NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | subtype | item_count |
|
|
372511 |
1dax   |
cing | 4-filtered-FRED | STAR | entry | full | 568 |
data_FRED_restraints_with_modified_coordinates_PDB_code_1dax
# This FRED archive file contains, for PDB entry <1dax>:
#
# - 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, W Vranken, C Penkett, J Lin, CF Schulte, G Vuister, G Vriend,
# JL Markley, EL Ulrich. BioMagResBank database `NMR Restraints Grid` with
# curated sets of experimental NMR restraints for over 4,000 protein and nucleic
# acid PDB entries. (in preparation)
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_1dax
_Assembly.Sf_category assembly
_Assembly.Entry_ID 1
_Assembly.ID 1
_Assembly.Name 1dax
_Assembly.Number_of_components 2
_Assembly.Organic_ligands .
_Assembly.Metal_ions .
_Assembly.Paramagnetic .
_Assembly.Thiol_state "all free"
_Assembly.Molecular_mass 7535.39
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 $FERREDOXIN_I A . 1 1
2 . 2 $IRON_SULFUR_CLUSTER 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 SF4 1 SF4 1 1
stop_
save_
save_FERREDOXIN_I
_Entity.Sf_category entity
_Entity.Entry_ID 1
_Entity.ID 1
_Entity.Name "FERREDOXIN I"
_Entity.Type polymer
_Entity.Polymer_type polypeptide(L)
_Entity.Polymer_seq_one_letter_code ARKFYVDQDECIACESCVEIAPGAFAMDPEIEKAYVKDVEGASQEEVEEAMDTCPVQCIHWEDE
_Entity.Number_of_monomers 64
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 ALA . 1 1
2 ARG . 1 1
3 LYS . 1 1
4 PHE . 1 1
5 TYR . 1 1
6 VAL . 1 1
7 ASP . 1 1
8 GLN . 1 1
9 ASP . 1 1
10 GLU . 1 1
11 CYS . 1 1
12 ILE . 1 1
13 ALA . 1 1
14 CYS . 1 1
15 GLU . 1 1
16 SER . 1 1
17 CYS . 1 1
18 VAL . 1 1
19 GLU . 1 1
20 ILE . 1 1
21 ALA . 1 1
22 PRO . 1 1
23 GLY . 1 1
24 ALA . 1 1
25 PHE . 1 1
26 ALA . 1 1
27 MET . 1 1
28 ASP . 1 1
29 PRO . 1 1
30 GLU . 1 1
31 ILE . 1 1
32 GLU . 1 1
33 LYS . 1 1
34 ALA . 1 1
35 TYR . 1 1
36 VAL . 1 1
37 LYS . 1 1
38 ASP . 1 1
39 VAL . 1 1
40 GLU . 1 1
41 GLY . 1 1
42 ALA . 1 1
43 SER . 1 1
44 GLN . 1 1
45 GLU . 1 1
46 GLU . 1 1
47 VAL . 1 1
48 GLU . 1 1
49 GLU . 1 1
50 ALA . 1 1
51 MET . 1 1
52 ASP . 1 1
53 THR . 1 1
54 CYS . 1 1
55 PRO . 1 1
56 VAL . 1 1
57 GLN . 1 1
58 CYS . 1 1
59 ILE . 1 1
60 HIS . 1 1
61 TRP . 1 1
62 GLU . 1 1
63 ASP . 1 1
64 GLU . 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
ALA 1 1 1 1
ARG 2 2 1 1
LYS 3 3 1 1
PHE 4 4 1 1
TYR 5 5 1 1
VAL 6 6 1 1
ASP 7 7 1 1
GLN 8 8 1 1
ASP 9 9 1 1
GLU 10 10 1 1
CYS 11 11 1 1
ILE 12 12 1 1
ALA 13 13 1 1
CYS 14 14 1 1
GLU 15 15 1 1
SER 16 16 1 1
CYS 17 17 1 1
VAL 18 18 1 1
GLU 19 19 1 1
ILE 20 20 1 1
ALA 21 21 1 1
PRO 22 22 1 1
GLY 23 23 1 1
ALA 24 24 1 1
PHE 25 25 1 1
ALA 26 26 1 1
MET 27 27 1 1
ASP 28 28 1 1
PRO 29 29 1 1
GLU 30 30 1 1
ILE 31 31 1 1
GLU 32 32 1 1
LYS 33 33 1 1
ALA 34 34 1 1
TYR 35 35 1 1
VAL 36 36 1 1
LYS 37 37 1 1
ASP 38 38 1 1
VAL 39 39 1 1
GLU 40 40 1 1
GLY 41 41 1 1
ALA 42 42 1 1
SER 43 43 1 1
GLN 44 44 1 1
GLU 45 45 1 1
GLU 46 46 1 1
VAL 47 47 1 1
GLU 48 48 1 1
GLU 49 49 1 1
ALA 50 50 1 1
MET 51 51 1 1
ASP 52 52 1 1
THR 53 53 1 1
CYS 54 54 1 1
PRO 55 55 1 1
VAL 56 56 1 1
GLN 57 57 1 1
CYS 58 58 1 1
ILE 59 59 1 1
HIS 60 60 1 1
TRP 61 61 1 1
GLU 62 62 1 1
ASP 63 63 1 1
GLU 64 64 1 1
stop_
save_
save_IRON_SULFUR_CLUSTER
_Entity.Sf_category entity
_Entity.Entry_ID 1
_Entity.ID 2
_Entity.Name "IRON SULFUR CLUSTER"
_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 SF4 $SF4 1 2
stop_
save_
save_SF4
_Chem_comp.Sf_category chem_comp
_Chem_comp.Entry_ID 1
_Chem_comp.ID SF4
_Chem_comp.Type non-polymer
save_
save_CNS/XPLOR_distance_constraints_2_1
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID 1
_Distance_constraint_list.ID 1
_Distance_constraint_list.Constraint_type NOE
_Distance_constraint_list.Constraint_file_ID .
_Distance_constraint_list.Block_ID .
loop_
_Dist_constraint_tree.Constraint_ID
_Dist_constraint_tree.Node_ID
_Dist_constraint_tree.Down_node_ID
_Dist_constraint_tree.Right_node_ID
_Dist_constraint_tree.Logic_operation
_Dist_constraint_tree.Entry_ID
_Dist_constraint_tree.Distance_constraint_list_ID
1 1 . . . 1 1
2 1 . . . 1 1
3 1 . . . 1 1
4 1 . . . 1 1
5 1 . . . 1 1
6 1 . . . 1 1
7 1 . . . 1 1
8 1 . . . 1 1
9 1 . . . 1 1
10 1 . . . 1 1
11 1 . . . 1 1
12 1 . . . 1 1
13 1 . . . 1 1
14 1 . . . 1 1
15 1 . . . 1 1
16 1 . . . 1 1
17 1 . . . 1 1
18 1 . . . 1 1
19 1 . . . 1 1
20 1 . . . 1 1
21 1 . . . 1 1
22 1 . . . 1 1
23 1 . . . 1 1
24 1 . . . 1 1
25 1 . . . 1 1
26 1 . . . 1 1
27 1 . . . 1 1
28 1 . . . 1 1
29 1 . . . 1 1
30 1 . . . 1 1
31 1 . . . 1 1
32 1 . . . 1 1
33 1 . . . 1 1
34 1 . . . 1 1
35 1 . . . 1 1
36 1 . . . 1 1
37 1 . . . 1 1
38 1 . . . 1 1
39 1 . . . 1 1
40 1 . . . 1 1
41 1 . . . 1 1
42 1 . . . 1 1
43 1 . . . 1 1
44 1 . . . 1 1
45 1 . . . 1 1
46 1 . . . 1 1
47 1 . . . 1 1
48 1 . . . 1 1
49 1 . . . 1 1
50 1 . . . 1 1
51 1 . . . 1 1
52 1 . . . 1 1
53 1 . . . 1 1
54 1 . . . 1 1
55 1 . . . 1 1
56 1 . . . 1 1
57 1 . . . 1 1
58 1 . . . 1 1
59 1 . . . 1 1
60 1 . . . 1 1
61 1 . . . 1 1
62 1 . . . 1 1
63 1 . . . 1 1
64 1 . . . 1 1
65 1 . . . 1 1
66 1 . . . 1 1
67 1 . . . 1 1
68 1 . . . 1 1
69 1 . . . 1 1
70 1 . . . 1 1
71 1 . . . 1 1
72 1 . . . 1 1
73 1 . . . 1 1
74 1 . . . 1 1
75 1 . . . 1 1
76 1 . . . 1 1
77 1 . . . 1 1
78 1 . . . 1 1
79 1 . . . 1 1
80 1 . . . 1 1
81 1 . . . 1 1
82 1 . . . 1 1
83 1 . . . 1 1
84 1 . . . 1 1
85 1 . . . 1 1
86 1 . . . 1 1
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88 1 . . . 1 1
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90 1 . . . 1 1
91 1 . . . 1 1
92 1 . . . 1 1
93 1 . . . 1 1
94 1 . . . 1 1
95 1 . . . 1 1
96 1 . . . 1 1
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
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120 1 . . . 1 1
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122 1 . . . 1 1
123 1 . . . 1 1
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125 1 . . . 1 1
