . A A . 33 PRO HA 1 1
1 500 1 1 33 PRO HB2 H 9.456 -3.127 2.122 1.00 . A A . 33 PRO HB2 1 1
1 501 1 1 33 PRO HB3 H 10.034 -2.258 3.542 1.00 . A A . 33 PRO HB3 1 1
1 502 1 1 33 PRO HD2 H 8.765 0.198 0.550 1.00 . A A . 33 PRO HD2 1 1
1 503 1 1 33 PRO HD3 H 9.367 0.941 2.039 1.00 . A A . 33 PRO HD3 1 1
1 504 1 1 33 PRO HG2 H 7.869 -1.525 1.741 1.00 . A A . 33 PRO HG2 1 1
1 505 1 1 33 PRO HG3 H 8.369 -0.718 3.228 1.00 . A A . 33 PRO HG3 1 1
1 506 1 1 33 PRO N N 10.691 -0.421 1.119 1.00 . A A . 33 PRO N 1 1
1 507 1 1 33 PRO O O 11.671 -2.475 -0.493 1.00 . A A . 33 PRO O 1 1
1 508 1 1 34 ARG C C 10.522 -6.120 0.136 1.00 . A A . 34 ARG C 1 1
1 509 1 1 34 ARG CA C 11.708 -5.167 0.166 1.00 . A A . 34 ARG CA 1 1
1 510 1 1 34 ARG CB C 12.942 -5.918 0.702 1.00 . A A . 34 ARG CB 1 1
1 511 1 1 34 ARG CD C 13.090 -4.860 3.000 1.00 . A A . 34 ARG CD 1 1
1 512 1 1 34 ARG CG C 12.785 -6.152 2.216 1.00 . A A . 34 ARG CG 1 1
1 513 1 1 34 ARG CZ C 14.221 -4.439 5.093 1.00 . A A . 34 ARG CZ 1 1
1 514 1 1 34 ARG H H 11.153 -4.221 2.007 1.00 . A A . 34 ARG H 1 1
1 515 1 1 34 ARG HA H 11.884 -4.783 -0.838 1.00 . A A . 34 ARG HA 1 1
1 516 1 1 34 ARG HB2 H 13.023 -6.871 0.201 1.00 . A A . 34 ARG HB2 1 1
1 517 1 1 34 ARG HB3 H 13.836 -5.345 0.503 1.00 . A A . 34 ARG HB3 1 1
1 518 1 1 34 ARG HD2 H 13.425 -4.081 2.335 1.00 . A A . 34 ARG HD2 1 1
1 519 1 1 34 ARG HD3 H 12.201 -4.529 3.517 1.00 . A A . 34 ARG HD3 1 1
1 520 1 1 34 ARG HE H 14.812 -5.858 3.831 1.00 . A A . 34 ARG HE 1 1
1 521 1 1 34 ARG HG2 H 11.773 -6.468 2.426 1.00 . A A . 34 ARG HG2 1 1
1 522 1 1 34 ARG HG3 H 13.465 -6.930 2.530 1.00 . A A . 34 ARG HG3 1 1
1 523 1 1 34 ARG HH11 H 12.284 -4.718 5.517 1.00 . A A . 34 ARG HH11 1 1
1 524 1 1 34 ARG HH12 H 13.169 -3.754 6.652 1.00 . A A . 34 ARG HH12 1 1
1 525 1 1 34 ARG HH21 H 16.169 -4.037 4.861 1.00 . A A . 34 ARG HH21 1 1
1 526 1 1 34 ARG HH22 H 15.426 -3.359 6.271 1.00 . A A . 34 ARG HH22 1 1
1 527 1 1 34 ARG N N 11.393 -4.035 1.081 1.00 . A A . 34 ARG N 1 1
1 528 1 1 34 ARG NE N 14.160 -5.146 3.997 1.00 . A A . 34 ARG NE 1 1
1 529 1 1 34 ARG NH1 N 13.141 -4.292 5.810 1.00 . A A . 34 ARG NH1 1 1
1 530 1 1 34 ARG NH2 N 15.361 -3.903 5.435 1.00 . A A . 34 ARG NH2 1 1
1 531 1 1 34 ARG O O 10.656 -7.318 0.290 1.00 . A A . 34 ARG O 1 1
1 532 1 1 35 PHE C C 7.937 -7.026 -1.463 1.00 . A A . 35 PHE C 1 1
1 533 1 1 35 PHE CA C 8.114 -6.309 -0.122 1.00 . A A . 35 PHE CA 1 1
1 534 1 1 35 PHE CB C 7.008 -5.256 -0.001 1.00 . A A . 35 PHE CB 1 1
1 535 1 1 35 PHE CD1 C 4.989 -6.768 -0.242 1.00 . A A . 35 PHE CD1 1 1
1 536 1 1 35 PHE CD2 C 5.170 -5.420 1.716 1.00 . A A . 35 PHE CD2 1 1
1 537 1 1 35 PHE CE1 C 3.770 -7.225 0.188 1.00 . A A . 35 PHE CE1 1 1
1 538 1 1 35 PHE CE2 C 3.949 -5.878 2.141 1.00 . A A . 35 PHE CE2 1 1
1 539 1 1 35 PHE CG C 5.703 -5.856 0.517 1.00 . A A . 35 PHE CG 1 1
1 540 1 1 35 PHE CZ C 3.244 -6.775 1.379 1.00 . A A . 35 PHE CZ 1 1
1 541 1 1 35 PHE H H 9.366 -4.564 -0.162 1.00 . A A . 35 PHE H 1 1
1 542 1 1 35 PHE HA H 8.066 -7.034 0.699 1.00 . A A . 35 PHE HA 1 1
1 543 1 1 35 PHE HB2 H 7.330 -4.478 0.674 1.00 . A A . 35 PHE HB2 1 1
1 544 1 1 35 PHE HB3 H 6.827 -4.818 -0.972 1.00 . A A . 35 PHE HB3 1 1
1 545 1 1 35 PHE HD1 H 5.376 -7.106 -1.182 1.00 . A A . 35 PHE HD1 1 1
1 546 1 1 35 PHE HD2 H 5.717 -4.716 2.324 1.00 . A A . 35 PHE HD2 1 1
1 547 1 1 35 PHE HE1 H 3.237 -7.953 -0.401 1.00 . A A . 35 PHE HE1 1 1
1 548 1 1 35 PHE HE2 H 3.538 -5.523 3.072 1.00 . A A . 35 PHE HE2 1 1
1 549 1 1 35 PHE HZ H 2.251 -7.068 1.679 1.00 . A A . 35 PHE HZ 1 1
1 550 1 1 35 PHE N N 9.388 -5.539 -0.064 1.00 . A A . 35 PHE N 1 1
1 551 1 1 35 PHE O O 8.247 -6.480 -2.501 1.00 . A A . 35 PHE O 1 1
1 552 1 1 36 SER C C 7.110 -10.629 -2.433 1.00 . A A . 36 SER C 1 1
1 553 1 1 36 SER CA C 7.183 -9.067 -2.625 1.00 . A A . 36 SER CA 1 1
1 554 1 1 36 SER CB C 8.294 -8.786 -3.654 1.00 . A A . 36 SER CB 1 1
1 555 1 1 36 SER H H 7.166 -8.583 -0.529 1.00 . A A . 36 SER H 1 1
1 556 1 1 36 SER HA H 6.238 -8.764 -3.013 1.00 . A A . 36 SER HA 1 1
1 557 1 1 36 SER HB2 H 9.214 -8.499 -3.166 1.00 . A A . 36 SER HB2 1 1
1 558 1 1 36 SER HB3 H 8.458 -9.650 -4.280 1.00 . A A . 36 SER HB3 1 1
1 559 1 1 36 SER HG H 8.531 -7.272 -4.854 1.00 . A A . 36 SER HG 1 1
1 560 1 1 36 SER N N 7.418 -8.240 -1.388 1.00 . A A . 36 SER N 1 1
1 561 1 1 36 SER O O 6.811 -11.322 -3.385 1.00 . A A . 36 SER O 1 1
1 562 1 1 36 SER OG O 7.787 -7.711 -4.434 1.00 . A A . 36 SER OG 1 1
1 563 1 1 37 PRO C C 5.918 -13.199 -1.378 1.00 . A A . 37 PRO C 1 1
1 564 1 1 37 PRO CA C 7.307 -12.630 -1.056 1.00 . A A . 37 PRO CA 1 1
1 565 1 1 37 PRO CB C 7.635 -12.833 0.428 1.00 . A A . 37 PRO CB 1 1
1 566 1 1 37 PRO CD C 7.746 -10.418 -0.057 1.00 . A A . 37 PRO CD 1 1
1 567 1 1 37 PRO CG C 8.106 -11.457 0.970 1.00 . A A . 37 PRO CG 1 1
1 568 1 1 37 PRO HA H 8.051 -13.109 -1.686 1.00 . A A . 37 PRO HA 1 1
1 569 1 1 37 PRO HB2 H 6.756 -13.160 0.961 1.00 . A A . 37 PRO HB2 1 1
1 570 1 1 37 PRO HB3 H 8.421 -13.565 0.539 1.00 . A A . 37 PRO HB3 1 1
1 571 1 1 37 PRO HD2 H 6.909 -9.840 0.297 1.00 . A A . 37 PRO HD2 1 1
1 572 1 1 37 PRO HD3 H 8.597 -9.790 -0.259 1.00 . A A . 37 PRO HD3 1 1
1 573 1 1 37 PRO HG2 H 7.618 -11.226 1.890 1.00 . A A . 37 PRO HG2 1 1
1 574 1 1 37 PRO HG3 H 9.165 -11.459 1.110 1.00 . A A . 37 PRO HG3 1 1
1 575 1 1 37 PRO N N 7.371 -11.170 -1.248 1.00 . A A . 37 PRO N 1 1
1 576 1 1 37 PRO O O 4.923 -12.505 -1.302 1.00 . A A . 37 PRO O 1 1
1 577 1 1 38 ALA C C 3.925 -15.771 -0.854 1.00 . A A . 38 ALA C 1 1
1 578 1 1 38 ALA CA C 4.587 -15.116 -2.071 1.00 . A A . 38 ALA CA 1 1
1 579 1 1 38 ALA CB C 4.865 -16.207 -3.108 1.00 . A A . 38 ALA CB 1 1
1 580 1 1 38 ALA H H 6.720 -14.979 -1.778 1.00 . A A . 38 ALA H 1 1
1 581 1 1 38 ALA HA H 3.913 -14.367 -2.477 1.00 . A A . 38 ALA HA 1 1
1 582 1 1 38 ALA HB1 H 5.424 -15.792 -3.934 1.00 . A A . 38 ALA HB1 1 1
1 583 1 1 38 ALA HB2 H 5.440 -17.000 -2.653 1.00 . A A . 38 ALA HB2 1 1
1 584 1 1 38 ALA HB3 H 3.933 -16.609 -3.475 1.00 . A A . 38 ALA HB3 1 1
1 585 1 1 38 ALA N N 5.888 -14.464 -1.734 1.00 . A A . 38 ALA N 1 1
1 586 1 1 38 ALA O O 2.807 -16.241 -0.939 1.00 . A A . 38 ALA O 1 1
1 587 1 1 39 THR C C 3.042 -15.458 2.109 1.00 . A A . 39 THR C 1 1
1 588 1 1 39 THR CA C 4.028 -16.414 1.459 1.00 . A A . 39 THR CA 1 1
1 589 1 1 39 THR CB C 5.155 -16.716 2.451 1.00 . A A . 39 THR CB 1 1
1 590 1 1 39 THR CG2 C 5.640 -15.431 3.135 1.00 . A A . 39 THR CG2 1 1