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127 1 . . . 1 1
128 1 . . . 1 1
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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
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148 1 . . . 1 1
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159 1 . . . 1 1
160 1 . . . 1 1
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162 1 . . . 1 1
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165 1 . . . 1 1
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168 1 . . . 1 1
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170 1 . . . 1 1
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198 1 . . . 1 1
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200 1 . . . 1 1
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202 1 . . . 1 1
203 1 . . . 1 1
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205 1 . . . 1 1
206 1 . . . 1 1
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215 1 . . . 1 1
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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
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230 1 . . . 1 1
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232 1 . . . 1 1
233 1 . . . 1 1
234 1 . . . 1 1
235 1 . . . 1 1
236 1 . . . 1 1
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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
408 1 . . . 1 1
409 1 . . . 1 1
410 1 . . . 1 1
411 1 . . . 1 1
412 1 . . . 1 1
413 1 . . . 1 1
414 1 . . . 1 1
415 1 . . . 1 1
416 1 . . . 1 1
417 1 . . . 1 1
418 1 . . . 1 1
419 1 . . . 1 1
420 1 . . . 1 1
421 1 . . . 1 1
422 1 . . . 1 1
423 1 . . . 1 1
424 1 . . . 1 1
425 1 . . . 1 1
426 1 . . . 1 1
427 1 . . . 1 1
428 1 . . . 1 1
429 1 . . . 1 1
430 1 . . . 1 1
431 1 . . . 1 1
432 1 . . . 1 1
433 1 . . . 1 1
434 1 . . . 1 1
435 1 . . . 1 1
436 1 . . . 1 1
437 1 . . . 1 1
438 1 . . . 1 1
439 1 . . . 1 1
440 1 . . . 1 1
441 1 . . . 1 1
442 1 . . . 1 1
443 1 . . . 1 1
444 1 . . . 1 1
445 1 . . . 1 1
446 1 . . . 1 1
447 1 . . . 1 1
448 1 . . . 1 1
449 1 . . . 1 1
450 1 . . . 1 1
451 1 . . . 1 1
452 1 . . . 1 1
453 1 . . . 1 1
454 1 . . . 1 1
455 1 . . . 1 1
456 1 . . . 1 1
457 1 . . . 1 1
458 1 . . . 1 1
459 1 . . . 1 1
460 1 . . . 1 1
461 1 . . . 1 1
462 1 . . . 1 1
463 1 . . . 1 1
464 1 . . . 1 1
465 1 . . . 1 1
466 1 . . . 1 1
467 1 . . . 1 1
468 1 . . . 1 1
469 1 . . . 1 1
470 1 . . . 1 1
471 1 . . . 1 1
472 1 . . . 1 1
473 1 . . . 1 1
474 1 . . . 1 1
475 1 . . . 1 1
476 1 . . . 1 1
477 1 . . . 1 1
478 1 . . . 1 1
479 1 . . . 1 1
480 1 . . . 1 1
481 1 . . . 1 1
482 1 . . . 1 1
483 1 . . . 1 1
484 1 . . . 1 1
485 1 . . . 1 1
486 1 . . . 1 1
487 1 . . . 1 1
488 1 . . . 1 1
489 1 . . . 1 1
490 1 . . . 1 1
491 1 . . . 1 1
492 1 . . . 1 1
493 1 . . . 1 1
494 1 . . . 1 1
495 1 . . . 1 1
496 1 . . . 1 1
497 1 . . . 1 1
498 1 . . . 1 1
499 1 . . . 1 1
500 1 . . . 1 1
501 1 . . . 1 1
502 1 . . . 1 1
503 1 . . . 1 1
504 1 . . . 1 1
505 1 . . . 1 1
506 1 . . . 1 1
507 1 . . . 1 1
508 1 . . . 1 1
509 1 . . . 1 1
510 1 . . . 1 1
511 1 . . . 1 1
512 1 . . . 1 1
513 1 . . . 1 1
514 1 . . . 1 1
515 1 . . . 1 1
516 1 . . . 1 1
517 1 . . . 1 1
518 1 . . . 1 1
519 1 . . . 1 1
520 1 . . . 1 1
521 1 . . . 1 1
522 1 . . . 1 1
523 1 . . . 1 1
524 1 . . . 1 1
525 1 . . . 1 1
526 1 . . . 1 1
527 1 . . . 1 1
528 1 . . . 1 1
529 1 . . . 1 1
530 1 . . . 1 1
531 1 . . . 1 1
532 1 . . . 1 1
533 1 . . . 1 1
534 1 . . . 1 1
535 1 . . . 1 1
536 1 . . . 1 1
537 1 . . . 1 1
538 1 . . . 1 1
539 1 . . . 1 1
540 1 . . . 1 1
541 1 . . . 1 1
542 1 . . . 1 1
543 1 . . . 1 1
544 1 . . . 1 1
545 1 . . . 1 1
546 1 . . . 1 1
547 1 . . . 1 1
548 1 . . . 1 1
549 1 . . . 1 1
550 1 . . . 1 1
551 1 . . . 1 1
552 1 . . . 1 1
553 1 . . . 1 1
554 1 . . . 1 1
555 1 . . . 1 1
556 1 . . . 1 1
557 1 . . . 1 1
558 1 . . . 1 1
559 1 . . . 1 1
560 1 . . . 1 1
561 1 . . . 1 1
562 1 . . . 1 1
563 1 . . . 1 1
564 1 . . . 1 1
stop_
loop_
_Dist_constraint.Tree_node_member_constraint_ID
_Dist_constraint.Tree_node_member_node_ID
_Dist_constraint.Constraint_tree_node_member_ID
_Dist_constraint.Entity_assembly_ID
_Dist_constraint.Entity_ID
_Dist_constraint.Comp_index_ID
_Dist_constraint.Comp_ID
_Dist_constraint.Atom_ID
_Dist_constraint.Auth_asym_ID
_Dist_constraint.Auth_seq_ID
_Dist_constraint.Auth_comp_ID
_Dist_constraint.Auth_atom_ID
_Dist_constraint.Entry_ID
_Dist_constraint.Distance_constraint_list_ID
1 1 1 1 1 2 ARG HA . 2 . HA 1 1
1 1 2 1 1 3 LYS H . 3 . HN 1 1
2 1 1 1 1 3 LYS H . 3 . HN 1 1
2 1 2 1 1 3 LYS HA . 3 . HA 1 1
3 1 1 1 1 3 LYS H . 3 . HN 1 1
3 1 2 1 1 3 LYS HB2 . 3 . HB2 1 1
4 1 1 1 1 3 LYS H . 3 . HN 1 1
4 1 2 1 1 3 LYS HB3 . 3 . HB1 1 1
5 1 1 1 1 3 LYS H . 3 . HN 1 1
5 1 2 1 1 4 PHE HA . 4 . HA 1 1
6 1 1 1 1 3 LYS H . 3 . HN 1 1
6 1 2 1 1 62 GLU O . 62 . O 1 1
7 1 1 1 1 3 LYS H . 3 . HN 1 1
7 1 2 1 1 63 ASP HA . 63 . HA 1 1
8 1 1 1 1 3 LYS HA . 3 . HA 1 1
8 1 2 1 1 4 PHE H . 4 . HN 1 1
9 1 1 1 1 3 LYS HA . 3 . HA 1 1
9 1 2 1 1 39 VAL MG1 . 39 . HG1# 1 1
10 1 1 1 1 3 LYS HB2 . 3 . HB2 1 1
10 1 2 1 1 4 PHE H . 4 . HN 1 1
11 1 1 1 1 3 LYS HB3 . 3 . HB1 1 1
11 1 2 1 1 4 PHE H . 4 . HN 1 1
12 1 1 1 1 3 LYS N . 3 . N 1 1
12 1 2 1 1 62 GLU O . 62 . O 1 1
13 1 1 1 1 3 LYS O . 3 . O 1 1
13 1 2 1 1 62 GLU H . 62 . HN 1 1
14 1 1 1 1 3 LYS O . 3 . O 1 1
14 1 2 1 1 62 GLU N . 62 . N 1 1
15 1 1 1 1 4 PHE CG . 4 . CG 1 1
15 1 2 1 1 5 TYR H . 5 . HN 1 1
16 1 1 1 1 4 PHE CG . 4 . CG 1 1
16 1 2 1 1 47 VAL MG1 . 47 . HG1# 1 1
17 1 1 1 1 4 PHE CG . 4 . CG 1 1
17 1 2 1 1 59 ILE QG . 59 . HG1# 1 1
18 1 1 1 1 4 PHE CG . 4 . CG 1 1
18 1 2 1 1 62 GLU H . 62 . HN 1 1
19 1 1 1 1 4 PHE CZ . 4 . CZ 1 1
19 1 2 1 1 24 ALA MB . 24 . HB# 1 1
20 1 1 1 1 4 PHE CZ . 4 . CZ 1 1
20 1 2 1 1 36 VAL MG2 . 36 . HG1# 1 1
21 1 1 1 1 4 PHE CZ . 4 . CZ 1 1
21 1 2 1 1 39 VAL HA . 39 . HA 1 1
22 1 1 1 1 4 PHE CZ . 4 . CZ 1 1
22 1 2 1 1 39 VAL MG1 . 39 . HG1# 1 1
23 1 1 1 1 4 PHE CZ . 4 . CZ 1 1
23 1 2 1 1 47 VAL MG1 . 47 . HG1# 1 1
24 1 1 1 1 4 PHE H . 4 . HN 1 1
24 1 2 1 1 5 TYR H . 5 . HN 1 1
25 1 1 1 1 4 PHE H . 4 . HN 1 1
25 1 2 1 1 5 TYR HB3 . 5 . HB1 1 1
26 1 1 1 1 4 PHE H . 4 . HN 1 1
26 1 2 1 1 36 VAL MG2 . 36 . HG1# 1 1
27 1 1 1 1 4 PHE H . 4 . HN 1 1
27 1 2 1 1 39 VAL MG1 . 39 . HG1# 1 1
28 1 1 1 1 4 PHE H . 4 . HN 1 1
28 1 2 1 1 61 TRP HA . 61 . HA 1 1
29 1 1 1 1 4 PHE H . 4 . HN 1 1
29 1 2 1 1 62 GLU HB3 . 62 . HB1 1 1
30 1 1 1 1 4 PHE HA . 4 . HA 1 1
30 1 2 1 1 4 PHE HB2 . 4 . HB2 1 1
31 1 1 1 1 4 PHE HA . 4 . HA 1 1
31 1 2 1 1 4 PHE HB3 . 4 . HB1 1 1
32 1 1 1 1 4 PHE HA . 4 . HA 1 1
32 1 2 1 1 5 TYR CG . 5 . CG 1 1
33 1 1 1 1 4 PHE HA . 4 . HA 1 1
33 1 2 1 1 5 TYR H . 5 . HN 1 1
34 1 1 1 1 4 PHE HA . 4 . HA 1 1
34 1 2 1 1 5 TYR HB3 . 5 . HB1 1 1
35 1 1 1 1 4 PHE HA . 4 . HA 1 1
35 1 2 1 1 51 MET ME . 51 . HE# 1 1
36 1 1 1 1 4 PHE HA . 4 . HA 1 1
36 1 2 1 1 61 TRP HA . 61 . HA 1 1
37 1 1 1 1 4 PHE HA . 4 . HA 1 1
37 1 2 1 1 61 TRP HB3 . 61 . HB1 1 1
38 1 1 1 1 4 PHE HA . 4 . HA 1 1
38 1 2 1 1 61 TRP HE3 . 61 . HE3 1 1
39 1 1 1 1 4 PHE HA . 4 . HA 1 1
39 1 2 1 1 62 GLU H . 62 . HN 1 1
40 1 1 1 1 4 PHE HB2 . 4 . HB2 1 1
40 1 2 1 1 5 TYR H . 5 . HN 1 1
41 1 1 1 1 4 PHE HB2 . 4 . HB2 1 1
41 1 2 1 1 51 MET ME . 51 . HE# 1 1
42 1 1 1 1 4 PHE HB2 . 4 . HB2 1 1
42 1 2 1 1 59 ILE QG . 59 . HG1# 1 1
43 1 1 1 1 4 PHE HB2 . 4 . HB2 1 1
43 1 2 1 1 61 TRP HA . 61 . HA 1 1
44 1 1 1 1 4 PHE HB2 . 4 . HB2 1 1
44 1 2 1 1 61 TRP HE3 . 61 . HE3 1 1
45 1 1 1 1 4 PHE HB3 . 4 . HB1 1 1
45 1 2 1 1 5 TYR H . 5 . HN 1 1
46 1 1 1 1 4 PHE HB3 . 4 . HB1 1 1
46 1 2 1 1 51 MET ME . 51 . HE# 1 1
47 1 1 1 1 4 PHE HB3 . 4 . HB1 1 1
47 1 2 1 1 61 TRP HA . 61 . HA 1 1
48 1 1 1 1 4 PHE HB3 . 4 . HB1 1 1
48 1 2 1 1 61 TRP HE3 . 61 . HE3 1 1
49 1 1 1 1 4 PHE HB3 . 4 . HB1 1 1
49 1 2 1 1 61 TRP HZ3 . 61 . HZ3 1 1
50 1 1 1 1 5 TYR CG . 5 . CG 1 1
50 1 2 1 1 6 VAL H . 6 . HN 1 1
51 1 1 1 1 5 TYR CG . 5 . CG 1 1
51 1 2 1 1 36 VAL MG2 . 36 . HG1# 1 1
52 1 1 1 1 5 TYR CG . 5 . CG 1 1
52 1 2 1 1 62 GLU H . 62 . HN 1 1
53 1 1 1 1 5 TYR CG . 5 . CG 1 1
53 1 2 1 1 62 GLU HA . 62 . HA 1 1
54 1 1 1 1 5 TYR CZ . 5 . CZ 1 1
54 1 2 1 1 6 VAL HA . 6 . HA 1 1
55 1 1 1 1 5 TYR CZ . 5 . CZ 1 1
55 1 2 1 1 7 ASP HA . 7 . HA 1 1
56 1 1 1 1 5 TYR CZ . 5 . CZ 1 1
56 1 2 1 1 7 ASP HB2 . 7 . HB2 1 1
57 1 1 1 1 5 TYR CZ . 5 . CZ 1 1
57 1 2 1 1 60 HIS HB3 . 60 . HB1 1 1
58 1 1 1 1 5 TYR CZ . 5 . CZ 1 1
58 1 2 1 1 62 GLU HA . 62 . HA 1 1
59 1 1 1 1 5 TYR H . 5 . HN 1 1
59 1 2 1 1 6 VAL HA . 6 . HA 1 1
60 1 1 1 1 5 TYR H . 5 . HN 1 1
60 1 2 1 1 6 VAL MG1 . 6 . HG1# 1 1
61 1 1 1 1 5 TYR H . 5 . HN 1 1
61 1 2 1 1 51 MET ME . 51 . HE# 1 1
62 1 1 1 1 5 TYR H . 5 . HN 1 1
62 1 2 1 1 59 ILE QG . 59 . HG1# 1 1
63 1 1 1 1 5 TYR H . 5 . HN 1 1
63 1 2 1 1 60 HIS H . 60 . HN 1 1
64 1 1 1 1 5 TYR H . 5 . HN 1 1
64 1 2 1 1 60 HIS HB2 . 60 . HB2 1 1
65 1 1 1 1 5 TYR H . 5 . HN 1 1
65 1 2 1 1 61 TRP HA . 61 . HA 1 1
66 1 1 1 1 5 TYR HA . 5 . HA 1 1
66 1 2 1 1 5 TYR HB2 . 5 . HB2 1 1
67 1 1 1 1 5 TYR HA . 5 . HA 1 1
67 1 2 1 1 5 TYR HB3 . 5 . HB1 1 1
68 1 1 1 1 5 TYR HA . 5 . HA 1 1
68 1 2 1 1 6 VAL H . 6 . HN 1 1
69 1 1 1 1 5 TYR HA . 5 . HA 1 1
69 1 2 1 1 36 VAL H . 36 . HN 1 1
70 1 1 1 1 5 TYR HA . 5 . HA 1 1
70 1 2 1 1 36 VAL HB . 36 . HB 1 1
71 1 1 1 1 5 TYR HA . 5 . HA 1 1
71 1 2 1 1 36 VAL MG2 . 36 . HG1# 1 1
72 1 1 1 1 5 TYR HB2 . 5 . HB2 1 1
72 1 2 1 1 6 VAL H . 6 . HN 1 1
73 1 1 1 1 5 TYR HB3 . 5 . HB1 1 1
73 1 2 1 1 6 VAL H . 6 . HN 1 1
74 1 1 1 1 5 TYR O . 5 . O 1 1
74 1 2 1 1 60 HIS H . 60 . HN 1 1
75 1 1 1 1 5 TYR O . 5 . O 1 1
75 1 2 1 1 60 HIS N . 60 . N 1 1
76 1 1 1 1 6 VAL H . 6 . HN 1 1
76 1 2 1 1 7 ASP HA . 7 . HA 1 1
77 1 1 1 1 6 VAL H . 6 . HN 1 1
77 1 2 1 1 35 TYR HA . 35 . HA 1 1
78 1 1 1 1 6 VAL H . 6 . HN 1 1
78 1 2 1 1 36 VAL HA . 36 . HA 1 1
79 1 1 1 1 6 VAL H . 6 . HN 1 1
79 1 2 1 1 36 VAL HB . 36 . HB 1 1
80 1 1 1 1 6 VAL H . 6 . HN 1 1
80 1 2 1 1 36 VAL MG2 . 36 . HG1# 1 1
81 1 1 1 1 6 VAL HA . 6 . HA 1 1
81 1 2 1 1 7 ASP H . 7 . HN 1 1
82 1 1 1 1 6 VAL HA . 6 . HA 1 1
82 1 2 1 1 59 ILE HA . 59 . HA 1 1
83 1 1 1 1 6 VAL HB . 6 . HB 1 1
83 1 2 1 1 8 GLN H . 8 . HN 1 1
84 1 1 1 1 6 VAL HB . 6 . HB 1 1
84 1 2 1 1 8 GLN HE22 . 8 . HE22 1 1
85 1 1 1 1 6 VAL HB . 6 . HB 1 1
85 1 2 1 1 35 TYR HA . 35 . HA 1 1
86 1 1 1 1 6 VAL HB . 6 . HB 1 1
86 1 2 1 1 36 VAL H . 36 . HN 1 1
87 1 1 1 1 6 VAL MG1 . 6 . HG1# 1 1
87 1 2 1 1 7 ASP H . 7 . HN 1 1
88 1 1 1 1 6 VAL MG1 . 6 . HG1# 1 1
88 1 2 1 1 7 ASP HA . 7 . HA 1 1
89 1 1 1 1 6 VAL MG1 . 6 . HG1# 1 1
89 1 2 1 1 9 ASP H . 9 . HN 1 1
90 1 1 1 1 6 VAL MG1 . 6 . HG1# 1 1
90 1 2 1 1 36 VAL MG2 . 36 . HG1# 1 1
91 1 1 1 1 7 ASP H . 7 . HN 1 1
91 1 2 1 1 7 ASP HB2 . 7 . HB2 1 1
92 1 1 1 1 7 ASP H . 7 . HN 1 1
92 1 2 1 1 7 ASP HB3 . 7 . HB1 1 1
93 1 1 1 1 7 ASP H . 7 . HN 1 1
93 1 2 1 1 8 GLN HA . 8 . HA 1 1
94 1 1 1 1 7 ASP H . 7 . HN 1 1
94 1 2 1 1 58 CYS HB3 . 58 . HB1 1 1
95 1 1 1 1 7 ASP H . 7 . HN 1 1
95 1 2 1 1 59 ILE HA . 59 . HA 1 1
96 1 1 1 1 7 ASP H . 7 . HN 1 1
96 1 2 1 1 60 HIS HE1 . 60 . HE1 1 1
97 1 1 1 1 7 ASP HA . 7 . HA 1 1
97 1 2 1 1 7 ASP HB2 . 7 . HB2 1 1
98 1 1 1 1 7 ASP HA . 7 . HA 1 1
98 1 2 1 1 8 GLN H . 8 . HN 1 1
99 1 1 1 1 7 ASP HA . 7 . HA 1 1
99 1 2 1 1 8 GLN HA . 8 . HA 1 1
100 1 1 1 1 7 ASP HA . 7 . HA 1 1
100 1 2 1 1 9 ASP H . 9 . HN 1 1
101 1 1 1 1 7 ASP HA . 7 . HA 1 1
101 1 2 1 1 25 PHE CZ . 25 . CZ 1 1
102 1 1 1 1 7 ASP HB2 . 7 . HB2 1 1
102 1 2 1 1 8 GLN H . 8 . HN 1 1
103 1 1 1 1 7 ASP HB2 . 7 . HB2 1 1
103 1 2 1 1 58 CYS HB3 . 58 . HB1 1 1
104 1 1 1 1 7 ASP HB2 . 7 . HB2 1 1
104 1 2 1 1 60 HIS HE1 . 60 . HE1 1 1
105 1 1 1 1 7 ASP HB3 . 7 . HB1 1 1
105 1 2 1 1 10 GLU H . 10 . HN 1 1
106 1 1 1 1 7 ASP HB3 . 7 . HB1 1 1
106 1 2 1 1 58 CYS HA . 58 . HA 1 1
107 1 1 1 1 7 ASP HB3 . 7 . HB1 1 1