1 591 1 1 39 THR H H 5.496 -15.415 0.280 1.00 . A A . 39 THR H 1 1
1 592 1 1 39 THR HA H 3.514 -17.315 1.169 1.00 . A A . 39 THR HA 1 1
1 593 1 1 39 THR HB H 5.961 -17.278 1.987 1.00 . A A . 39 THR HB 1 1
1 594 1 1 39 THR HG1 H 3.665 -17.117 3.626 1.00 . A A . 39 THR HG1 1 1
1 595 1 1 39 THR HG21 H 5.650 -14.621 2.423 1.00 . A A . 39 THR HG21 1 1
1 596 1 1 39 THR HG22 H 4.979 -15.180 3.950 1.00 . A A . 39 THR HG22 1 1
1 597 1 1 39 THR HG23 H 6.639 -15.578 3.520 1.00 . A A . 39 THR HG23 1 1
1 598 1 1 39 THR N N 4.615 -15.794 0.250 1.00 . A A . 39 THR N 1 1
1 599 1 1 39 THR O O 2.747 -15.550 3.284 1.00 . A A . 39 THR O 1 1
1 600 1 1 39 THR OG1 O 4.550 -17.464 3.487 1.00 . A A . 39 THR OG1 1 1
1 601 1 1 40 HIS C C 0.152 -13.901 1.318 1.00 . A A . 40 HIS C 1 1
1 602 1 1 40 HIS CA C 1.584 -13.560 1.803 1.00 . A A . 40 HIS CA 1 1
1 603 1 1 40 HIS CB C 2.022 -12.232 1.193 1.00 . A A . 40 HIS CB 1 1
1 604 1 1 40 HIS CD2 C 3.684 -10.540 2.331 1.00 . A A . 40 HIS CD2 1 1
1 605 1 1 40 HIS CE1 C 5.187 -11.897 2.788 1.00 . A A . 40 HIS CE1 1 1
1 606 1 1 40 HIS CG C 3.307 -11.785 1.897 1.00 . A A . 40 HIS CG 1 1
1 607 1 1 40 HIS H H 2.842 -14.539 0.378 1.00 . A A . 40 HIS H 1 1
1 608 1 1 40 HIS HA H 1.626 -13.519 2.884 1.00 . A A . 40 HIS HA 1 1
1 609 1 1 40 HIS HB2 H 2.223 -12.362 0.141 1.00 . A A . 40 HIS HB2 1 1
1 610 1 1 40 HIS HB3 H 1.256 -11.491 1.318 1.00 . A A . 40 HIS HB3 1 1
1 611 1 1 40 HIS HD1 H 4.283 -13.504 2.023 1.00 . A A . 40 HIS HD1 1 1
1 612 1 1 40 HIS HD2 H 3.105 -9.662 2.229 1.00 . A A . 40 HIS HD2 1 1
1 613 1 1 40 HIS HE1 H 6.098 -12.343 3.144 1.00 . A A . 40 HIS HE1 1 1
1 614 1 1 40 HIS N N 2.556 -14.560 1.312 1.00 . A A . 40 HIS N 1 1
1 615 1 1 40 HIS ND1 N 4.258 -12.541 2.206 1.00 . A A . 40 HIS ND1 1 1
1 616 1 1 40 HIS NE2 N 4.904 -10.609 2.910 1.00 . A A . 40 HIS NE2 1 1
1 617 1 1 40 HIS O O -0.008 -14.525 0.287 1.00 . A A . 40 HIS O 1 1
1 618 1 1 41 PRO C C -2.452 -13.534 0.196 1.00 . A A . 41 PRO C 1 1
1 619 1 1 41 PRO CA C -2.254 -13.764 1.682 1.00 . A A . 41 PRO CA 1 1
1 620 1 1 41 PRO CB C -3.072 -12.741 2.488 1.00 . A A . 41 PRO CB 1 1
1 621 1 1 41 PRO CD C -0.745 -12.704 3.310 1.00 . A A . 41 PRO CD 1 1
1 622 1 1 41 PRO CG C -2.172 -12.267 3.654 1.00 . A A . 41 PRO CG 1 1
1 623 1 1 41 PRO HA H -2.519 -14.782 1.946 1.00 . A A . 41 PRO HA 1 1
1 624 1 1 41 PRO HB2 H -3.318 -11.897 1.861 1.00 . A A . 41 PRO HB2 1 1
1 625 1 1 41 PRO HB3 H -3.970 -13.193 2.868 1.00 . A A . 41 PRO HB3 1 1
1 626 1 1 41 PRO HD2 H -0.133 -11.867 3.144 1.00 . A A . 41 PRO HD2 1 1
1 627 1 1 41 PRO HD3 H -0.336 -13.320 4.096 1.00 . A A . 41 PRO HD3 1 1
1 628 1 1 41 PRO HG2 H -2.219 -11.192 3.747 1.00 . A A . 41 PRO HG2 1 1
1 629 1 1 41 PRO HG3 H -2.488 -12.726 4.579 1.00 . A A . 41 PRO HG3 1 1
1 630 1 1 41 PRO N N -0.877 -13.486 2.068 1.00 . A A . 41 PRO N 1 1
1 631 1 1 41 PRO O O -3.003 -14.362 -0.503 1.00 . A A . 41 PRO O 1 1
1 632 1 1 42 SER C C -0.878 -11.354 -2.143 1.00 . A A . 42 SER C 1 1
1 633 1 1 42 SER CA C -2.130 -12.071 -1.680 1.00 . A A . 42 SER CA 1 1
1 634 1 1 42 SER CB C -3.337 -11.137 -1.852 1.00 . A A . 42 SER CB 1 1
1 635 1 1 42 SER H H -1.563 -11.777 0.361 1.00 . A A . 42 SER H 1 1
1 636 1 1 42 SER HA H -2.254 -12.986 -2.256 1.00 . A A . 42 SER HA 1 1
1 637 1 1 42 SER HB2 H -4.091 -11.344 -1.107 1.00 . A A . 42 SER HB2 1 1
1 638 1 1 42 SER HB3 H -3.031 -10.102 -1.802 1.00 . A A . 42 SER HB3 1 1
1 639 1 1 42 SER HG H -4.738 -11.133 -3.200 1.00 . A A . 42 SER HG 1 1
1 640 1 1 42 SER N N -1.997 -12.407 -0.251 1.00 . A A . 42 SER N 1 1
1 641 1 1 42 SER O O 0.197 -11.597 -1.633 1.00 . A A . 42 SER O 1 1
1 642 1 1 42 SER OG O -3.831 -11.442 -3.148 1.00 . A A . 42 SER OG 1 1
1 643 1 1 43 GLU C C -0.250 -8.745 -4.637 1.00 . A A . 43 GLU C 1 1
1 644 1 1 43 GLU CA C 0.154 -9.750 -3.589 1.00 . A A . 43 GLU CA 1 1
1 645 1 1 43 GLU CB C 1.139 -10.752 -4.215 1.00 . A A . 43 GLU CB 1 1
1 646 1 1 43 GLU CD C 0.039 -12.992 -4.321 1.00 . A A . 43 GLU CD 1 1
1 647 1 1 43 GLU CG C 0.366 -11.723 -5.111 1.00 . A A . 43 GLU CG 1 1
1 648 1 1 43 GLU H H -1.915 -10.319 -3.476 1.00 . A A . 43 GLU H 1 1
1 649 1 1 43 GLU HA H 0.610 -9.218 -2.757 1.00 . A A . 43 GLU HA 1 1
1 650 1 1 43 GLU HB2 H 1.870 -10.220 -4.805 1.00 . A A . 43 GLU HB2 1 1
1 651 1 1 43 GLU HB3 H 1.647 -11.300 -3.438 1.00 . A A . 43 GLU HB3 1 1
1 652 1 1 43 GLU HG2 H -0.553 -11.262 -5.442 1.00 . A A . 43 GLU HG2 1 1
1 653 1 1 43 GLU HG3 H 0.965 -11.983 -5.971 1.00 . A A . 43 GLU HG3 1 1
1 654 1 1 43 GLU N N -1.029 -10.486 -3.093 1.00 . A A . 43 GLU N 1 1
1 655 1 1 43 GLU O O 0.330 -8.682 -5.702 1.00 . A A . 43 GLU O 1 1
1 656 1 1 43 GLU OE1 O 0.978 -13.546 -3.774 1.00 . A A . 43 GLU OE1 1 1
1 657 1 1 43 GLU OE2 O -1.132 -13.335 -4.309 1.00 . A A . 43 GLU OE2 1 1
1 658 1 1 44 GLY C C -0.719 -5.782 -5.299 1.00 . A A . 44 GLY C 1 1
1 659 1 1 44 GLY CA C -1.692 -6.962 -5.291 1.00 . A A . 44 GLY CA 1 1
1 660 1 1 44 GLY H H -1.680 -8.057 -3.449 1.00 . A A . 44 GLY H 1 1
1 661 1 1 44 GLY HA2 H -1.721 -7.405 -6.276 1.00 . A A . 44 GLY HA2 1 1
1 662 1 1 44 GLY HA3 H -2.674 -6.627 -5.029 1.00 . A A . 44 GLY HA3 1 1
1 663 1 1 44 GLY N N -1.239 -7.972 -4.320 1.00 . A A . 44 GLY N 1 1
1 664 1 1 44 GLY O O -1.083 -4.674 -5.636 1.00 . A A . 44 GLY O 1 1
1 665 1 1 45 LEU C C 1.985 -4.714 -6.296 1.00 . A A . 45 LEU C 1 1
1 666 1 1 45 LEU CA C 1.523 -4.998 -4.886 1.00 . A A . 45 LEU CA 1 1
1 667 1 1 45 LEU CB C 2.719 -5.527 -4.067 1.00 . A A . 45 LEU CB 1 1
1 668 1 1 45 LEU CD1 C 3.695 -4.706 -1.975 1.00 . A A . 45 LEU CD1 1 1
1 669 1 1 45 LEU CD2 C 1.197 -4.742 -2.097 1.00 . A A . 45 LEU CD2 1 1
1 670 1 1 45 LEU CG C 2.502 -5.458 -2.519 1.00 . A A . 45 LEU CG 1 1
1 671 1 1 45 LEU H H 0.742 -6.944 -4.611 1.00 . A A . 45 LEU H 1 1
1 672 1 1 45 LEU HA H 1.121 -4.100 -4.480 1.00 . A A . 45 LEU HA 1 1
1 673 1 1 45 LEU HB2 H 2.909 -6.553 -4.344 1.00 . A A . 45 LEU HB2 1 1
1 674 1 1 45 LEU HB3 H 3.593 -4.944 -4.315 1.00 . A A . 45 LEU HB3 1 1
1 675 1 1 45 LEU HD11 H 4.602 -5.195 -2.289 1.00 . A A . 45 LEU HD11 1 1
1 676 1 1 45 LEU HD12 H 3.684 -3.719 -2.358 1.00 . A A . 45 LEU HD12 1 1
1 677 1 1 45 LEU HD13 H 3.664 -4.674 -0.921 1.00 . A A . 45 LEU HD13 1 1
1 678 1 1 45 LEU HD21 H 0.355 -5.135 -2.644 1.00 . A A . 45 LEU HD21 1 1
1 679 1 1 45 LEU HD22 H 1.020 -4.903 -1.062 1.00 . A A . 45 LEU HD22 1 1
1 680 1 1 45 LEU HD23 H 1.287 -3.686 -2.269 1.00 . A A . 45 LEU HD23 1 1
1 681 1 1 45 LEU HG H 2.494 -6.443 -2.104 1.00 . A A . 45 LEU HG 1 1