107 1 2 1 1 58 CYS HB3 . 58 . HB1 1 1
108 1 1 1 1 7 ASP HB3 . 7 . HB1 1 1
108 1 2 1 1 60 HIS HE1 . 60 . HE1 1 1
109 1 1 1 1 8 GLN H . 8 . HN 1 1
109 1 2 1 1 8 GLN HB3 . 8 . HB1 1 1
110 1 1 1 1 8 GLN H . 8 . HN 1 1
110 1 2 1 1 9 ASP H . 9 . HN 1 1
111 1 1 1 1 8 GLN H . 8 . HN 1 1
111 1 2 1 1 9 ASP HB2 . 9 . HB2 1 1
112 1 1 1 1 8 GLN HA . 8 . HA 1 1
112 1 2 1 1 10 GLU H . 10 . HN 1 1
113 1 1 1 1 8 GLN HA . 8 . HA 1 1
113 1 2 1 1 11 CYS H . 11 . HN 1 1
114 1 1 1 1 8 GLN HA . 8 . HA 1 1
114 1 2 1 1 11 CYS HB2 . 11 . HB1 1 1
115 1 1 1 1 8 GLN HA . 8 . HA 1 1
115 1 2 1 1 11 CYS HB3 . 11 . HB2 1 1
116 1 1 1 1 8 GLN HA . 8 . HA 1 1
116 1 2 1 1 33 LYS HB3 . 33 . HB1 1 1
117 1 1 1 1 8 GLN HB2 . 8 . HB2 1 1
117 1 2 1 1 9 ASP H . 9 . HN 1 1
118 1 1 1 1 8 GLN HB3 . 8 . HB1 1 1
118 1 2 1 1 9 ASP H . 9 . HN 1 1
119 1 1 1 1 8 GLN HB3 . 8 . HB1 1 1
119 1 2 1 1 11 CYS HB2 . 11 . HB1 1 1
120 1 1 1 1 8 GLN HE21 . 8 . HE21 1 1
120 1 2 1 1 35 TYR QB . 35 . HB# 1 1
121 1 1 1 1 8 GLN HE22 . 8 . HE22 1 1
121 1 2 1 1 35 TYR QB . 35 . HB# 1 1
122 1 1 1 1 9 ASP H . 9 . HN 1 1
122 1 2 1 1 9 ASP HB2 . 9 . HB2 1 1
123 1 1 1 1 9 ASP H . 9 . HN 1 1
123 1 2 1 1 9 ASP HB3 . 9 . HB1 1 1
124 1 1 1 1 9 ASP H . 9 . HN 1 1
124 1 2 1 1 10 GLU H . 10 . HN 1 1
125 1 1 1 1 9 ASP H . 9 . HN 1 1
125 1 2 1 1 10 GLU HB3 . 10 . HB1 1 1
126 1 1 1 1 9 ASP HA . 9 . HA 1 1
126 1 2 1 1 9 ASP HB3 . 9 . HB1 1 1
127 1 1 1 1 9 ASP HB2 . 9 . HB2 1 1
127 1 2 1 1 10 GLU H . 10 . HN 1 1
128 1 1 1 1 9 ASP HB3 . 9 . HB1 1 1
128 1 2 1 1 10 GLU H . 10 . HN 1 1
129 1 1 1 1 9 ASP HB3 . 9 . HB1 1 1
129 1 2 1 1 10 GLU HA . 10 . HA 1 1
130 1 1 1 1 10 GLU H . 10 . HN 1 1
130 1 2 1 1 10 GLU HB2 . 10 . HB2 1 1
131 1 1 1 1 10 GLU H . 10 . HN 1 1
131 1 2 1 1 10 GLU HG3 . 10 . HG1 1 1
132 1 1 1 1 10 GLU HA . 10 . HA 1 1
132 1 2 1 1 10 GLU HB2 . 10 . HB2 1 1
133 1 1 1 1 10 GLU HB2 . 10 . HB2 1 1
133 1 2 1 1 58 CYS HA . 58 . HA 1 1
134 1 1 1 1 10 GLU HB2 . 10 . HB2 1 1
134 1 2 1 1 58 CYS HB3 . 58 . HB1 1 1
135 1 1 1 1 11 CYS H . 11 . HN 1 1
135 1 2 1 1 33 LYS QB . 33 . HB# 1 1
136 1 1 1 1 11 CYS HB2 . 11 . HB1 1 1
136 1 2 1 1 33 LYS QB . 33 . HB# 1 1
137 1 1 1 1 11 CYS HB3 . 11 . HB2 1 1
137 1 2 1 1 33 LYS HA . 33 . HA 1 1
138 1 1 1 1 11 CYS HB3 . 11 . HB2 1 1
138 1 2 1 1 33 LYS QB . 33 . HB# 1 1
139 1 1 1 1 11 CYS SG . 11 . SG 1 1
139 1 2 1 1 14 CYS SG . 14 . SG 1 1
140 1 1 1 1 11 CYS SG . 11 . SG 1 1
140 1 2 1 1 17 CYS SG . 17 . SG 1 1
141 1 1 1 1 11 CYS SG . 11 . SG 1 1
141 1 2 1 1 54 CYS SG . 54 . SG 1 1
142 1 1 1 1 12 ILE QG . 12 . HG1# 1 1
142 1 2 1 1 14 CYS HB3 . 14 . HB2 1 1
143 1 1 1 1 14 CYS HA . 14 . HA 1 1
143 1 2 1 1 14 CYS HB2 . 14 . HB1 1 1
144 1 1 1 1 14 CYS HA . 14 . HA 1 1
144 1 2 1 1 14 CYS HB3 . 14 . HB2 1 1
145 1 1 1 1 14 CYS SG . 14 . SG 1 1
145 1 2 1 1 17 CYS SG . 17 . SG 1 1
146 1 1 1 1 14 CYS SG . 14 . SG 1 1
146 1 2 1 1 54 CYS SG . 54 . SG 1 1
147 1 1 1 1 15 GLU O . 15 . O 1 1
147 1 2 1 1 19 GLU H . 19 . HN 1 1
148 1 1 1 1 15 GLU O . 15 . O 1 1
148 1 2 1 1 19 GLU N . 19 . N 1 1
149 1 1 1 1 16 SER O . 16 . O 1 1
149 1 2 1 1 20 ILE H . 20 . HN 1 1
150 1 1 1 1 16 SER O . 16 . O 1 1
150 1 2 1 1 20 ILE N . 20 . N 1 1
151 1 1 1 1 17 CYS HB2 . 17 . HB1 1 1
151 1 2 1 1 25 PHE CG . 25 . CG 1 1
152 1 1 1 1 17 CYS HB2 . 17 . HB1 1 1
152 1 2 1 1 25 PHE CZ . 25 . CZ 1 1
153 1 1 1 1 17 CYS HB2 . 17 . HB1 1 1
153 1 2 1 1 25 PHE HB2 . 25 . HB2 1 1
154 1 1 1 1 17 CYS HB2 . 17 . HB1 1 1
154 1 2 1 1 25 PHE HB3 . 25 . HB1 1 1
155 1 1 1 1 17 CYS HB2 . 17 . HB1 1 1
155 1 2 1 1 50 ALA HA . 50 . HA 1 1
156 1 1 1 1 17 CYS HB2 . 17 . HB1 1 1
156 1 2 1 1 50 ALA MB . 50 . HB# 1 1
157 1 1 1 1 17 CYS O . 17 . O 1 1
157 1 2 1 1 21 ALA H . 21 . HN 1 1
158 1 1 1 1 17 CYS O . 17 . O 1 1
158 1 2 1 1 21 ALA N . 21 . N 1 1
159 1 1 1 1 17 CYS SG . 17 . SG 1 1
159 1 2 1 1 54 CYS SG . 54 . SG 1 1
160 1 1 1 1 18 VAL H . 18 . HN 1 1
160 1 2 1 1 18 VAL HA . 18 . HA 1 1
161 1 1 1 1 18 VAL H . 18 . HN 1 1
161 1 2 1 1 18 VAL HB . 18 . HB 1 1
162 1 1 1 1 18 VAL HA . 18 . HA 1 1
162 1 2 1 1 20 ILE H . 20 . HN 1 1
163 1 1 1 1 18 VAL HA . 18 . HA 1 1
163 1 2 1 1 21 ALA H . 21 . HN 1 1
164 1 1 1 1 18 VAL HA . 18 . HA 1 1
164 1 2 1 1 25 PHE H . 25 . HN 1 1
165 1 1 1 1 18 VAL HA . 18 . HA 1 1
165 1 2 1 1 25 PHE HB2 . 25 . HB2 1 1
166 1 1 1 1 18 VAL HA . 18 . HA 1 1
166 1 2 1 1 25 PHE HB3 . 25 . HB1 1 1
167 1 1 1 1 18 VAL HB . 18 . HB 1 1
167 1 2 1 1 19 GLU H . 19 . HN 1 1
168 1 1 1 1 18 VAL MG1 . 18 . HG1# 1 1
168 1 2 1 1 19 GLU HA . 19 . HA 1 1
169 1 1 1 1 18 VAL MG1 . 18 . HG1# 1 1
169 1 2 1 1 26 ALA HA . 26 . HA 1 1
170 1 1 1 1 18 VAL MG1 . 18 . HG1# 1 1
170 1 2 1 1 27 MET H . 27 . HN 1 1
171 1 1 1 1 19 GLU H . 19 . HN 1 1
171 1 2 1 1 19 GLU HB2 . 19 . HB2 1 1
172 1 1 1 1 19 GLU H . 19 . HN 1 1
172 1 2 1 1 19 GLU HB3 . 19 . HB1 1 1
173 1 1 1 1 19 GLU H . 19 . HN 1 1
173 1 2 1 1 19 GLU HG2 . 19 . HG2 1 1
174 1 1 1 1 19 GLU H . 19 . HN 1 1
174 1 2 1 1 19 GLU HG3 . 19 . HG1 1 1
175 1 1 1 1 19 GLU H . 19 . HN 1 1
175 1 2 1 1 20 ILE H . 20 . HN 1 1
176 1 1 1 1 19 GLU H . 19 . HN 1 1
176 1 2 1 1 21 ALA H . 21 . HN 1 1
177 1 1 1 1 19 GLU HA . 19 . HA 1 1
177 1 2 1 1 19 GLU HB2 . 19 . HB2 1 1
178 1 1 1 1 19 GLU HA . 19 . HA 1 1
178 1 2 1 1 21 ALA H . 21 . HN 1 1
179 1 1 1 1 19 GLU HB2 . 19 . HB2 1 1
179 1 2 1 1 20 ILE H . 20 . HN 1 1
180 1 1 1 1 19 GLU HB3 . 19 . HB1 1 1
180 1 2 1 1 20 ILE H . 20 . HN 1 1
181 1 1 1 1 19 GLU HB3 . 19 . HB1 1 1
181 1 2 1 1 20 ILE HA . 20 . HA 1 1
182 1 1 1 1 20 ILE H . 20 . HN 1 1
182 1 2 1 1 20 ILE HB . 20 . HB 1 1
183 1 1 1 1 20 ILE H . 20 . HN 1 1
183 1 2 1 1 20 ILE HG12 . 20 . HG12 1 1
184 1 1 1 1 20 ILE H . 20 . HN 1 1
184 1 2 1 1 20 ILE HG13 . 20 . HG11 1 1
185 1 1 1 1 20 ILE H . 20 . HN 1 1
185 1 2 1 1 21 ALA H . 21 . HN 1 1
186 1 1 1 1 20 ILE HA . 20 . HA 1 1
186 1 2 1 1 20 ILE HG12 . 20 . HG12 1 1
187 1 1 1 1 20 ILE HA . 20 . HA 1 1
187 1 2 1 1 20 ILE HG13 . 20 . HG11 1 1