1 682 1 1 45 LEU N N 0.507 -6.053 -4.913 1.00 . A A . 45 LEU N 1 1
1 683 1 1 45 LEU O O 3.129 -4.927 -6.646 1.00 . A A . 45 LEU O 1 1
1 684 1 1 46 GLU C C 2.088 -2.579 -8.553 1.00 . A A . 46 GLU C 1 1
1 685 1 1 46 GLU CA C 1.380 -3.916 -8.466 1.00 . A A . 46 GLU CA 1 1
1 686 1 1 46 GLU CB C 0.033 -3.887 -9.265 1.00 . A A . 46 GLU CB 1 1
1 687 1 1 46 GLU CD C -1.357 -2.695 -10.973 1.00 . A A . 46 GLU CD 1 1
1 688 1 1 46 GLU CG C -0.201 -2.531 -9.985 1.00 . A A . 46 GLU CG 1 1
1 689 1 1 46 GLU H H 0.172 -4.088 -6.749 1.00 . A A . 46 GLU H 1 1
1 690 1 1 46 GLU HA H 2.031 -4.684 -8.848 1.00 . A A . 46 GLU HA 1 1
1 691 1 1 46 GLU HB2 H 0.041 -4.679 -9.998 1.00 . A A . 46 GLU HB2 1 1
1 692 1 1 46 GLU HB3 H -0.784 -4.062 -8.579 1.00 . A A . 46 GLU HB3 1 1
1 693 1 1 46 GLU HG2 H -0.467 -1.771 -9.267 1.00 . A A . 46 GLU HG2 1 1
1 694 1 1 46 GLU HG3 H 0.679 -2.223 -10.531 1.00 . A A . 46 GLU HG3 1 1
1 695 1 1 46 GLU N N 1.065 -4.233 -7.081 1.00 . A A . 46 GLU N 1 1
1 696 1 1 46 GLU O O 1.524 -1.565 -8.241 1.00 . A A . 46 GLU O 1 1
1 697 1 1 46 GLU OE1 O -2.482 -2.575 -10.515 1.00 . A A . 46 GLU OE1 1 1
1 698 1 1 46 GLU OE2 O -1.051 -2.929 -12.131 1.00 . A A . 46 GLU OE2 1 1
1 699 1 1 47 GLU C C 3.996 -0.429 -7.893 1.00 . A A . 47 GLU C 1 1
1 700 1 1 47 GLU CA C 4.117 -1.372 -9.087 1.00 . A A . 47 GLU CA 1 1
1 701 1 1 47 GLU CB C 3.602 -0.628 -10.325 1.00 . A A . 47 GLU CB 1 1
1 702 1 1 47 GLU CD C 5.785 -0.553 -11.532 1.00 . A A . 47 GLU CD 1 1
1 703 1 1 47 GLU CG C 4.363 -1.118 -11.558 1.00 . A A . 47 GLU CG 1 1
1 704 1 1 47 GLU H H 3.731 -3.485 -9.182 1.00 . A A . 47 GLU H 1 1
1 705 1 1 47 GLU HA H 5.150 -1.630 -9.214 1.00 . A A . 47 GLU HA 1 1
1 706 1 1 47 GLU HB2 H 2.544 -0.818 -10.448 1.00 . A A . 47 GLU HB2 1 1
1 707 1 1 47 GLU HB3 H 3.757 0.433 -10.200 1.00 . A A . 47 GLU HB3 1 1
1 708 1 1 47 GLU HG2 H 4.408 -2.197 -11.556 1.00 . A A . 47 GLU HG2 1 1
1 709 1 1 47 GLU HG3 H 3.862 -0.783 -12.454 1.00 . A A . 47 GLU HG3 1 1
1 710 1 1 47 GLU N N 3.322 -2.622 -8.958 1.00 . A A . 47 GLU N 1 1
1 711 1 1 47 GLU O O 4.879 -0.333 -7.085 1.00 . A A . 47 GLU O 1 1
1 712 1 1 47 GLU OE1 O 5.889 0.657 -11.651 1.00 . A A . 47 GLU OE1 1 1
1 713 1 1 47 GLU OE2 O 6.687 -1.363 -11.395 1.00 . A A . 47 GLU OE2 1 1
1 714 1 1 48 ASN C C 1.255 0.953 -6.124 1.00 . A A . 48 ASN C 1 1
1 715 1 1 48 ASN CA C 2.645 1.188 -6.712 1.00 . A A . 48 ASN CA 1 1
1 716 1 1 48 ASN CB C 2.650 2.581 -7.371 1.00 . A A . 48 ASN CB 1 1
1 717 1 1 48 ASN CG C 1.640 2.590 -8.523 1.00 . A A . 48 ASN CG 1 1
1 718 1 1 48 ASN H H 2.202 0.066 -8.482 1.00 . A A . 48 ASN H 1 1
1 719 1 1 48 ASN HA H 3.426 1.092 -5.932 1.00 . A A . 48 ASN HA 1 1
1 720 1 1 48 ASN HB2 H 2.387 3.334 -6.648 1.00 . A A . 48 ASN HB2 1 1
1 721 1 1 48 ASN HB3 H 3.620 2.797 -7.774 1.00 . A A . 48 ASN HB3 1 1
1 722 1 1 48 ASN HD21 H 2.061 4.464 -9.043 1.00 . A A . 48 ASN HD21 1 1
1 723 1 1 48 ASN HD22 H 0.865 3.690 -9.989 1.00 . A A . 48 ASN HD22 1 1
1 724 1 1 48 ASN N N 2.894 0.228 -7.820 1.00 . A A . 48 ASN N 1 1
1 725 1 1 48 ASN ND2 N 1.512 3.670 -9.244 1.00 . A A . 48 ASN ND2 1 1
1 726 1 1 48 ASN O O 0.322 1.644 -6.487 1.00 . A A . 48 ASN O 1 1
1 727 1 1 48 ASN OD1 O 0.960 1.615 -8.775 1.00 . A A . 48 ASN OD1 1 1
1 728 1 1 49 TYR C C -0.313 -0.260 -3.120 1.00 . A A . 49 TYR C 1 1
1 729 1 1 49 TYR CA C -0.194 -0.264 -4.632 1.00 . A A . 49 TYR CA 1 1
1 730 1 1 49 TYR CB C -0.514 -1.697 -5.033 1.00 . A A . 49 TYR CB 1 1
1 731 1 1 49 TYR CD1 C -1.647 -0.860 -7.083 1.00 . A A . 49 TYR CD1 1 1
1 732 1 1 49 TYR CD2 C -2.818 -2.398 -5.717 1.00 . A A . 49 TYR CD2 1 1
1 733 1 1 49 TYR CE1 C -2.732 -0.778 -7.930 1.00 . A A . 49 TYR CE1 1 1
1 734 1 1 49 TYR CE2 C -3.909 -2.324 -6.559 1.00 . A A . 49 TYR CE2 1 1
1 735 1 1 49 TYR CG C -1.691 -1.667 -5.976 1.00 . A A . 49 TYR CG 1 1
1 736 1 1 49 TYR CZ C -3.876 -1.513 -7.671 1.00 . A A . 49 TYR CZ 1 1
1 737 1 1 49 TYR H H 1.877 -0.540 -4.986 1.00 . A A . 49 TYR H 1 1
1 738 1 1 49 TYR HA H -0.903 0.417 -5.045 1.00 . A A . 49 TYR HA 1 1
1 739 1 1 49 TYR HB2 H 0.337 -2.136 -5.529 1.00 . A A . 49 TYR HB2 1 1
1 740 1 1 49 TYR HB3 H -0.737 -2.292 -4.136 1.00 . A A . 49 TYR HB3 1 1
1 741 1 1 49 TYR HD1 H -0.739 -0.275 -7.280 1.00 . A A . 49 TYR HD1 1 1
1 742 1 1 49 TYR HD2 H -2.848 -3.032 -4.850 1.00 . A A . 49 TYR HD2 1 1
1 743 1 1 49 TYR HE1 H -2.688 -0.138 -8.799 1.00 . A A . 49 TYR HE1 1 1
1 744 1 1 49 TYR HE2 H -4.796 -2.898 -6.343 1.00 . A A . 49 TYR HE2 1 1
1 745 1 1 49 TYR HH H -4.638 -1.411 -9.418 1.00 . A A . 49 TYR HH 1 1
1 746 1 1 49 TYR N N 1.134 0.003 -5.222 1.00 . A A . 49 TYR N 1 1
1 747 1 1 49 TYR O O 0.606 0.019 -2.391 1.00 . A A . 49 TYR O 1 1
1 748 1 1 49 TYR OH O -4.964 -1.435 -8.515 1.00 . A A . 49 TYR OH 1 1
1 749 1 1 50 CYS C C -2.799 -1.770 -1.090 1.00 . A A . 50 CYS C 1 1
1 750 1 1 50 CYS CA C -1.860 -0.630 -1.280 1.00 . A A . 50 CYS CA 1 1
1 751 1 1 50 CYS CB C -2.583 0.614 -0.819 1.00 . A A . 50 CYS CB 1 1
1 752 1 1 50 CYS H H -2.244 -0.722 -3.374 1.00 . A A . 50 CYS H 1 1
1 753 1 1 50 CYS HA H -0.961 -0.833 -0.704 1.00 . A A . 50 CYS HA 1 1
1 754 1 1 50 CYS HB2 H -3.608 0.534 -1.143 1.00 . A A . 50 CYS HB2 1 1
1 755 1 1 50 CYS HB3 H -2.580 0.604 0.260 1.00 . A A . 50 CYS HB3 1 1
1 756 1 1 50 CYS N N -1.529 -0.566 -2.708 1.00 . A A . 50 CYS N 1 1
1 757 1 1 50 CYS O O -3.933 -1.729 -1.529 1.00 . A A . 50 CYS O 1 1
1 758 1 1 50 CYS SG S -1.989 2.221 -1.346 1.00 . A A . 50 CYS SG 1 1
1 759 1 1 51 ARG C C -2.913 -4.461 1.213 1.00 . A A . 51 ARG C 1 1
1 760 1 1 51 ARG CA C -3.188 -3.937 -0.185 1.00 . A A . 51 ARG CA 1 1
1 761 1 1 51 ARG CB C -2.817 -5.007 -1.260 1.00 . A A . 51 ARG CB 1 1
1 762 1 1 51 ARG CD C -4.939 -5.264 -2.587 1.00 . A A . 51 ARG CD 1 1
1 763 1 1 51 ARG CG C -3.516 -4.680 -2.584 1.00 . A A . 51 ARG CG 1 1
1 764 1 1 51 ARG CZ C -5.482 -5.431 -4.940 1.00 . A A . 51 ARG CZ 1 1
1 765 1 1 51 ARG H H -1.406 -2.695 -0.041 1.00 . A A . 51 ARG H 1 1
1 766 1 1 51 ARG HA H -4.228 -3.651 -0.260 1.00 . A A . 51 ARG HA 1 1
1 767 1 1 51 ARG HB2 H -1.740 -5.004 -1.420 1.00 . A A . 51 ARG HB2 1 1
1 768 1 1 51 ARG HB3 H -3.126 -5.982 -0.941 1.00 . A A . 51 ARG HB3 1 1
1 769 1 1 51 ARG HD2 H -4.892 -6.343 -2.594 1.00 . A A . 51 ARG HD2 1 1
1 770 1 1 51 ARG HD3 H -5.477 -4.937 -1.713 1.00 . A A . 51 ARG HD3 1 1
1 771 1 1 51 ARG HE H -6.243 -4.013 -3.768 1.00 . A A . 51 ARG HE 1 1
1 772 1 1 51 ARG HG2 H -3.566 -3.624 -2.717 1.00 . A A . 51 ARG HG2 1 1
1 773 1 1 51 ARG HG3 H -2.954 -5.100 -3.391 1.00 . A A . 51 ARG HG3 1 1
1 774 1 1 51 ARG HH11 H -3.778 -4.477 -5.358 1.00 . A A . 51 ARG HH11 1 1
1 775 1 1 51 ARG HH12 H -4.292 -5.639 -6.532 1.00 . A A . 51 ARG HH12 1 1
1 776 1 1 51 ARG HH21 H -7.157 -6.495 -4.729 1.00 . A A . 51 ARG HH21 1 1
1 777 1 1 51 ARG HH22 H -6.251 -6.810 -6.167 1.00 . A A . 51 ARG HH22 1 1
1 778 1 1 51 ARG N N -2.332 -2.751 -0.425 1.00 . A A . 51 ARG N 1 1
1 779 1 1 51 ARG NE N -5.652 -4.794 -3.811 1.00 . A A . 51 ARG NE 1 1
1 780 1 1 51 ARG NH1 N -4.436 -5.161 -5.666 1.00 . A A . 51 ARG NH1 1 1
1 781 1 1 51 ARG NH2 N -6.366 -6.314 -5.306 1.00 . A A . 51 ARG NH2 1 1
1 782 1 1 51 ARG O O -2.583 -3.685 2.087 1.00 . A A . 51 ARG O 1 1
1 783 1 1 52 ASN C C -2.060 -7.667 2.725 1.00 . A A . 52 ASN C 1 1
1 784 1 1 52 ASN CA C -2.808 -6.299 2.761 1.00 . A A . 52 ASN CA 1 1
1 785 1 1 52 ASN CB C -4.163 -6.503 3.469 1.00 . A A . 52 ASN CB 1 1
1 786 1 1 52 ASN CG C -4.195 -5.684 4.761 1.00 . A A . 52 ASN CG 1 1
1 787 1 1 52 ASN H H -3.366 -6.339 0.698 1.00 . A A . 52 ASN H 1 1
1 788 1 1 52 ASN HA H -2.198 -5.583 3.291 1.00 . A A . 52 ASN HA 1 1
1 789 1 1 52 ASN HB2 H -4.962 -6.174 2.822 1.00 . A A . 52 ASN HB2 1 1
1 790 1 1 52 ASN HB3 H -4.307 -7.556 3.705 1.00 . A A . 52 ASN HB3 1 1
1 791 1 1 52 ASN HD21 H -3.371 -4.082 3.925 1.00 . A A . 52 ASN HD21 1 1
1 792 1 1 52 ASN HD22 H -3.747 -3.929 5.573 1.00 . A A . 52 ASN HD22 1 1
1 793 1 1 52 ASN N N -3.071 -5.753 1.418 1.00 . A A . 52 ASN N 1 1
1 794 1 1 52 ASN ND2 N -3.733 -4.464 4.753 1.00 . A A . 52 ASN ND2 1 1
1 795 1 1 52 ASN O O -2.376 -8.563 3.484 1.00 . A A . 52 ASN O 1 1
1 796 1 1 52 ASN OD1 O -4.643 -6.149 5.789 1.00 . A A . 52 ASN OD1 1 1
1 797 1 1 53 PRO C C 0.547 -9.240 3.051 1.00 . A A . 53 PRO C 1 1
1 798 1 1 53 PRO CA C -0.346 -9.079 1.812 1.00 . A A . 53 PRO CA 1 1
1 799 1 1 53 PRO CB C 0.500 -8.984 0.519 1.00 . A A . 53 PRO CB 1 1
1 800 1 1 53 PRO CD C -0.569 -6.796 0.933 1.00 . A A . 53 PRO CD 1 1
1 801 1 1 53 PRO CG C 0.232 -7.585 -0.098 1.00 . A A . 53 PRO CG 1 1
1 802 1 1 53 PRO HA H -1.056 -9.899 1.759 1.00 . A A . 53 PRO HA 1 1
1 803 1 1 53 PRO HB2 H 1.537 -9.090 0.743 1.00 . A A . 53 PRO HB2 1 1
1 804 1 1 53 PRO HB3 H 0.201 -9.755 -0.173 1.00 . A A . 53 PRO HB3 1 1
1 805 1 1 53 PRO HD2 H 0.058 -6.101 1.451 1.00 . A A . 53 PRO HD2 1 1
1 806 1 1 53 PRO HD3 H -1.348 -6.304 0.468 1.00 . A A . 53 PRO HD3 1 1
1 807 1 1 53 PRO HG2 H 1.149 -7.086 -0.313 1.00 . A A . 53 PRO HG2 1 1
1 808 1 1 53 PRO HG3 H -0.341 -7.689 -1.006 1.00 . A A . 53 PRO HG3 1 1
1 809 1 1 53 PRO N N -1.061 -7.819 1.871 1.00 . A A . 53 PRO N 1 1
1 810 1 1 53 PRO O O 1.229 -10.214 3.204 1.00 . A A . 53 PRO O 1 1
1 811 1 1 54 ASP C C 0.481 -8.681 6.363 1.00 . A A . 54 ASP C 1 1
1 812 1 1 54 ASP CA C 1.349 -8.357 5.146 1.00 . A A . 54 ASP CA 1 1
1 813 1 1 54 ASP CB C 2.064 -7.006 5.338 1.00 . A A . 54 ASP CB 1 1
1 814 1 1 54 ASP CG C 2.411 -6.800 6.816 1.00 . A A . 54 ASP CG 1 1
1 815 1 1 54 ASP H H -0.063 -7.489 3.766 1.00 . A A . 54 ASP H 1 1
1 816 1 1 54 ASP HA H 2.072 -9.150 5.023 1.00 . A A . 54 ASP HA 1 1
1 817 1 1 54 ASP HB2 H 2.976 -7.003 4.764 1.00 . A A . 54 ASP HB2 1 1
1 818 1 1 54 ASP HB3 H 1.428 -6.203 4.994 1.00 . A A . 54 ASP HB3 1 1
1 819 1 1 54 ASP N N 0.510 -8.269 3.919 1.00 . A A . 54 ASP N 1 1
1 820 1 1 54 ASP O O 0.298 -9.834 6.699 1.00 . A A . 54 ASP O 1 1
1 821 1 1 54 ASP OD1 O 3.385 -7.406 7.233 1.00 . A A . 54 ASP OD1 1 1
1 822 1 1 54 ASP OD2 O 1.683 -6.050 7.444 1.00 . A A . 54 ASP OD2 1 1
1 823 1 1 55 ASN C C -1.435 -6.546 8.647 1.00 . A A . 55 ASN C 1 1
1 824 1 1 55 ASN CA C -0.902 -7.878 8.171 1.00 . A A . 55 ASN CA 1 1
1 825 1 1 55 ASN CB C -0.060 -8.498 9.304 1.00 . A A . 55 ASN CB 1 1
1 826 1 1 55 ASN CG C -0.991 -9.001 10.408 1.00 . A A . 55 ASN CG 1 1
1 827 1 1 55 ASN H H 0.112 -6.764 6.661 1.00 . A A . 55 ASN H 1 1
1 828 1 1 55 ASN HA H -1.733 -8.517 7.898 1.00 . A A . 55 ASN HA 1 1
1 829 1 1 55 ASN HB2 H 0.522 -9.322 8.929 1.00 . A A . 55 ASN HB2 1 1
1 830 1 1 55 ASN HB3 H 0.605 -7.751 9.713 1.00 . A A . 55 ASN HB3 1 1
1 831 1 1 55 ASN HD21 H -1.436 -7.174 11.046 1.00 . A A . 55 ASN HD21 1 1
1 832 1 1 55 ASN HD22 H -2.187 -8.440 11.891 1.00 . A A . 55 ASN HD22 1 1
1 833 1 1 55 ASN N N -0.048 -7.666 6.983 1.00 . A A . 55 ASN N 1 1
1 834 1 1 55 ASN ND2 N -1.588 -8.133 11.179 1.00 . A A . 55 ASN ND2 1 1
1 835 1 1 55 ASN O O -1.007 -6.028 9.658 1.00 . A A . 55 ASN O 1 1
1 836 1 1 55 ASN OD1 O -1.184 -10.188 10.579 1.00 . A A . 55 ASN OD1 1 1
1 837 1 1 56 ASP C C -4.436 -4.657 7.928 1.00 . A A . 56 ASP C 1 1
1 838 1 1 56 ASP CA C -2.944 -4.715 8.298 1.00 . A A . 56 ASP CA 1 1
1 839 1 1 56 ASP CB C -2.170 -3.608 7.531 1.00 . A A . 56 ASP CB 1 1
1 840 1 1 56 ASP CG C -1.108 -2.997 8.453 1.00 . A A . 56 ASP CG 1 1
1 841 1 1 56 ASP H H -2.690 -6.492 7.113 1.00 . A A . 56 ASP H 1 1
1 842 1 1 56 ASP HA H -2.835 -4.581 9.368 1.00 . A A . 56 ASP HA 1 1
1 843 1 1 56 ASP HB2 H -1.678 -4.032 6.662 1.00 . A A . 56 ASP HB2 1 1
1 844 1 1 56 ASP HB3 H -2.845 -2.831 7.214 1.00 . A A . 56 ASP HB3 1 1
1 845 1 1 56 ASP N N -2.364 -6.019 7.911 1.00 . A A . 56 ASP N 1 1
1 846 1 1 56 ASP O O -4.836 -3.946 7.027 1.00 . A A . 56 ASP O 1 1
1 847 1 1 56 ASP OD1 O -0.645 -3.730 9.309 1.00 . A A . 56 ASP OD1 1 1
1 848 1 1 56 ASP OD2 O -0.820 -1.830 8.246 1.00 . A A . 56 ASP OD2 1 1
1 849 1 1 57 PRO C C -7.299 -4.096 8.624 1.00 . A A . 57 PRO C 1 1
1 850 1 1 57 PRO CA C -6.676 -5.465 8.386 1.00 . A A . 57 PRO CA 1 1
1 851 1 1 57 PRO CB C -7.233 -6.486 9.400 1.00 . A A . 57 PRO CB 1 1
1 852 1 1 57 PRO CD C -4.769 -6.305 9.728 1.00 . A A . 57 PRO CD 1 1
1 853 1 1 57 PRO CG C -6.021 -7.072 10.182 1.00 . A A . 57 PRO CG 1 1
1 854 1 1 57 PRO HA H -6.861 -5.784 7.365 1.00 . A A . 57 PRO HA 1 1
1 855 1 1 57 PRO HB2 H -7.911 -5.995 10.082 1.00 . A A . 57 PRO HB2 1 1
1 856 1 1 57 PRO HB3 H -7.754 -7.276 8.879 1.00 . A A . 57 PRO HB3 1 1
1 857 1 1 57 PRO HD2 H -4.383 -5.716 10.545 1.00 . A A . 57 PRO HD2 1 1
1 858 1 1 57 PRO HD3 H -4.015 -6.986 9.364 1.00 . A A . 57 PRO HD3 1 1
1 859 1 1 57 PRO HG2 H -6.169 -6.941 11.244 1.00 . A A . 57 PRO HG2 1 1
1 860 1 1 57 PRO HG3 H -5.911 -8.123 9.959 1.00 . A A . 57 PRO HG3 1 1
1 861 1 1 57 PRO N N -5.238 -5.429 8.639 1.00 . A A . 57 PRO N 1 1
1 862 1 1 57 PRO O O -8.283 -3.740 8.007 1.00 . A A . 57 PRO O 1 1
1 863 1 1 58 GLN C C -7.395 -1.215 8.529 1.00 . A A . 58 GLN C 1 1
1 864 1 1 58 GLN CA C -7.241 -2.011 9.816 1.00 . A A . 58 GLN CA 1 1