188 1 1 1 1 20 ILE HA . 20 . HA 1 1
188 1 2 1 1 21 ALA HA . 21 . HA 1 1
189 1 1 1 1 20 ILE HA . 20 . HA 1 1
189 1 2 1 1 22 PRO HD2 . 22 . HD2 1 1
190 1 1 1 1 20 ILE HB . 20 . HB 1 1
190 1 2 1 1 20 ILE HG12 . 20 . HG12 1 1
191 1 1 1 1 20 ILE HB . 20 . HB 1 1
191 1 2 1 1 20 ILE HG13 . 20 . HG11 1 1
192 1 1 1 1 20 ILE HB . 20 . HB 1 1
192 1 2 1 1 21 ALA H . 21 . HN 1 1
193 1 1 1 1 20 ILE QG . 20 . HG1# 1 1
193 1 2 1 1 21 ALA H . 21 . HN 1 1
194 1 1 1 1 20 ILE QG . 20 . HG1# 1 1
194 1 2 1 1 46 GLU HA . 46 . HA 1 1
195 1 1 1 1 20 ILE QG . 20 . HG1# 1 1
195 1 2 1 1 50 ALA H . 50 . HN 1 1
196 1 1 1 1 20 ILE QG . 20 . HG1# 1 1
196 1 2 1 1 50 ALA HA . 50 . HA 1 1
197 1 1 1 1 20 ILE QG . 20 . HG1# 1 1
197 1 2 1 1 53 THR H . 53 . HN 1 1
198 1 1 1 1 20 ILE QG . 20 . HG1# 1 1
198 1 2 1 1 53 THR HB . 53 . HB 1 1
199 1 1 1 1 20 ILE HG13 . 20 . HG11 1 1
199 1 2 1 1 50 ALA HA . 50 . HA 1 1
200 1 1 1 1 21 ALA H . 21 . HN 1 1
200 1 2 1 1 22 PRO HA . 22 . HA 1 1
201 1 1 1 1 21 ALA H . 21 . HN 1 1
201 1 2 1 1 22 PRO HD2 . 22 . HD2 1 1
202 1 1 1 1 21 ALA H . 21 . HN 1 1
202 1 2 1 1 22 PRO HD3 . 22 . HD1 1 1
203 1 1 1 1 21 ALA H . 21 . HN 1 1
203 1 2 1 1 25 PHE CG . 25 . CG 1 1
204 1 1 1 1 21 ALA H . 21 . HN 1 1
204 1 2 1 1 50 ALA MB . 50 . HB# 1 1
205 1 1 1 1 21 ALA HA . 21 . HA 1 1
205 1 2 1 1 22 PRO HD2 . 22 . HD2 1 1
206 1 1 1 1 21 ALA HA . 21 . HA 1 1
206 1 2 1 1 22 PRO HD3 . 22 . HD1 1 1
207 1 1 1 1 21 ALA HA . 21 . HA 1 1
207 1 2 1 1 24 ALA MB . 24 . HB# 1 1
208 1 1 1 1 21 ALA HA . 21 . HA 1 1
208 1 2 1 1 42 ALA MB . 42 . HB# 1 1
209 1 1 1 1 21 ALA MB . 21 . HB# 1 1
209 1 2 1 1 23 GLY H . 23 . HN 1 1
210 1 1 1 1 21 ALA MB . 21 . HB# 1 1
210 1 2 1 1 24 ALA H . 24 . HN 1 1
211 1 1 1 1 21 ALA MB . 21 . HB# 1 1
211 1 2 1 1 25 PHE CG . 25 . CG 1 1
212 1 1 1 1 21 ALA MB . 21 . HB# 1 1
212 1 2 1 1 25 PHE CZ . 25 . CZ 1 1
213 1 1 1 1 21 ALA MB . 21 . HB# 1 1
213 1 2 1 1 25 PHE H . 25 . HN 1 1
214 1 1 1 1 21 ALA MB . 21 . HB# 1 1
214 1 2 1 1 42 ALA HA . 42 . HA 1 1
215 1 1 1 1 21 ALA MB . 21 . HB# 1 1
215 1 2 1 1 46 GLU HA . 46 . HA 1 1
216 1 1 1 1 21 ALA MB . 21 . HB# 1 1
216 1 2 1 1 47 VAL H . 47 . HN 1 1
217 1 1 1 1 21 ALA MB . 21 . HB# 1 1
217 1 2 1 1 47 VAL HA . 47 . HA 1 1
218 1 1 1 1 21 ALA MB . 21 . HB# 1 1
218 1 2 1 1 50 ALA H . 50 . HN 1 1
219 1 1 1 1 21 ALA O . 21 . O 1 1
219 1 2 1 1 25 PHE H . 25 . HN 1 1
220 1 1 1 1 21 ALA O . 21 . O 1 1
220 1 2 1 1 25 PHE N . 25 . N 1 1
221 1 1 1 1 22 PRO HA . 22 . HA 1 1
221 1 2 1 1 25 PHE H . 25 . HN 1 1
222 1 1 1 1 22 PRO HD3 . 22 . HD1 1 1
222 1 2 1 1 23 GLY H . 23 . HN 1 1
223 1 1 1 1 23 GLY H . 23 . HN 1 1
223 1 2 1 1 24 ALA H . 24 . HN 1 1
224 1 1 1 1 23 GLY H . 23 . HN 1 1
224 1 2 1 1 25 PHE H . 25 . HN 1 1
225 1 1 1 1 23 GLY H . 23 . HN 1 1
225 1 2 1 1 41 GLY HA3 . 41 . HA1 1 1
226 1 1 1 1 23 GLY H . 23 . HN 1 1
226 1 2 1 1 42 ALA MB . 42 . HB# 1 1
227 1 1 1 1 23 GLY HA3 . 23 . HA1 1 1
227 1 2 1 1 25 PHE H . 25 . HN 1 1
228 1 1 1 1 24 ALA H . 24 . HN 1 1
228 1 2 1 1 25 PHE HA . 25 . HA 1 1
229 1 1 1 1 24 ALA H . 24 . HN 1 1
229 1 2 1 1 25 PHE HB2 . 25 . HB2 1 1
230 1 1 1 1 24 ALA H . 24 . HN 1 1
230 1 2 1 1 41 GLY HA2 . 41 . HA2 1 1
231 1 1 1 1 24 ALA H . 24 . HN 1 1
231 1 2 1 1 41 GLY HA3 . 41 . HA1 1 1
232 1 1 1 1 24 ALA H . 24 . HN 1 1
232 1 2 1 1 42 ALA MB . 42 . HB# 1 1
233 1 1 1 1 24 ALA HA . 24 . HA 1 1
233 1 2 1 1 37 LYS QG . 37 . HG# 1 1
234 1 1 1 1 24 ALA HA . 24 . HA 1 1
234 1 2 1 1 38 ASP H . 38 . HN 1 1
235 1 1 1 1 24 ALA HA . 24 . HA 1 1
235 1 2 1 1 41 GLY H . 41 . HN 1 1
236 1 1 1 1 24 ALA HA . 24 . HA 1 1
236 1 2 1 1 41 GLY HA3 . 41 . HA1 1 1
237 1 1 1 1 24 ALA MB . 24 . HB# 1 1
237 1 2 1 1 25 PHE CG . 25 . CG 1 1
238 1 1 1 1 24 ALA MB . 24 . HB# 1 1
238 1 2 1 1 36 VAL MG2 . 36 . HG1# 1 1
239 1 1 1 1 24 ALA MB . 24 . HB# 1 1
239 1 2 1 1 38 ASP H . 38 . HN 1 1
240 1 1 1 1 24 ALA MB . 24 . HB# 1 1
240 1 2 1 1 39 VAL HA . 39 . HA 1 1
241 1 1 1 1 24 ALA MB . 24 . HB# 1 1
241 1 2 1 1 41 GLY H . 41 . HN 1 1
242 1 1 1 1 24 ALA MB . 24 . HB# 1 1
242 1 2 1 1 41 GLY HA3 . 41 . HA1 1 1
243 1 1 1 1 24 ALA MB . 24 . HB# 1 1
243 1 2 1 1 42 ALA H . 42 . HN 1 1
244 1 1 1 1 24 ALA MB . 24 . HB# 1 1
244 1 2 1 1 47 VAL MG1 . 47 . HG1# 1 1
245 1 1 1 1 25 PHE CG . 25 . CG 1 1
245 1 2 1 1 36 VAL HA . 36 . HA 1 1
246 1 1 1 1 25 PHE CG . 25 . CG 1 1
246 1 2 1 1 36 VAL MG2 . 36 . HG1# 1 1
247 1 1 1 1 25 PHE CZ . 25 . CZ 1 1
247 1 2 1 1 47 VAL MG1 . 47 . HG1# 1 1
248 1 1 1 1 25 PHE CZ . 25 . CZ 1 1
248 1 2 1 1 59 ILE QG . 59 . HG1# 1 1
249 1 1 1 1 25 PHE H . 25 . HN 1 1
249 1 2 1 1 25 PHE HB2 . 25 . HB2 1 1
250 1 1 1 1 25 PHE HA . 25 . HA 1 1
250 1 2 1 1 26 ALA H . 26 . HN 1 1
251 1 1 1 1 25 PHE HA . 25 . HA 1 1
251 1 2 1 1 26 ALA HA . 26 . HA 1 1
252 1 1 1 1 25 PHE HA . 25 . HA 1 1
252 1 2 1 1 26 ALA MB . 26 . HB# 1 1
253 1 1 1 1 25 PHE HA . 25 . HA 1 1
253 1 2 1 1 35 TYR H . 35 . HN 1 1
254 1 1 1 1 25 PHE HA . 25 . HA 1 1
254 1 2 1 1 36 VAL HA . 36 . HA 1 1
255 1 1 1 1 25 PHE HA . 25 . HA 1 1
255 1 2 1 1 36 VAL MG2 . 36 . HG1# 1 1
256 1 1 1 1 25 PHE HA . 25 . HA 1 1
256 1 2 1 1 37 LYS H . 37 . HN 1 1
257 1 1 1 1 25 PHE HA . 25 . HA 1 1
257 1 2 1 1 38 ASP H . 38 . HN 1 1
258 1 1 1 1 25 PHE HB2 . 25 . HB2 1 1
258 1 2 1 1 26 ALA H . 26 . HN 1 1
259 1 1 1 1 25 PHE HB3 . 25 . HB1 1 1
259 1 2 1 1 26 ALA H . 26 . HN 1 1
260 1 1 1 1 25 PHE HB3 . 25 . HB1 1 1
260 1 2 1 1 35 TYR H . 35 . HN 1 1
261 1 1 1 1 26 ALA H . 26 . HN 1 1
261 1 2 1 1 27 MET H . 27 . HN 1 1
262 1 1 1 1 26 ALA H . 26 . HN 1 1
262 1 2 1 1 35 TYR H . 35 . HN 1 1
263 1 1 1 1 26 ALA H . 26 . HN 1 1
263 1 2 1 1 35 TYR O . 35 . O 1 1
264 1 1 1 1 26 ALA H . 26 . HN 1 1
264 1 2 1 1 36 VAL HA . 36 . HA 1 1
265 1 1 1 1 26 ALA H . 26 . HN 1 1
265 1 2 1 1 37 LYS HG2 . 37 . HG2 1 1
266 1 1 1 1 26 ALA HA . 26 . HA 1 1
266 1 2 1 1 27 MET H . 27 . HN 1 1
267 1 1 1 1 26 ALA HA . 26 . HA 1 1
267 1 2 1 1 35 TYR H . 35 . HN 1 1
268 1 1 1 1 26 ALA MB . 26 . HB# 1 1