1 865 1 1 58 GLN CB C -6.253 -1.278 10.744 1.00 . A A . 58 GLN CB 1 1
1 866 1 1 58 GLN CD C -4.580 -3.028 11.374 1.00 . A A . 58 GLN CD 1 1
1 867 1 1 58 GLN CG C -4.830 -1.796 10.499 1.00 . A A . 58 GLN CG 1 1
1 868 1 1 58 GLN H H -5.927 -3.684 9.989 1.00 . A A . 58 GLN H 1 1
1 869 1 1 58 GLN HA H -8.211 -2.117 10.288 1.00 . A A . 58 GLN HA 1 1
1 870 1 1 58 GLN HB2 H -6.291 -0.217 10.545 1.00 . A A . 58 GLN HB2 1 1
1 871 1 1 58 GLN HB3 H -6.529 -1.452 11.774 1.00 . A A . 58 GLN HB3 1 1
1 872 1 1 58 GLN HE21 H -2.606 -2.916 11.196 1.00 . A A . 58 GLN HE21 1 1
1 873 1 1 58 GLN HE22 H -3.177 -4.200 12.148 1.00 . A A . 58 GLN HE22 1 1
1 874 1 1 58 GLN HG2 H -4.705 -2.061 9.460 1.00 . A A . 58 GLN HG2 1 1
1 875 1 1 58 GLN HG3 H -4.116 -1.031 10.758 1.00 . A A . 58 GLN HG3 1 1
1 876 1 1 58 GLN N N -6.709 -3.354 9.519 1.00 . A A . 58 GLN N 1 1
1 877 1 1 58 GLN NE2 N -3.352 -3.413 11.591 1.00 . A A . 58 GLN NE2 1 1
1 878 1 1 58 GLN O O -8.298 -0.414 8.391 1.00 . A A . 58 GLN O 1 1
1 879 1 1 58 GLN OE1 O -5.500 -3.649 11.867 1.00 . A A . 58 GLN OE1 1 1
1 880 1 1 59 GLY C C -5.416 -1.182 5.385 1.00 . A A . 59 GLY C 1 1
1 881 1 1 59 GLY CA C -6.569 -0.723 6.311 1.00 . A A . 59 GLY CA 1 1
1 882 1 1 59 GLY H H -5.791 -2.111 7.768 1.00 . A A . 59 GLY H 1 1
1 883 1 1 59 GLY HA2 H -7.519 -0.925 5.861 1.00 . A A . 59 GLY HA2 1 1
1 884 1 1 59 GLY HA3 H -6.480 0.338 6.494 1.00 . A A . 59 GLY HA3 1 1
1 885 1 1 59 GLY N N -6.501 -1.454 7.607 1.00 . A A . 59 GLY N 1 1
1 886 1 1 59 GLY O O -4.368 -1.566 5.864 1.00 . A A . 59 GLY O 1 1
1 887 1 1 60 PRO C C -3.397 -0.636 3.271 1.00 . A A . 60 PRO C 1 1
1 888 1 1 60 PRO CA C -4.585 -1.567 3.128 1.00 . A A . 60 PRO CA 1 1
1 889 1 1 60 PRO CB C -5.210 -1.392 1.735 1.00 . A A . 60 PRO CB 1 1
1 890 1 1 60 PRO CD C -6.886 -0.706 3.436 1.00 . A A . 60 PRO CD 1 1
1 891 1 1 60 PRO CG C -6.600 -0.733 1.928 1.00 . A A . 60 PRO CG 1 1
1 892 1 1 60 PRO HA H -4.278 -2.615 3.315 1.00 . A A . 60 PRO HA 1 1
1 893 1 1 60 PRO HB2 H -4.582 -0.762 1.122 1.00 . A A . 60 PRO HB2 1 1
1 894 1 1 60 PRO HB3 H -5.327 -2.350 1.265 1.00 . A A . 60 PRO HB3 1 1
1 895 1 1 60 PRO HD2 H -7.136 0.292 3.762 1.00 . A A . 60 PRO HD2 1 1
1 896 1 1 60 PRO HD3 H -7.687 -1.392 3.669 1.00 . A A . 60 PRO HD3 1 1
1 897 1 1 60 PRO HG2 H -6.591 0.273 1.535 1.00 . A A . 60 PRO HG2 1 1
1 898 1 1 60 PRO HG3 H -7.352 -1.315 1.420 1.00 . A A . 60 PRO HG3 1 1
1 899 1 1 60 PRO N N -5.629 -1.152 4.067 1.00 . A A . 60 PRO N 1 1
1 900 1 1 60 PRO O O -3.480 0.531 2.937 1.00 . A A . 60 PRO O 1 1
1 901 1 1 61 TRP C C -0.348 -0.169 2.637 1.00 . A A . 61 TRP C 1 1
1 902 1 1 61 TRP CA C -1.068 -0.396 3.937 1.00 . A A . 61 TRP CA 1 1
1 903 1 1 61 TRP CB C -0.116 -1.210 4.791 1.00 . A A . 61 TRP CB 1 1
1 904 1 1 61 TRP CD1 C -0.496 -3.294 3.598 1.00 . A A . 61 TRP CD1 1 1
1 905 1 1 61 TRP CD2 C 1.404 -2.360 3.150 1.00 . A A . 61 TRP CD2 1 1
1 906 1 1 61 TRP CE2 C 1.333 -3.426 2.274 1.00 . A A . 61 TRP CE2 1 1
1 907 1 1 61 TRP CE3 C 2.519 -1.532 3.118 1.00 . A A . 61 TRP CE3 1 1
1 908 1 1 61 TRP CG C 0.308 -2.323 3.892 1.00 . A A . 61 TRP CG 1 1
1 909 1 1 61 TRP CH2 C 3.444 -2.852 1.349 1.00 . A A . 61 TRP CH2 1 1
1 910 1 1 61 TRP CZ2 C 2.339 -3.671 1.383 1.00 . A A . 61 TRP CZ2 1 1
1 911 1 1 61 TRP CZ3 C 3.536 -1.783 2.213 1.00 . A A . 61 TRP CZ3 1 1
1 912 1 1 61 TRP H H -2.329 -2.132 3.936 1.00 . A A . 61 TRP H 1 1
1 913 1 1 61 TRP HA H -1.289 0.535 4.397 1.00 . A A . 61 TRP HA 1 1
1 914 1 1 61 TRP HB2 H 0.730 -0.619 5.094 1.00 . A A . 61 TRP HB2 1 1
1 915 1 1 61 TRP HB3 H -0.626 -1.607 5.657 1.00 . A A . 61 TRP HB3 1 1
1 916 1 1 61 TRP HD1 H -1.434 -3.508 4.059 1.00 . A A . 61 TRP HD1 1 1
1 917 1 1 61 TRP HE1 H -0.285 -4.692 2.143 1.00 . A A . 61 TRP HE1 1 1
1 918 1 1 61 TRP HE3 H 2.598 -0.691 3.799 1.00 . A A . 61 TRP HE3 1 1
1 919 1 1 61 TRP HH2 H 4.242 -3.048 0.652 1.00 . A A . 61 TRP HH2 1 1
1 920 1 1 61 TRP HZ2 H 2.262 -4.512 0.707 1.00 . A A . 61 TRP HZ2 1 1
1 921 1 1 61 TRP HZ3 H 4.400 -1.139 2.177 1.00 . A A . 61 TRP HZ3 1 1
1 922 1 1 61 TRP N N -2.319 -1.189 3.738 1.00 . A A . 61 TRP N 1 1
1 923 1 1 61 TRP NE1 N 0.121 -3.948 2.617 1.00 . A A . 61 TRP NE1 1 1
1 924 1 1 61 TRP O O -0.625 -0.825 1.623 1.00 . A A . 61 TRP O 1 1
1 925 1 1 62 CYS C C 2.448 2.084 1.886 1.00 . A A . 62 CYS C 1 1
1 926 1 1 62 CYS CA C 1.395 1.074 1.526 1.00 . A A . 62 CYS CA 1 1
1 927 1 1 62 CYS CB C 0.479 1.710 0.510 1.00 . A A . 62 CYS CB 1 1
1 928 1 1 62 CYS H H 0.764 1.195 3.557 1.00 . A A . 62 CYS H 1 1
1 929 1 1 62 CYS HA H 1.865 0.178 1.129 1.00 . A A . 62 CYS HA 1 1
1 930 1 1 62 CYS HB2 H -0.295 1.015 0.308 1.00 . A A . 62 CYS HB2 1 1
1 931 1 1 62 CYS HB3 H 0.028 2.575 0.963 1.00 . A A . 62 CYS HB3 1 1
1 932 1 1 62 CYS N N 0.595 0.734 2.707 1.00 . A A . 62 CYS N 1 1
1 933 1 1 62 CYS O O 2.165 3.038 2.592 1.00 . A A . 62 CYS O 1 1
1 934 1 1 62 CYS SG S 1.219 2.223 -1.067 1.00 . A A . 62 CYS SG 1 1
1 935 1 1 63 TYR C C 4.822 3.874 0.608 1.00 . A A . 63 TYR C 1 1
1 936 1 1 63 TYR CA C 4.703 2.837 1.735 1.00 . A A . 63 TYR CA 1 1
1 937 1 1 63 TYR CB C 6.045 2.098 1.918 1.00 . A A . 63 TYR CB 1 1
1 938 1 1 63 TYR CD1 C 5.178 0.967 3.988 1.00 . A A . 63 TYR CD1 1 1
1 939 1 1 63 TYR CD2 C 7.361 1.885 4.066 1.00 . A A . 63 TYR CD2 1 1
1 940 1 1 63 TYR CE1 C 5.308 0.547 5.296 1.00 . A A . 63 TYR CE1 1 1
1 941 1 1 63 TYR CE2 C 7.495 1.468 5.373 1.00 . A A . 63 TYR CE2 1 1
1 942 1 1 63 TYR CG C 6.196 1.635 3.365 1.00 . A A . 63 TYR CG 1 1
1 943 1 1 63 TYR CZ C 6.469 0.795 5.999 1.00 . A A . 63 TYR CZ 1 1
1 944 1 1 63 TYR H H 3.831 1.093 0.847 1.00 . A A . 63 TYR H 1 1
1 945 1 1 63 TYR HA H 4.422 3.320 2.622 1.00 . A A . 63 TYR HA 1 1
1 946 1 1 63 TYR HB2 H 6.083 1.245 1.270 1.00 . A A . 63 TYR HB2 1 1
1 947 1 1 63 TYR HB3 H 6.853 2.763 1.692 1.00 . A A . 63 TYR HB3 1 1
1 948 1 1 63 TYR HD1 H 4.268 0.786 3.459 1.00 . A A . 63 TYR HD1 1 1
1 949 1 1 63 TYR HD2 H 8.173 2.412 3.587 1.00 . A A . 63 TYR HD2 1 1
1 950 1 1 63 TYR HE1 H 4.495 0.025 5.773 1.00 . A A . 63 TYR HE1 1 1
1 951 1 1 63 TYR HE2 H 8.411 1.669 5.909 1.00 . A A . 63 TYR HE2 1 1
1 952 1 1 63 TYR HH H 7.366 -0.193 7.363 1.00 . A A . 63 TYR HH 1 1
1 953 1 1 63 TYR N N 3.645 1.873 1.409 1.00 . A A . 63 TYR N 1 1
1 954 1 1 63 TYR O O 3.988 3.908 -0.272 1.00 . A A . 63 TYR O 1 1
1 955 1 1 63 TYR OH O 6.598 0.380 7.308 1.00 . A A . 63 TYR OH 1 1
1 956 1 1 64 THR C C 7.429 6.038 -0.762 1.00 . A A . 64 THR C 1 1
1 957 1 1 64 THR CA C 5.968 5.745 -0.437 1.00 . A A . 64 THR CA 1 1