268 1 2 1 1 27 MET HA . 27 . HA 1 1
269 1 1 1 1 26 ALA MB . 26 . HB# 1 1
269 1 2 1 1 35 TYR CZ . 35 . CZ 1 1
270 1 1 1 1 26 ALA MB . 26 . HB# 1 1
270 1 2 1 1 35 TYR H . 35 . HN 1 1
271 1 1 1 1 26 ALA N . 26 . N 1 1
271 1 2 1 1 35 TYR O . 35 . O 1 1
272 1 1 1 1 26 ALA O . 26 . O 1 1
272 1 2 1 1 35 TYR H . 35 . HN 1 1
273 1 1 1 1 26 ALA O . 26 . O 1 1
273 1 2 1 1 35 TYR N . 35 . N 1 1
274 1 1 1 1 27 MET H . 27 . HN 1 1
274 1 2 1 1 35 TYR CZ . 35 . CZ 1 1
275 1 1 1 1 27 MET HA . 27 . HA 1 1
275 1 2 1 1 28 ASP H . 28 . HN 1 1
276 1 1 1 1 27 MET HA . 27 . HA 1 1
276 1 2 1 1 34 ALA HA . 34 . HA 1 1
277 1 1 1 1 27 MET HA . 27 . HA 1 1
277 1 2 1 1 35 TYR CG . 35 . CG 1 1
278 1 1 1 1 27 MET HA . 27 . HA 1 1
278 1 2 1 1 35 TYR H . 35 . HN 1 1
279 1 1 1 1 27 MET QB . 27 . HB# 1 1
279 1 2 1 1 34 ALA HA . 34 . HA 1 1
280 1 1 1 1 27 MET HB2 . 27 . HB2 1 1
280 1 2 1 1 28 ASP H . 28 . HN 1 1
281 1 1 1 1 27 MET HB3 . 27 . HB1 1 1
281 1 2 1 1 28 ASP H . 28 . HN 1 1
282 1 1 1 1 27 MET HB3 . 27 . HB1 1 1
282 1 2 1 1 33 LYS H . 33 . HN 1 1
283 1 1 1 1 28 ASP H . 28 . HN 1 1
283 1 2 1 1 28 ASP HB2 . 28 . HB2 1 1
284 1 1 1 1 28 ASP H . 28 . HN 1 1
284 1 2 1 1 28 ASP HB3 . 28 . HB1 1 1
285 1 1 1 1 28 ASP H . 28 . HN 1 1
285 1 2 1 1 31 ILE H . 31 . HN 1 1
286 1 1 1 1 28 ASP H . 28 . HN 1 1
286 1 2 1 1 31 ILE HA . 31 . HA 1 1
287 1 1 1 1 28 ASP H . 28 . HN 1 1
287 1 2 1 1 31 ILE HG12 . 31 . HG12 1 1
288 1 1 1 1 28 ASP H . 28 . HN 1 1
288 1 2 1 1 32 GLU H . 32 . HN 1 1
289 1 1 1 1 28 ASP H . 28 . HN 1 1
289 1 2 1 1 32 GLU HA . 32 . HA 1 1
290 1 1 1 1 28 ASP H . 28 . HN 1 1
290 1 2 1 1 33 LYS H . 33 . HN 1 1
291 1 1 1 1 28 ASP H . 28 . HN 1 1
291 1 2 1 1 33 LYS O . 33 . O 1 1
292 1 1 1 1 28 ASP H . 28 . HN 1 1
292 1 2 1 1 34 ALA HA . 34 . HA 1 1
293 1 1 1 1 28 ASP H . 28 . HN 1 1
293 1 2 1 1 35 TYR CG . 35 . CG 1 1
294 1 1 1 1 28 ASP H . 28 . HN 1 1
294 1 2 1 1 35 TYR CZ . 35 . CZ 1 1
295 1 1 1 1 28 ASP HA . 28 . HA 1 1
295 1 2 1 1 28 ASP HB2 . 28 . HB2 1 1
296 1 1 1 1 28 ASP HA . 28 . HA 1 1
296 1 2 1 1 29 PRO HA . 29 . HA 1 1
297 1 1 1 1 28 ASP HA . 28 . HA 1 1
297 1 2 1 1 29 PRO HD2 . 29 . HD2 1 1
298 1 1 1 1 28 ASP HA . 28 . HA 1 1
298 1 2 1 1 29 PRO HD3 . 29 . HD1 1 1
299 1 1 1 1 28 ASP HA . 28 . HA 1 1
299 1 2 1 1 30 GLU H . 30 . HN 1 1
300 1 1 1 1 28 ASP HA . 28 . HA 1 1
300 1 2 1 1 31 ILE H . 31 . HN 1 1
301 1 1 1 1 28 ASP HA . 28 . HA 1 1
301 1 2 1 1 35 TYR CG . 35 . CG 1 1
302 1 1 1 1 28 ASP HA . 28 . HA 1 1
302 1 2 1 1 35 TYR CZ . 35 . CZ 1 1
303 1 1 1 1 28 ASP HB2 . 28 . HB2 1 1
303 1 2 1 1 31 ILE H . 31 . HN 1 1
304 1 1 1 1 28 ASP HB2 . 28 . HB2 1 1
304 1 2 1 1 33 LYS H . 33 . HN 1 1
305 1 1 1 1 28 ASP HB2 . 28 . HB2 1 1
305 1 2 1 1 35 TYR CG . 35 . CG 1 1
306 1 1 1 1 28 ASP HB2 . 28 . HB2 1 1
306 1 2 1 1 35 TYR H . 35 . HN 1 1
307 1 1 1 1 28 ASP HB3 . 28 . HB1 1 1
307 1 2 1 1 30 GLU H . 30 . HN 1 1
308 1 1 1 1 28 ASP HB3 . 28 . HB1 1 1
308 1 2 1 1 31 ILE H . 31 . HN 1 1
309 1 1 1 1 28 ASP HB3 . 28 . HB1 1 1
309 1 2 1 1 32 GLU H . 32 . HN 1 1
310 1 1 1 1 28 ASP HB3 . 28 . HB1 1 1
310 1 2 1 1 32 GLU HA . 32 . HA 1 1
311 1 1 1 1 28 ASP HB3 . 28 . HB1 1 1
311 1 2 1 1 33 LYS H . 33 . HN 1 1
312 1 1 1 1 28 ASP N . 28 . N 1 1
312 1 2 1 1 33 LYS O . 33 . O 1 1
313 1 1 1 1 28 ASP O . 28 . O 1 1
313 1 2 1 1 33 LYS H . 33 . HN 1 1
314 1 1 1 1 28 ASP O . 28 . O 1 1
314 1 2 1 1 33 LYS N . 33 . N 1 1
315 1 1 1 1 29 PRO HA . 29 . HA 1 1
315 1 2 1 1 32 GLU H . 32 . HN 1 1
316 1 1 1 1 29 PRO HD2 . 29 . HD2 1 1
316 1 2 1 1 30 GLU H . 30 . HN 1 1
317 1 1 1 1 29 PRO HD3 . 29 . HD1 1 1
317 1 2 1 1 30 GLU H . 30 . HN 1 1
318 1 1 1 1 30 GLU H . 30 . HN 1 1
318 1 2 1 1 30 GLU HB2 . 30 . HB2 1 1
319 1 1 1 1 30 GLU H . 30 . HN 1 1
319 1 2 1 1 31 ILE H . 31 . HN 1 1
320 1 1 1 1 30 GLU H . 30 . HN 1 1
320 1 2 1 1 31 ILE QG . 31 . HG1# 1 1
321 1 1 1 1 30 GLU H . 30 . HN 1 1
321 1 2 1 1 32 GLU H . 32 . HN 1 1
322 1 1 1 1 30 GLU H . 30 . HN 1 1
322 1 2 1 1 32 GLU HA . 32 . HA 1 1
323 1 1 1 1 30 GLU HA . 30 . HA 1 1
323 1 2 1 1 30 GLU HB2 . 30 . HB2 1 1
324 1 1 1 1 30 GLU HA . 30 . HA 1 1
324 1 2 1 1 32 GLU H . 32 . HN 1 1
325 1 1 1 1 30 GLU HA . 30 . HA 1 1
325 1 2 1 1 32 GLU QG . 32 . HG# 1 1
326 1 1 1 1 30 GLU HB2 . 30 . HB2 1 1
326 1 2 1 1 31 ILE H . 31 . HN 1 1
327 1 1 1 1 30 GLU HB3 . 30 . HB1 1 1
327 1 2 1 1 31 ILE H . 31 . HN 1 1
328 1 1 1 1 31 ILE H . 31 . HN 1 1
328 1 2 1 1 31 ILE HG12 . 31 . HG12 1 1
329 1 1 1 1 31 ILE H . 31 . HN 1 1
329 1 2 1 1 31 ILE HG13 . 31 . HG11 1 1
330 1 1 1 1 31 ILE H . 31 . HN 1 1
330 1 2 1 1 32 GLU H . 32 . HN 1 1
331 1 1 1 1 31 ILE H . 31 . HN 1 1
331 1 2 1 1 32 GLU HA . 32 . HA 1 1
332 1 1 1 1 31 ILE HA . 31 . HA 1 1
332 1 2 1 1 32 GLU HB2 . 32 . HB2 1 1
333 1 1 1 1 31 ILE HB . 31 . HB 1 1
333 1 2 1 1 32 GLU H . 32 . HN 1 1
334 1 1 1 1 31 ILE HB . 31 . HB 1 1
334 1 2 1 1 33 LYS H . 33 . HN 1 1
335 1 1 1 1 31 ILE QG . 31 . HG1# 1 1
335 1 2 1 1 32 GLU H . 32 . HN 1 1
336 1 1 1 1 31 ILE QG . 31 . HG1# 1 1
336 1 2 1 1 33 LYS H . 33 . HN 1 1
337 1 1 1 1 31 ILE HG12 . 31 . HG12 1 1
337 1 2 1 1 32 GLU H . 32 . HN 1 1
338 1 1 1 1 31 ILE HG12 . 31 . HG12 1 1
338 1 2 1 1 33 LYS H . 33 . HN 1 1
339 1 1 1 1 31 ILE HG13 . 31 . HG11 1 1
339 1 2 1 1 33 LYS H . 33 . HN 1 1
340 1 1 1 1 32 GLU H . 32 . HN 1 1
340 1 2 1 1 32 GLU HA . 32 . HA 1 1
341 1 1 1 1 32 GLU H . 32 . HN 1 1
341 1 2 1 1 33 LYS H . 33 . HN 1 1
342 1 1 1 1 32 GLU HA . 32 . HA 1 1
342 1 2 1 1 33 LYS H . 33 . HN 1 1
343 1 1 1 1 34 ALA H . 34 . HN 1 1
343 1 2 2 2 1 SF4 FE1 . 65 . FE1 1 1
344 1 1 1 1 35 TYR CG . 35 . CG 1 1
344 1 2 1 1 36 VAL H . 36 . HN 1 1
345 1 1 1 1 35 TYR CG . 35 . CG 1 1
345 1 2 1 1 36 VAL MG2 . 36 . HG1# 1 1
346 1 1 1 1 35 TYR CG . 35 . CG 1 1
346 1 2 1 1 37 LYS HA . 37 . HA 1 1
347 1 1 1 1 35 TYR CZ . 35 . CZ 1 1
347 1 2 1 1 35 TYR H . 35 . HN 1 1
348 1 1 1 1 35 TYR CZ . 35 . CZ 1 1
348 1 2 1 1 36 VAL HA . 36 . HA 1 1
349 1 1 1 1 35 TYR CZ . 35 . CZ 1 1
349 1 2 1 1 37 LYS HA . 37 . HA 1 1
350 1 1 1 1 35 TYR CZ . 35 . CZ 1 1
350 1 2 1 1 38 ASP HB2 . 38 . HB2 1 1
351 1 1 1 1 35 TYR CZ . 35 . CZ 1 1
351 1 2 1 1 38 ASP HB3 . 38 . HB1 1 1
352 1 1 1 1 35 TYR H . 35 . HN 1 1
352 1 2 1 1 36 VAL HA . 36 . HA 1 1
353 1 1 1 1 35 TYR HA . 35 . HA 1 1
353 1 2 1 1 36 VAL H . 36 . HN 1 1
354 1 1 1 1 35 TYR HA . 35 . HA 1 1
354 1 2 1 1 36 VAL HB . 36 . HB 1 1
355 1 1 1 1 36 VAL H . 36 . HN 1 1
355 1 2 1 1 36 VAL HB . 36 . HB 1 1
356 1 1 1 1 36 VAL HA . 36 . HA 1 1
356 1 2 1 1 37 LYS H . 37 . HN 1 1
357 1 1 1 1 36 VAL HA . 36 . HA 1 1
357 1 2 1 1 38 ASP H . 38 . HN 1 1
358 1 1 1 1 36 VAL HB . 36 . HB 1 1
358 1 2 1 1 37 LYS H . 37 . HN 1 1
359 1 1 1 1 36 VAL MG2 . 36 . HG1# 1 1
359 1 2 1 1 37 LYS H . 37 . HN 1 1
360 1 1 1 1 36 VAL MG2 . 36 . HG1# 1 1
360 1 2 1 1 38 ASP H . 38 . HN 1 1
361 1 1 1 1 36 VAL MG2 . 36 . HG1# 1 1
361 1 2 1 1 39 VAL H . 39 . HN 1 1
362 1 1 1 1 36 VAL MG2 . 36 . HG1# 1 1
362 1 2 1 1 39 VAL HA . 39 . HA 1 1
363 1 1 1 1 36 VAL MG2 . 36 . HG1# 1 1
363 1 2 1 1 39 VAL HB . 39 . HB 1 1
364 1 1 1 1 37 LYS H . 37 . HN 1 1
364 1 2 1 1 38 ASP H . 38 . HN 1 1
365 1 1 1 1 37 LYS HA . 37 . HA 1 1
365 1 2 1 1 37 LYS HB2 . 37 . HB2 1 1
366 1 1 1 1 37 LYS HB2 . 37 . HB2 1 1
366 1 2 1 1 38 ASP H . 38 . HN 1 1
367 1 1 1 1 37 LYS HB3 . 37 . HB1 1 1
367 1 2 1 1 38 ASP H . 38 . HN 1 1
368 1 1 1 1 37 LYS QG . 37 . HG# 1 1
368 1 2 1 1 38 ASP H . 38 . HN 1 1
369 1 1 1 1 38 ASP H . 38 . HN 1 1
369 1 2 1 1 39 VAL H . 39 . HN 1 1
370 1 1 1 1 38 ASP H . 38 . HN 1 1
370 1 2 1 1 39 VAL HA . 39 . HA 1 1
371 1 1 1 1 38 ASP H . 38 . HN 1 1
371 1 2 1 1 39 VAL MG1 . 39 . HG1# 1 1
372 1 1 1 1 38 ASP H . 38 . HN 1 1
372 1 2 1 1 41 GLY HA3 . 41 . HA1 1 1
373 1 1 1 1 38 ASP HA . 38 . HA 1 1
373 1 2 1 1 39 VAL H . 39 . HN 1 1
374 1 1 1 1 38 ASP HA . 38 . HA 1 1
374 1 2 1 1 39 VAL HA . 39 . HA 1 1
375 1 1 1 1 38 ASP HA . 38 . HA 1 1
375 1 2 1 1 40 GLU H . 40 . HN 1 1
376 1 1 1 1 38 ASP HB2 . 38 . HB2 1 1
376 1 2 1 1 41 GLY H . 41 . HN 1 1
377 1 1 1 1 38 ASP HB3 . 38 . HB1 1 1
377 1 2 1 1 41 GLY H . 41 . HN 1 1
378 1 1 1 1 38 ASP HB3 . 38 . HB1 1 1
378 1 2 1 1 41 GLY HA3 . 41 . HA1 1 1
379 1 1 1 1 39 VAL H . 39 . HN 1 1
379 1 2 1 1 39 VAL HB . 39 . HB 1 1
380 1 1 1 1 39 VAL H . 39 . HN 1 1
380 1 2 1 1 40 GLU H . 40 . HN 1 1
381 1 1 1 1 39 VAL HA . 39 . HA 1 1
381 1 2 1 1 39 VAL HB . 39 . HB 1 1
382 1 1 1 1 39 VAL HA . 39 . HA 1 1
382 1 2 1 1 40 GLU H . 40 . HN 1 1
383 1 1 1 1 39 VAL HA . 39 . HA 1 1
383 1 2 1 1 41 GLY H . 41 . HN 1 1
384 1 1 1 1 39 VAL HB . 39 . HB 1 1
384 1 2 1 1 40 GLU H . 40 . HN 1 1
385 1 1 1 1 39 VAL MG1 . 39 . HG1# 1 1
385 1 2 1 1 40 GLU H . 40 . HN 1 1
386 1 1 1 1 40 GLU H . 40 . HN 1 1
386 1 2 1 1 40 GLU HG3 . 40 . HG1 1 1
387 1 1 1 1 40 GLU H . 40 . HN 1 1
387 1 2 1 1 41 GLY H . 41 . HN 1 1
388 1 1 1 1 40 GLU H . 40 . HN 1 1
388 1 2 1 1 41 GLY HA3 . 41 . HA1 1 1
389 1 1 1 1 40 GLU H . 40 . HN 1 1
389 1 2 1 1 42 ALA H . 42 . HN 1 1
390 1 1 1 1 40 GLU HA . 40 . HA 1 1
390 1 2 1 1 40 GLU HB3 . 40 . HB1 1 1
391 1 1 1 1 40 GLU HA . 40 . HA 1 1
391 1 2 1 1 40 GLU HG2 . 40 . HG2 1 1
392 1 1 1 1 40 GLU HA . 40 . HA 1 1
392 1 2 1 1 40 GLU HG3 . 40 . HG1 1 1
393 1 1 1 1 40 GLU HA . 40 . HA 1 1
393 1 2 1 1 42 ALA H . 42 . HN 1 1
394 1 1 1 1 40 GLU HB2 . 40 . HB2 1 1
394 1 2 1 1 41 GLY H . 41 . HN 1 1
395 1 1 1 1 41 GLY H . 41 . HN 1 1
395 1 2 1 1 42 ALA H . 42 . HN 1 1
396 1 1 1 1 42 ALA HA . 42 . HA 1 1
396 1 2 1 1 43 SER H . 43 . HN 1 1
397 1 1 1 1 42 ALA MB . 42 . HB# 1 1
397 1 2 1 1 43 SER HA . 43 . HA 1 1
398 1 1 1 1 42 ALA MB . 42 . HB# 1 1
398 1 2 1 1 46 GLU H . 46 . HN 1 1
399 1 1 1 1 42 ALA MB . 42 . HB# 1 1
399 1 2 1 1 47 VAL H . 47 . HN 1 1
400 1 1 1 1 42 ALA MB . 42 . HB# 1 1
400 1 2 1 1 47 VAL HA . 47 . HA 1 1
401 1 1 1 1 42 ALA MB . 42 . HB# 1 1
401 1 2 1 1 47 VAL MG1 . 47 . HG1# 1 1
402 1 1 1 1 43 SER H . 43 . HN 1 1
402 1 2 1 1 43 SER HB3 . 43 . HB1 1 1
403 1 1 1 1 43 SER H . 43 . HN 1 1
403 1 2 1 1 44 GLN H . 44 . HN 1 1
404 1 1 1 1 43 SER H . 43 . HN 1 1
404 1 2 1 1 46 GLU H . 46 . HN 1 1
405 1 1 1 1 43 SER H . 43 . HN 1 1
405 1 2 1 1 46 GLU QB . 46 . HB# 1 1
406 1 1 1 1 43 SER H . 43 . HN 1 1
406 1 2 1 1 46 GLU HG3 . 46 . HG1 1 1
407 1 1 1 1 43 SER HB2 . 43 . HB2 1 1
407 1 2 1 1 44 GLN H . 44 . HN 1 1
408 1 1 1 1 43 SER HB2 . 43 . HB2 1 1
408 1 2 1 1 46 GLU H . 46 . HN 1 1
409 1 1 1 1 43 SER HB3 . 43 . HB1 1 1
409 1 2 1 1 44 GLN H . 44 . HN 1 1
410 1 1 1 1 43 SER HB3 . 43 . HB1 1 1
410 1 2 1 1 45 GLU H . 45 . HN 1 1
411 1 1 1 1 43 SER O . 43 . O 1 1
411 1 2 1 1 47 VAL H . 47 . HN 1 1
412 1 1 1 1 43 SER O . 43 . O 1 1
412 1 2 1 1 47 VAL N . 47 . N 1 1
413 1 1 1 1 44 GLN H . 44 . HN 1 1
413 1 2 1 1 45 GLU H . 45 . HN 1 1
414 1 1 1 1 44 GLN H . 44 . HN 1 1
414 1 2 1 1 45 GLU HG2 . 45 . HG2 1 1
415 1 1 1 1 44 GLN HA . 44 . HA 1 1
415 1 2 1 1 46 GLU H . 46 . HN 1 1
416 1 1 1 1 44 GLN HA . 44 . HA 1 1
416 1 2 1 1 47 VAL H . 47 . HN 1 1
417 1 1 1 1 44 GLN HA . 44 . HA 1 1
417 1 2 1 1 47 VAL HB . 47 . HB 1 1
418 1 1 1 1 44 GLN HA . 44 . HA 1 1
418 1 2 1 1 47 VAL MG1 . 47 . HG1# 1 1
419 1 1 1 1 44 GLN HA . 44 . HA 1 1
419 1 2 1 1 48 GLU H . 48 . HN 1 1
420 1 1 1 1 44 GLN HA . 44 . HA 1 1
420 1 2 1 1 61 TRP HH2 . 61 . HH2 1 1
421 1 1 1 1 44 GLN QG . 44 . HG# 1 1
421 1 2 1 1 61 TRP HH2 . 61 . HH2 1 1
422 1 1 1 1 44 GLN O . 44 . O 1 1
422 1 2 1 1 48 GLU H . 48 . HN 1 1
423 1 1 1 1 44 GLN O . 44 . O 1 1
423 1 2 1 1 48 GLU N . 48 . N 1 1
424 1 1 1 1 45 GLU H . 45 . HN 1 1
424 1 2 1 1 45 GLU HB2 . 45 . HB2 1 1
425 1 1 1 1 45 GLU H . 45 . HN 1 1
425 1 2 1 1 45 GLU HB3 . 45 . HB1 1 1
426 1 1 1 1 45 GLU H . 45 . HN 1 1
426 1 2 1 1 45 GLU HG2 . 45 . HG2 1 1
427 1 1 1 1 45 GLU H . 45 . HN 1 1
427 1 2 1 1 45 GLU HG3 . 45 . HG1 1 1
428 1 1 1 1 45 GLU H . 45 . HN 1 1
428 1 2 1 1 46 GLU H . 46 . HN 1 1
429 1 1 1 1 45 GLU HA . 45 . HA 1 1
429 1 2 1 1 46 GLU H . 46 . HN 1 1