1 958 1 1 64 THR CB C 5.280 7.058 -0.068 1.00 . A A . 64 THR CB 1 1
1 959 1 1 64 THR CG2 C 4.317 6.894 1.128 1.00 . A A . 64 THR CG2 1 1
1 960 1 1 64 THR H H 6.472 4.689 1.397 1.00 . A A . 64 THR H 1 1
1 961 1 1 64 THR HA H 5.512 5.330 -1.334 1.00 . A A . 64 THR HA 1 1
1 962 1 1 64 THR HB H 4.786 7.486 -0.935 1.00 . A A . 64 THR HB 1 1
1 963 1 1 64 THR HG1 H 6.841 7.475 1.039 1.00 . A A . 64 THR HG1 1 1
1 964 1 1 64 THR HG21 H 4.799 6.372 1.929 1.00 . A A . 64 THR HG21 1 1
1 965 1 1 64 THR HG22 H 4.002 7.866 1.477 1.00 . A A . 64 THR HG22 1 1
1 966 1 1 64 THR HG23 H 3.447 6.334 0.817 1.00 . A A . 64 THR HG23 1 1
1 967 1 1 64 THR N N 5.830 4.722 0.659 1.00 . A A . 64 THR N 1 1
1 968 1 1 64 THR O O 8.322 5.746 0.008 1.00 . A A . 64 THR O 1 1
1 969 1 1 64 THR OG1 O 6.322 7.922 0.364 1.00 . A A . 64 THR OG1 1 1
1 970 1 1 65 THR C C 9.813 7.762 -1.403 1.00 . A A . 65 THR C 1 1
1 971 1 1 65 THR CA C 8.990 6.947 -2.386 1.00 . A A . 65 THR CA 1 1
1 972 1 1 65 THR CB C 8.859 7.767 -3.677 1.00 . A A . 65 THR CB 1 1
1 973 1 1 65 THR CG2 C 8.351 6.907 -4.849 1.00 . A A . 65 THR CG2 1 1
1 974 1 1 65 THR H H 6.853 6.804 -2.492 1.00 . A A . 65 THR H 1 1
1 975 1 1 65 THR HA H 9.524 6.034 -2.581 1.00 . A A . 65 THR HA 1 1
1 976 1 1 65 THR HB H 9.779 8.296 -3.912 1.00 . A A . 65 THR HB 1 1
1 977 1 1 65 THR HG1 H 7.432 8.934 -4.277 1.00 . A A . 65 THR HG1 1 1
1 978 1 1 65 THR HG21 H 8.419 5.862 -4.597 1.00 . A A . 65 THR HG21 1 1
1 979 1 1 65 THR HG22 H 7.322 7.156 -5.062 1.00 . A A . 65 THR HG22 1 1
1 980 1 1 65 THR HG23 H 8.951 7.099 -5.726 1.00 . A A . 65 THR HG23 1 1
1 981 1 1 65 THR N N 7.623 6.603 -1.919 1.00 . A A . 65 THR N 1 1
1 982 1 1 65 THR O O 10.842 8.279 -1.791 1.00 . A A . 65 THR O 1 1
1 983 1 1 65 THR OG1 O 7.808 8.680 -3.431 1.00 . A A . 65 THR OG1 1 1
1 984 1 1 66 ASP C C 9.993 8.437 2.245 1.00 . A A . 66 ASP C 1 1
1 985 1 1 66 ASP CA C 10.254 8.699 0.719 1.00 . A A . 66 ASP CA 1 1
1 986 1 1 66 ASP CB C 9.889 10.130 0.415 1.00 . A A . 66 ASP CB 1 1
1 987 1 1 66 ASP CG C 11.081 10.866 -0.209 1.00 . A A . 66 ASP CG 1 1
1 988 1 1 66 ASP H H 8.558 7.525 0.138 1.00 . A A . 66 ASP H 1 1
1 989 1 1 66 ASP HA H 11.279 8.494 0.460 1.00 . A A . 66 ASP HA 1 1
1 990 1 1 66 ASP HB2 H 9.045 10.132 -0.262 1.00 . A A . 66 ASP HB2 1 1
1 991 1 1 66 ASP HB3 H 9.620 10.622 1.320 1.00 . A A . 66 ASP HB3 1 1
1 992 1 1 66 ASP N N 9.399 7.895 -0.166 1.00 . A A . 66 ASP N 1 1
1 993 1 1 66 ASP O O 8.917 8.054 2.629 1.00 . A A . 66 ASP O 1 1
1 994 1 1 66 ASP OD1 O 11.402 10.523 -1.334 1.00 . A A . 66 ASP OD1 1 1
1 995 1 1 66 ASP OD2 O 11.600 11.731 0.477 1.00 . A A . 66 ASP OD2 1 1
1 996 1 1 67 PRO C C 9.816 9.300 5.233 1.00 . A A . 67 PRO C 1 1
1 997 1 1 67 PRO CA C 10.945 8.496 4.550 1.00 . A A . 67 PRO CA 1 1
1 998 1 1 67 PRO CB C 12.316 8.995 5.071 1.00 . A A . 67 PRO CB 1 1
1 999 1 1 67 PRO CD C 12.310 9.165 2.600 1.00 . A A . 67 PRO CD 1 1
1 1000 1 1 67 PRO CG C 13.070 9.602 3.857 1.00 . A A . 67 PRO CG 1 1
1 1001 1 1 67 PRO HA H 10.819 7.453 4.769 1.00 . A A . 67 PRO HA 1 1
1 1002 1 1 67 PRO HB2 H 12.182 9.742 5.836 1.00 . A A . 67 PRO HB2 1 1
1 1003 1 1 67 PRO HB3 H 12.879 8.166 5.474 1.00 . A A . 67 PRO HB3 1 1
1 1004 1 1 67 PRO HD2 H 12.159 9.969 1.935 1.00 . A A . 67 PRO HD2 1 1
1 1005 1 1 67 PRO HD3 H 12.843 8.373 2.106 1.00 . A A . 67 PRO HD3 1 1
1 1006 1 1 67 PRO HG2 H 13.081 10.679 3.929 1.00 . A A . 67 PRO HG2 1 1
1 1007 1 1 67 PRO HG3 H 14.084 9.229 3.826 1.00 . A A . 67 PRO HG3 1 1
1 1008 1 1 67 PRO N N 11.018 8.687 3.077 1.00 . A A . 67 PRO N 1 1
1 1009 1 1 67 PRO O O 8.804 8.736 5.598 1.00 . A A . 67 PRO O 1 1
1 1010 1 1 68 GLU C C 7.583 10.987 5.725 1.00 . A A . 68 GLU C 1 1
1 1011 1 1 68 GLU CA C 8.984 11.462 6.069 1.00 . A A . 68 GLU CA 1 1
1 1012 1 1 68 GLU CB C 9.152 12.901 5.558 1.00 . A A . 68 GLU CB 1 1
1 1013 1 1 68 GLU CD C 10.497 14.953 6.017 1.00 . A A . 68 GLU CD 1 1
1 1014 1 1 68 GLU CG C 10.531 13.424 5.967 1.00 . A A . 68 GLU CG 1 1
1 1015 1 1 68 GLU H H 10.872 10.999 5.108 1.00 . A A . 68 GLU H 1 1
1 1016 1 1 68 GLU HA H 9.117 11.417 7.148 1.00 . A A . 68 GLU HA 1 1
1 1017 1 1 68 GLU HB2 H 9.063 12.917 4.482 1.00 . A A . 68 GLU HB2 1 1
1 1018 1 1 68 GLU HB3 H 8.385 13.530 5.986 1.00 . A A . 68 GLU HB3 1 1
1 1019 1 1 68 GLU HG2 H 10.794 13.041 6.942 1.00 . A A . 68 GLU HG2 1 1
1 1020 1 1 68 GLU HG3 H 11.271 13.107 5.247 1.00 . A A . 68 GLU HG3 1 1
1 1021 1 1 68 GLU N N 10.030 10.599 5.409 1.00 . A A . 68 GLU N 1 1
1 1022 1 1 68 GLU O O 6.658 11.120 6.503 1.00 . A A . 68 GLU O 1 1
1 1023 1 1 68 GLU OE1 O 9.669 15.452 6.762 1.00 . A A . 68 GLU OE1 1 1
1 1024 1 1 68 GLU OE2 O 11.301 15.535 5.308 1.00 . A A . 68 GLU OE2 1 1
1 1025 1 1 69 LYS C C 6.383 8.516 3.643 1.00 . A A . 69 LYS C 1 1
1 1026 1 1 69 LYS CA C 6.176 9.932 4.083 1.00 . A A . 69 LYS CA 1 1
1 1027 1 1 69 LYS CB C 5.772 10.744 2.855 1.00 . A A . 69 LYS CB 1 1
1 1028 1 1 69 LYS CD C 6.559 11.605 0.632 1.00 . A A . 69 LYS CD 1 1
1 1029 1 1 69 LYS CE C 6.012 10.655 -0.439 1.00 . A A . 69 LYS CE 1 1
1 1030 1 1 69 LYS CG C 6.969 10.804 1.876 1.00 . A A . 69 LYS CG 1 1
1 1031 1 1 69 LYS H H 8.261 10.367 3.992 1.00 . A A . 69 LYS H 1 1
1 1032 1 1 69 LYS HA H 5.423 9.980 4.869 1.00 . A A . 69 LYS HA 1 1
1 1033 1 1 69 LYS HB2 H 4.929 10.278 2.381 1.00 . A A . 69 LYS HB2 1 1
1 1034 1 1 69 LYS HB3 H 5.500 11.745 3.157 1.00 . A A . 69 LYS HB3 1 1
1 1035 1 1 69 LYS HD2 H 5.799 12.324 0.899 1.00 . A A . 69 LYS HD2 1 1
1 1036 1 1 69 LYS HD3 H 7.419 12.131 0.242 1.00 . A A . 69 LYS HD3 1 1
1 1037 1 1 69 LYS HE2 H 5.730 11.222 -1.313 1.00 . A A . 69 LYS HE2 1 1
1 1038 1 1 69 LYS HE3 H 6.770 9.941 -0.714 1.00 . A A . 69 LYS HE3 1 1
1 1039 1 1 69 LYS HG2 H 7.785 11.306 2.363 1.00 . A A . 69 LYS HG2 1 1
1 1040 1 1 69 LYS HG3 H 7.279 9.817 1.586 1.00 . A A . 69 LYS HG3 1 1
1 1041 1 1 69 LYS HZ1 H 4.248 10.573 0.652 1.00 . A A . 69 LYS HZ1 1 1
1 1042 1 1 69 LYS HZ2 H 4.248 9.587 -0.729 1.00 . A A . 69 LYS HZ2 1 1
1 1043 1 1 69 LYS HZ3 H 5.118 9.125 0.650 1.00 . A A . 69 LYS HZ3 1 1
1 1044 1 1 69 LYS N N 7.472 10.445 4.563 1.00 . A A . 69 LYS N 1 1
1 1045 1 1 69 LYS NZ N 4.817 9.928 0.072 1.00 . A A . 69 LYS NZ 1 1
1 1046 1 1 69 LYS O O 6.060 8.168 2.559 1.00 . A A . 69 LYS O 1 1
1 1047 1 1 70 ARG C C 5.900 5.477 4.077 1.00 . A A . 70 ARG C 1 1
1 1048 1 1 70 ARG CA C 7.124 6.320 4.102 1.00 . A A . 70 ARG CA 1 1
1 1049 1 1 70 ARG CB C 8.079 5.688 5.081 1.00 . A A . 70 ARG CB 1 1
1 1050 1 1 70 ARG CD C 8.400 5.088 7.423 1.00 . A A . 70 ARG CD 1 1
1 1051 1 1 70 ARG CG C 7.343 5.399 6.375 1.00 . A A . 70 ARG CG 1 1
1 1052 1 1 70 ARG CZ C 8.652 3.123 8.803 1.00 . A A . 70 ARG CZ 1 1
1 1053 1 1 70 ARG H H 7.140 8.031 5.386 1.00 . A A . 70 ARG H 1 1
1 1054 1 1 70 ARG HA H 7.554 6.305 3.112 1.00 . A A . 70 ARG HA 1 1
1 1055 1 1 70 ARG HB2 H 8.468 4.769 4.670 1.00 . A A . 70 ARG HB2 1 1
1 1056 1 1 70 ARG HB3 H 8.890 6.359 5.276 1.00 . A A . 70 ARG HB3 1 1
1 1057 1 1 70 ARG HD2 H 9.287 4.691 6.927 1.00 . A A . 70 ARG HD2 1 1
1 1058 1 1 70 ARG HD3 H 8.661 5.986 7.959 1.00 . A A . 70 ARG HD3 1 1
1 1059 1 1 70 ARG HE H 6.935 4.118 8.676 1.00 . A A . 70 ARG HE 1 1
1 1060 1 1 70 ARG HG2 H 6.755 6.268 6.662 1.00 . A A . 70 ARG HG2 1 1
1 1061 1 1 70 ARG HG3 H 6.684 4.545 6.255 1.00 . A A . 70 ARG HG3 1 1
1 1062 1 1 70 ARG HH11 H 9.390 2.755 6.978 1.00 . A A . 70 ARG HH11 1 1
1 1063 1 1 70 ARG HH12 H 10.023 1.770 8.255 1.00 . A A . 70 ARG HH12 1 1
1 1064 1 1 70 ARG HH21 H 8.053 3.325 10.703 1.00 . A A . 70 ARG HH21 1 1
1 1065 1 1 70 ARG HH22 H 9.246 2.102 10.420 1.00 . A A . 70 ARG HH22 1 1
1 1066 1 1 70 ARG N N 6.897 7.717 4.498 1.00 . A A . 70 ARG N 1 1
1 1067 1 1 70 ARG NE N 7.866 4.073 8.375 1.00 . A A . 70 ARG NE 1 1
1 1068 1 1 70 ARG NH1 N 9.414 2.501 7.945 1.00 . A A . 70 ARG NH1 1 1
1 1069 1 1 70 ARG NH2 N 8.650 2.827 10.074 1.00 . A A . 70 ARG NH2 1 1
1 1070 1 1 70 ARG O O 5.879 4.555 3.328 1.00 . A A . 70 ARG O 1 1
1 1071 1 1 71 TYR C C 2.487 5.296 5.538 1.00 . A A . 71 TYR C 1 1
1 1072 1 1 71 TYR CA C 3.715 4.863 4.790 1.00 . A A . 71 TYR CA 1 1
1 1073 1 1 71 TYR CB C 4.090 3.460 5.309 1.00 . A A . 71 TYR CB 1 1
1 1074 1 1 71 TYR CD1 C 4.226 4.434 7.650 1.00 . A A . 71 TYR CD1 1 1
1 1075 1 1 71 TYR CD2 C 3.237 2.286 7.385 1.00 . A A . 71 TYR CD2 1 1
1 1076 1 1 71 TYR CE1 C 4.008 4.365 9.011 1.00 . A A . 71 TYR CE1 1 1
1 1077 1 1 71 TYR CE2 C 3.020 2.220 8.747 1.00 . A A . 71 TYR CE2 1 1
1 1078 1 1 71 TYR CG C 3.842 3.393 6.824 1.00 . A A . 71 TYR CG 1 1
1 1079 1 1 71 TYR CZ C 3.404 3.258 9.569 1.00 . A A . 71 TYR CZ 1 1
1 1080 1 1 71 TYR H H 4.915 6.518 5.469 1.00 . A A . 71 TYR H 1 1
1 1081 1 1 71 TYR HA H 3.438 4.809 3.765 1.00 . A A . 71 TYR HA 1 1
1 1082 1 1 71 TYR HB2 H 3.475 2.706 4.815 1.00 . A A . 71 TYR HB2 1 1
1 1083 1 1 71 TYR HB3 H 5.124 3.257 5.116 1.00 . A A . 71 TYR HB3 1 1
1 1084 1 1 71 TYR HD1 H 4.695 5.307 7.228 1.00 . A A . 71 TYR HD1 1 1
1 1085 1 1 71 TYR HD2 H 2.929 1.467 6.753 1.00 . A A . 71 TYR HD2 1 1
1 1086 1 1 71 TYR HE1 H 4.314 5.185 9.644 1.00 . A A . 71 TYR HE1 1 1
1 1087 1 1 71 TYR HE2 H 2.546 1.347 9.171 1.00 . A A . 71 TYR HE2 1 1
1 1088 1 1 71 TYR HH H 2.243 3.109 11.078 1.00 . A A . 71 TYR HH 1 1
1 1089 1 1 71 TYR N N 4.896 5.757 4.877 1.00 . A A . 71 TYR N 1 1
1 1090 1 1 71 TYR O O 2.429 6.312 6.202 1.00 . A A . 71 TYR O 1 1
1 1091 1 1 71 TYR OH O 3.188 3.190 10.931 1.00 . A A . 71 TYR OH 1 1
1 1092 1 1 72 ASP C C -0.788 3.788 5.044 1.00 . A A . 72 ASP C 1 1
1 1093 1 1 72 ASP CA C 0.185 4.559 5.983 1.00 . A A . 72 ASP CA 1 1
1 1094 1 1 72 ASP CB C -0.174 6.069 6.070 1.00 . A A . 72 ASP CB 1 1
1 1095 1 1 72 ASP CG C -1.665 6.255 5.940 1.00 . A A . 72 ASP CG 1 1
1 1096 1 1 72 ASP H H 1.725 3.638 4.829 1.00 . A A . 72 ASP H 1 1
1 1097 1 1 72 ASP HA H 0.188 4.085 6.968 1.00 . A A . 72 ASP HA 1 1
1 1098 1 1 72 ASP HB2 H 0.151 6.466 7.020 1.00 . A A . 72 ASP HB2 1 1
1 1099 1 1 72 ASP HB3 H 0.309 6.613 5.277 1.00 . A A . 72 ASP HB3 1 1
1 1100 1 1 72 ASP N N 1.531 4.428 5.378 1.00 . A A . 72 ASP N 1 1
1 1101 1 1 72 ASP O O -0.335 3.201 4.078 1.00 . A A . 72 ASP O 1 1
1 1102 1 1 72 ASP OD1 O -2.111 6.133 4.822 1.00 . A A . 72 ASP OD1 1 1
1 1103 1 1 72 ASP OD2 O -2.277 6.508 6.965 1.00 . A A . 72 ASP OD2 1 1
1 1104 1 1 73 TYR C C -3.176 3.732 3.086 1.00 . A A . 73 TYR C 1 1
1 1105 1 1 73 TYR CA C -2.970 3.013 4.366 1.00 . A A . 73 TYR CA 1 1
1 1106 1 1 73 TYR CB C -4.330 2.769 5.013 1.00 . A A . 73 TYR CB 1 1
1 1107 1 1 73 TYR CD1 C -3.441 1.051 6.544 1.00 . A A . 73 TYR CD1 1 1
1 1108 1 1 73 TYR CD2 C -4.352 3.023 7.486 1.00 . A A . 73 TYR CD2 1 1
1 1109 1 1 73 TYR CE1 C -3.098 0.615 7.781 1.00 . A A . 73 TYR CE1 1 1
1 1110 1 1 73 TYR CE2 C -4.007 2.585 8.726 1.00 . A A . 73 TYR CE2 1 1
1 1111 1 1 73 TYR CG C -4.065 2.257 6.385 1.00 . A A . 73 TYR CG 1 1
1 1112 1 1 73 TYR CZ C -3.376 1.377 8.879 1.00 . A A . 73 TYR CZ 1 1
1 1113 1 1 73 TYR H H -2.441 4.241 6.087 1.00 . A A . 73 TYR H 1 1
1 1114 1 1 73 TYR HA H -2.504 2.106 4.147 1.00 . A A . 73 TYR HA 1 1
1 1115 1 1 73 TYR HB2 H -4.895 3.681 5.060 1.00 . A A . 73 TYR HB2 1 1
1 1116 1 1 73 TYR HB3 H -4.879 2.027 4.450 1.00 . A A . 73 TYR HB3 1 1
1 1117 1 1 73 TYR HD1 H -3.219 0.447 5.682 1.00 . A A . 73 TYR HD1 1 1
1 1118 1 1 73 TYR HD2 H -4.851 3.973 7.370 1.00 . A A . 73 TYR HD2 1 1
1 1119 1 1 73 TYR HE1 H -2.604 -0.337 7.898 1.00 . A A . 73 TYR HE1 1 1
1 1120 1 1 73 TYR HE2 H -4.231 3.190 9.592 1.00 . A A . 73 TYR HE2 1 1
1 1121 1 1 73 TYR HH H -3.287 1.607 10.771 1.00 . A A . 73 TYR HH 1 1
1 1122 1 1 73 TYR N N -2.076 3.773 5.307 1.00 . A A . 73 TYR N 1 1
1 1123 1 1 73 TYR O O -2.383 4.526 2.714 1.00 . A A . 73 TYR O 1 1
1 1124 1 1 73 TYR OH O -3.017 0.940 10.136 1.00 . A A . 73 TYR OH 1 1
1 1125 1 1 74 CYS C C -5.840 4.750 1.165 1.00 . A A . 74 CYS C 1 1
1 1126 1 1 74 CYS CA C -4.518 4.029 1.094 1.00 . A A . 74 CYS CA 1 1
1 1127 1 1 74 CYS CB C -4.615 2.978 0.003 1.00 . A A . 74 CYS CB 1 1
1 1128 1 1 74 CYS H H -4.768 2.614 2.721 1.00 . A A . 74 CYS H 1 1
1 1129 1 1 74 CYS HA H -3.744 4.749 0.872 1.00 . A A . 74 CYS HA 1 1
1 1130 1 1 74 CYS HB2 H -4.293 2.056 0.415 1.00 . A A . 74 CYS HB2 1 1
1 1131 1 1 74 CYS HB3 H -5.655 2.869 -0.263 1.00 . A A . 74 CYS HB3 1 1
1 1132 1 1 74 CYS N N -4.215 3.363 2.399 1.00 . A A . 74 CYS N 1 1
1 1133 1 1 74 CYS O O -6.712 4.374 1.922 1.00 . A A . 74 CYS O 1 1
1 1134 1 1 74 CYS SG S -3.689 3.282 -1.531 1.00 . A A . 74 CYS SG 1 1
1 1135 1 1 75 ASP C C -8.314 5.778 -0.405 1.00 . A A . 75 ASP C 1 1
1 1136 1 1 75 ASP CA C -7.240 6.516 0.408 1.00 . A A . 75 ASP CA 1 1
1 1137 1 1 75 ASP CB C -6.987 7.955 -0.139 1.00 . A A . 75 ASP CB 1 1
1 1138 1 1 75 ASP CG C -8.325 8.676 -0.323 1.00 . A A . 75 ASP CG 1 1
1 1139 1 1 75 ASP H H -5.253 6.052 -0.210 1.00 . A A . 75 ASP H 1 1
1 1140 1 1 75 ASP HA H -7.571 6.556 1.421 1.00 . A A . 75 ASP HA 1 1
1 1141 1 1 75 ASP HB2 H -6.368 8.526 0.574 1.00 . A A . 75 ASP HB2 1 1
1 1142 1 1 75 ASP HB3 H -6.475 7.906 -1.085 1.00 . A A . 75 ASP HB3 1 1
1 1143 1 1 75 ASP N N -5.977 5.777 0.381 1.00 . A A . 75 ASP N 1 1
1 1144 1 1 75 ASP O O -8.960 6.342 -1.265 1.00 . A A . 75 ASP O 1 1
1 1145 1 1 75 ASP OD1 O -9.182 8.448 0.515 1.00 . A A . 75 ASP OD1 1 1
1 1146 1 1 75 ASP OD2 O -8.414 9.413 -1.291 1.00 . A A . 75 ASP OD2 1 1
1 1147 1 1 76 ILE C C -10.858 3.936 -0.206 1.00 . A A . 76 ILE C 1 1
1 1148 1 1 76 ILE CA C -9.481 3.665 -0.803 1.00 . A A . 76 ILE CA 1 1
1 1149 1 1 76 ILE CB C -9.111 2.183 -0.598 1.00 . A A . 76 ILE CB 1 1
1 1150 1 1 76 ILE CD1 C -7.612 0.352 -1.402 1.00 . A A . 76 ILE CD1 1 1
1 1151 1 1 76 ILE CG1 C -8.238 1.699 -1.756 1.00 . A A . 76 ILE CG1 1 1
1 1152 1 1 76 ILE CG2 C -10.395 1.326 -0.593 1.00 . A A . 76 ILE CG2 1 1
1 1153 1 1 76 ILE H H -7.923 4.093 0.605 1.00 . A A . 76 ILE H 1 1
1 1154 1 1 76 ILE HA H -9.487 3.914 -1.851 1.00 . A A . 76 ILE HA 1 1
1 1155 1 1 76 ILE HB H -8.566 2.083 0.340 1.00 . A A . 76 ILE HB 1 1
1 1156 1 1 76 ILE HD11 H -7.882 0.064 -0.407 1.00 . A A . 76 ILE HD11 1 1
1 1157 1 1 76 ILE HD12 H -7.952 -0.396 -2.091 1.00 . A A . 76 ILE HD12 1 1
1 1158 1 1 76 ILE HD13 H -6.540 0.429 -1.468 1.00 . A A . 76 ILE HD13 1 1
1 1159 1 1 76 ILE HG12 H -8.844 1.593 -2.642 1.00 . A A . 76 ILE HG12 1 1
1 1160 1 1 76 ILE HG13 H -7.457 2.408 -1.952 1.00 . A A . 76 ILE HG13 1 1
1 1161 1 1 76 ILE HG21 H -11.072 1.673 -1.357 1.00 . A A . 76 ILE HG21 1 1
1 1162 1 1 76 ILE HG22 H -10.145 0.293 -0.797 1.00 . A A . 76 ILE HG22 1 1
1 1163 1 1 76 ILE HG23 H -10.873 1.393 0.372 1.00 . A A . 76 ILE HG23 1 1
1 1164 1 1 76 ILE N N -8.472 4.496 -0.095 1.00 . A A . 76 ILE N 1 1
1 1165 1 1 76 ILE O O -10.999 4.029 0.998 1.00 . A A . 76 ILE O 1 1
1 1166 1 1 77 LEU C C -13.508 3.460 0.680 1.00 . A A . 77 LEU C 1 1
1 1167 1 1 77 LEU CA C -13.218 4.330 -0.537 1.00 . A A . 77 LEU CA 1 1
1 1168 1 1 77 LEU CB C -14.233 3.974 -1.647 1.00 . A A . 77 LEU CB 1 1
1 1169 1 1 77 LEU CD1 C -15.760 5.983 -1.554 1.00 . A A . 77 LEU CD1 1 1
1 1170 1 1 77 LEU CD2 C -13.525 6.174 -2.699 1.00 . A A . 77 LEU CD2 1 1
1 1171 1 1 77 LEU CG C -14.712 5.240 -2.400 1.00 . A A . 77 LEU CG 1 1
1 1172 1 1 77 LEU H H -11.685 3.985 -2.015 1.00 . A A . 77 LEU H 1 1
1 1173 1 1 77 LEU HA H -13.292 5.369 -0.249 1.00 . A A . 77 LEU HA 1 1
1 1174 1 1 77 LEU HB2 H -13.769 3.297 -2.348 1.00 . A A . 77 LEU HB2 1 1
1 1175 1 1 77 LEU HB3 H -15.086 3.481 -1.204 1.00 . A A . 77 LEU HB3 1 1
1 1176 1 1 77 LEU HD11 H -16.559 5.307 -1.290 1.00 . A A . 77 LEU HD11 1 1
1 1177 1 1 77 LEU HD12 H -15.311 6.366 -0.653 1.00 . A A . 77 LEU HD12 1 1
1 1178 1 1 77 LEU HD13 H -16.167 6.806 -2.123 1.00 . A A . 77 LEU HD13 1 1
1 1179 1 1 77 LEU HD21 H -12.608 5.608 -2.716 1.00 . A A . 77 LEU HD21 1 1
1 1180 1 1 77 LEU HD22 H -13.668 6.641 -3.662 1.00 . A A . 77 LEU HD22 1 1
1 1181 1 1 77 LEU HD23 H -13.458 6.941 -1.943 1.00 . A A . 77 LEU HD23 1 1
1 1182 1 1 77 LEU HG H -15.165 4.941 -3.334 1.00 . A A . 77 LEU HG 1 1
1 1183 1 1 77 LEU N N -11.846 4.064 -1.052 1.00 . A A . 77 LEU N 1 1
1 1184 1 1 77 LEU O O -12.992 2.369 0.794 1.00 . A A . 77 LEU O 1 1
1 1185 1 1 78 GLU C C -15.153 1.792 2.412 1.00 . A A . 78 GLU C 1 1
1 1186 1 1 78 GLU CA C -14.660 3.175 2.787 1.00 . A A . 78 GLU CA 1 1
1 1187 1 1 78 GLU CB C -15.765 3.908 3.559 1.00 . A A . 78 GLU CB 1 1
1 1188 1 1 78 GLU CD C -14.230 4.755 5.336 1.00 . A A . 78 GLU CD 1 1
1 1189 1 1 78 GLU CG C -15.444 3.868 5.055 1.00 . A A . 78 GLU CG 1 1
1 1190 1 1 78 GLU H H -14.716 4.853 1.435 1.00 . A A . 78 GLU H 1 1
1 1191 1 1 78 GLU HA H -13.761 3.065 3.400 1.00 . A A . 78 GLU HA 1 1
1 1192 1 1 78 GLU HB2 H -15.819 4.935 3.227 1.00 . A A . 78 GLU HB2 1 1
1 1193 1 1 78 GLU HB3 H -16.715 3.427 3.378 1.00 . A A . 78 GLU HB3 1 1
1 1194 1 1 78 GLU HG2 H -16.290 4.231 5.620 1.00 . A A . 78 GLU HG2 1 1
1 1195 1 1 78 GLU HG3 H -15.223 2.854 5.354 1.00 . A A . 78 GLU HG3 1 1
1 1196 1 1 78 GLU N N -14.327 3.964 1.570 1.00 . A A . 78 GLU N 1 1
1 1197 1 1 78 GLU O O -15.048 1.380 1.274 1.00 . A A . 78 GLU O 1 1
1 1198 1 1 78 GLU OE1 O -14.424 5.959 5.321 1.00 . A A . 78 GLU OE1 1 1
1 1199 1 1 78 GLU OE2 O -13.176 4.178 5.551 1.00 . A A . 78 GLU OE2 1 1
1 1200 1 1 79 CYS C C -17.294 -0.684 4.005 1.00 . A A . 79 CYS C 1 1
1 1201 1 1 79 CYS CA C -16.188 -0.257 3.044 1.00 . A A . 79 CYS CA 1 1
1 1202 1 1 79 CYS CB C -14.991 -1.192 3.203 1.00 . A A . 79 CYS CB 1 1
1 1203 1 1 79 CYS H H -15.779 1.458 4.270 1.00 . A A . 79 CYS H 1 1
1 1204 1 1 79 CYS HA H -16.565 -0.274 2.025 1.00 . A A . 79 CYS HA 1 1
1 1205 1 1 79 CYS HB2 H -14.861 -1.409 4.250 1.00 . A A . 79 CYS HB2 1 1
1 1206 1 1 79 CYS HB3 H -15.210 -2.118 2.698 1.00 . A A . 79 CYS HB3 1 1
1 1207 1 1 79 CYS N N -15.697 1.094 3.363 1.00 . A A . 79 CYS N 1 1
1 1208 1 1 79 CYS O O -17.034 -0.612 5.195 1.00 . A A . 79 CYS O 1 1
1 1209 1 1 79 CYS OXT O -18.338 -1.059 3.497 1.00 . A A . 79 CYS OXT 1 1
1 1210 1 1 79 CYS SG S -13.416 -0.585 2.570 1.00 . A A . 79 CYS SG 1 1
1 1211 2 2 1 ACA C1 C 6.804 -2.108 5.750 1.00 . B A . 80 ACA C1 1 1
1 1212 2 2 1 ACA C2 C 5.674 -2.597 4.841 1.00 . B A . 80 ACA C2 1 1
1 1213 2 2 1 ACA C3 C 4.475 -3.013 5.693 1.00 . B A . 80 ACA C3 1 1
1 1214 2 2 1 ACA C4 C 4.840 -4.259 6.505 1.00 . B A . 80 ACA C4 1 1
1 1215 2 2 1 ACA C5 C 4.524 -4.011 7.985 1.00 . B A . 80 ACA C5 1 1
1 1216 2 2 1 ACA C6 C 3.034 -3.693 8.141 1.00 . B A . 80 ACA C6 1 1
1 1217 2 2 1 ACA H21 H 6.022 -3.440 4.263 1.00 . B A . 80 ACA H21 1 1
1 1218 2 2 1 ACA H22 H 5.385 -1.802 4.173 1.00 . B A . 80 ACA H22 1 1
1 1219 2 2 1 ACA H31 H 3.634 -3.233 5.050 1.00 . B A . 80 ACA H31 1 1
1 1220 2 2 1 ACA H32 H 4.210 -2.210 6.361 1.00 . B A . 80 ACA H32 1 1
1 1221 2 2 1 ACA H41 H 5.892 -4.471 6.390 1.00 . B A . 80 ACA H41 1 1
1 1222 2 2 1 ACA H42 H 4.269 -5.102 6.149 1.00 . B A . 80 ACA H42 1 1
1 1223 2 2 1 ACA H51 H 5.111 -3.181 8.348 1.00 . B A . 80 ACA H51 1 1
1 1224 2 2 1 ACA H52 H 4.768 -4.893 8.560 1.00 . B A . 80 ACA H52 1 1
1 1225 2 2 1 ACA H61 H 2.526 -3.869 7.205 1.00 . B A . 80 ACA H61 1 1
1 1226 2 2 1 ACA H62 H 2.913 -2.656 8.417 1.00 . B A . 80 ACA H62 1 1
1 1227 2 2 1 ACA HN61 H 2.321 -4.000 10.072 1.00 . B A . 80 ACA HN61 1 1
1 1228 2 2 1 ACA HN62 H 3.037 -5.371 9.373 1.00 . B A . 80 ACA HN62 1 1
1 1229 2 2 1 ACA N6 N 2.424 -4.550 9.196 1.00 . B A . 80 ACA N6 1 1
1 1230 2 2 1 ACA O1 O 7.883 -1.914 5.215 1.00 . B A . 80 ACA O1 1 1
1 1231 2 2 1 ACA O2 O 6.524 -1.955 6.926 1.00 . B A . 80 ACA O2 1 1
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