430 1 1 1 1 45 GLU HA . 45 . HA 1 1
430 1 2 1 1 48 GLU H . 48 . HN 1 1
431 1 1 1 1 45 GLU HA . 45 . HA 1 1
431 1 2 1 1 48 GLU HB3 . 48 . HB1 1 1
432 1 1 1 1 45 GLU HA . 45 . HA 1 1
432 1 2 1 1 48 GLU HG3 . 48 . HG1 1 1
433 1 1 1 1 45 GLU HA . 45 . HA 1 1
433 1 2 1 1 49 GLU H . 49 . HN 1 1
434 1 1 1 1 45 GLU HB3 . 45 . HB1 1 1
434 1 2 1 1 46 GLU H . 46 . HN 1 1
435 1 1 1 1 45 GLU HB3 . 45 . HB1 1 1
435 1 2 1 1 49 GLU H . 49 . HN 1 1
436 1 1 1 1 45 GLU O . 45 . O 1 1
436 1 2 1 1 49 GLU H . 49 . HN 1 1
437 1 1 1 1 45 GLU O . 45 . O 1 1
437 1 2 1 1 49 GLU N . 49 . N 1 1
438 1 1 1 1 46 GLU H . 46 . HN 1 1
438 1 2 1 1 46 GLU HG2 . 46 . HG2 1 1
439 1 1 1 1 46 GLU H . 46 . HN 1 1
439 1 2 1 1 46 GLU HG3 . 46 . HG1 1 1
440 1 1 1 1 46 GLU H . 46 . HN 1 1
440 1 2 1 1 47 VAL H . 47 . HN 1 1
441 1 1 1 1 46 GLU H . 46 . HN 1 1
441 1 2 1 1 47 VAL HB . 47 . HB 1 1
442 1 1 1 1 46 GLU H . 46 . HN 1 1
442 1 2 1 1 47 VAL MG1 . 47 . HG1# 1 1
443 1 1 1 1 46 GLU HA . 46 . HA 1 1
443 1 2 1 1 46 GLU HG3 . 46 . HG1 1 1
444 1 1 1 1 46 GLU HB2 . 46 . HB2 1 1
444 1 2 1 1 47 VAL H . 47 . HN 1 1
445 1 1 1 1 46 GLU HB3 . 46 . HB1 1 1
445 1 2 1 1 47 VAL H . 47 . HN 1 1
446 1 1 1 1 46 GLU HG2 . 46 . HG2 1 1
446 1 2 1 1 47 VAL H . 47 . HN 1 1
447 1 1 1 1 46 GLU HG3 . 46 . HG1 1 1
447 1 2 1 1 47 VAL H . 47 . HN 1 1
448 1 1 1 1 46 GLU O . 46 . O 1 1
448 1 2 1 1 50 ALA H . 50 . HN 1 1
449 1 1 1 1 46 GLU O . 46 . O 1 1
449 1 2 1 1 50 ALA N . 50 . N 1 1
450 1 1 1 1 47 VAL H . 47 . HN 1 1
450 1 2 1 1 47 VAL HB . 47 . HB 1 1
451 1 1 1 1 47 VAL H . 47 . HN 1 1
451 1 2 1 1 47 VAL MG1 . 47 . HG1# 1 1
452 1 1 1 1 47 VAL H . 47 . HN 1 1
452 1 2 1 1 48 GLU H . 48 . HN 1 1
453 1 1 1 1 47 VAL HA . 47 . HA 1 1
453 1 2 1 1 50 ALA H . 50 . HN 1 1
454 1 1 1 1 47 VAL HA . 47 . HA 1 1
454 1 2 1 1 50 ALA MB . 50 . HB# 1 1
455 1 1 1 1 47 VAL HB . 47 . HB 1 1
455 1 2 1 1 48 GLU H . 48 . HN 1 1
456 1 1 1 1 47 VAL HB . 47 . HB 1 1
456 1 2 1 1 61 TRP HH2 . 61 . HH2 1 1
457 1 1 1 1 47 VAL HB . 47 . HB 1 1
457 1 2 1 1 61 TRP HZ2 . 61 . HZ2 1 1
458 1 1 1 1 47 VAL MG1 . 47 . HG1# 1 1
458 1 2 1 1 48 GLU H . 48 . HN 1 1
459 1 1 1 1 47 VAL MG1 . 47 . HG1# 1 1
459 1 2 1 1 48 GLU HA . 48 . HA 1 1
460 1 1 1 1 47 VAL MG1 . 47 . HG1# 1 1
460 1 2 1 1 51 MET ME . 51 . HE# 1 1
461 1 1 1 1 47 VAL MG1 . 47 . HG1# 1 1
461 1 2 1 1 51 MET QG . 51 . HG# 1 1
462 1 1 1 1 47 VAL MG1 . 47 . HG1# 1 1
462 1 2 1 1 61 TRP HH2 . 61 . HH2 1 1
463 1 1 1 1 47 VAL MG1 . 47 . HG1# 1 1
463 1 2 1 1 61 TRP HZ2 . 61 . HZ2 1 1
464 1 1 1 1 48 GLU H . 48 . HN 1 1
464 1 2 1 1 48 GLU HB3 . 48 . HB1 1 1
465 1 1 1 1 48 GLU H . 48 . HN 1 1
465 1 2 1 1 48 GLU HG2 . 48 . HG2 1 1
466 1 1 1 1 48 GLU H . 48 . HN 1 1
466 1 2 1 1 48 GLU HG3 . 48 . HG1 1 1
467 1 1 1 1 48 GLU H . 48 . HN 1 1
467 1 2 1 1 49 GLU H . 49 . HN 1 1
468 1 1 1 1 48 GLU H . 48 . HN 1 1
468 1 2 1 1 50 ALA H . 50 . HN 1 1
469 1 1 1 1 48 GLU HA . 48 . HA 1 1
469 1 2 1 1 48 GLU HG2 . 48 . HG2 1 1
470 1 1 1 1 48 GLU HA . 48 . HA 1 1
470 1 2 1 1 48 GLU HG3 . 48 . HG1 1 1
471 1 1 1 1 48 GLU HA . 48 . HA 1 1
471 1 2 1 1 50 ALA H . 50 . HN 1 1
472 1 1 1 1 48 GLU HA . 48 . HA 1 1
472 1 2 1 1 51 MET H . 51 . HN 1 1
473 1 1 1 1 48 GLU HA . 48 . HA 1 1
473 1 2 1 1 51 MET QB . 51 . HB# 1 1
474 1 1 1 1 48 GLU HA . 48 . HA 1 1
474 1 2 1 1 52 ASP H . 52 . HN 1 1
475 1 1 1 1 48 GLU HA . 48 . HA 1 1
475 1 2 1 1 61 TRP HZ2 . 61 . HZ2 1 1
476 1 1 1 1 48 GLU HB2 . 48 . HB2 1 1
476 1 2 1 1 49 GLU H . 49 . HN 1 1
477 1 1 1 1 48 GLU HB3 . 48 . HB1 1 1
477 1 2 1 1 49 GLU H . 49 . HN 1 1
478 1 1 1 1 48 GLU HG2 . 48 . HG2 1 1
478 1 2 1 1 61 TRP HZ2 . 61 . HZ2 1 1
479 1 1 1 1 48 GLU HG3 . 48 . HG1 1 1
479 1 2 1 1 61 TRP HZ2 . 61 . HZ2 1 1
480 1 1 1 1 48 GLU O . 48 . O 1 1
480 1 2 1 1 51 MET H . 51 . HN 1 1
481 1 1 1 1 48 GLU O . 48 . O 1 1
481 1 2 1 1 51 MET N . 51 . N 1 1
482 1 1 1 1 48 GLU O . 48 . O 1 1
482 1 2 1 1 52 ASP H . 52 . HN 1 1
483 1 1 1 1 48 GLU O . 48 . O 1 1
483 1 2 1 1 52 ASP N . 52 . N 1 1
484 1 1 1 1 49 GLU H . 49 . HN 1 1
484 1 2 1 1 50 ALA H . 50 . HN 1 1
485 1 1 1 1 49 GLU H . 49 . HN 1 1
485 1 2 1 1 51 MET H . 51 . HN 1 1
486 1 1 1 1 49 GLU HA . 49 . HA 1 1
486 1 2 1 1 52 ASP H . 52 . HN 1 1
487 1 1 1 1 49 GLU HA . 49 . HA 1 1
487 1 2 1 1 52 ASP HB2 . 52 . HB2 1 1
488 1 1 1 1 49 GLU HA . 49 . HA 1 1
488 1 2 1 1 52 ASP HB3 . 52 . HB1 1 1
489 1 1 1 1 49 GLU O . 49 . O 1 1
489 1 2 1 1 53 THR H . 53 . HN 1 1
490 1 1 1 1 49 GLU O . 49 . O 1 1
490 1 2 1 1 53 THR N . 53 . N 1 1
491 1 1 1 1 50 ALA H . 50 . HN 1 1
491 1 2 1 1 51 MET H . 51 . HN 1 1
492 1 1 1 1 50 ALA H . 50 . HN 1 1
492 1 2 1 1 53 THR H . 53 . HN 1 1
493 1 1 1 1 50 ALA HA . 50 . HA 1 1
493 1 2 1 1 53 THR H . 53 . HN 1 1
494 1 1 1 1 50 ALA HA . 50 . HA 1 1
494 1 2 1 1 53 THR HG1 . 53 . HG1# 1 1
495 1 1 1 1 50 ALA MB . 50 . HB# 1 1
495 1 2 1 1 51 MET HA . 51 . HA 1 1
496 1 1 1 1 51 MET H . 51 . HN 1 1
496 1 2 1 1 51 MET HB2 . 51 . HB2 1 1
497 1 1 1 1 51 MET H . 51 . HN 1 1
497 1 2 1 1 51 MET HB3 . 51 . HB1 1 1
498 1 1 1 1 51 MET H . 51 . HN 1 1
498 1 2 1 1 52 ASP H . 52 . HN 1 1
499 1 1 1 1 51 MET HA . 51 . HA 1 1
499 1 2 1 1 53 THR H . 53 . HN 1 1
500 1 1 1 1 51 MET HA . 51 . HA 1 1
500 1 2 1 1 59 ILE QG . 59 . HG1# 1 1
501 1 1 1 1 51 MET HB2 . 51 . HB2 1 1
501 1 2 1 1 52 ASP H . 52 . HN 1 1
502 1 1 1 1 51 MET HB2 . 51 . HB2 1 1
502 1 2 1 1 59 ILE QG . 59 . HG1# 1 1
503 1 1 1 1 51 MET HB3 . 51 . HB1 1 1
503 1 2 1 1 52 ASP H . 52 . HN 1 1
504 1 1 1 1 51 MET ME . 51 . HE# 1 1
504 1 2 1 1 60 HIS H . 60 . HN 1 1
505 1 1 1 1 51 MET ME . 51 . HE# 1 1
505 1 2 1 1 61 TRP H . 61 . HN 1 1
506 1 1 1 1 51 MET ME . 51 . HE# 1 1
506 1 2 1 1 61 TRP HD1 . 61 . HD1 1 1
507 1 1 1 1 51 MET ME . 51 . HE# 1 1
507 1 2 1 1 61 TRP HE1 . 61 . HE1 1 1
508 1 1 1 1 51 MET ME . 51 . HE# 1 1
508 1 2 1 1 61 TRP HZ2 . 61 . HZ2 1 1
509 1 1 1 1 51 MET QG . 51 . HG# 1 1
509 1 2 1 1 59 ILE QG . 59 . HG1# 1 1
510 1 1 1 1 52 ASP H . 52 . HN 1 1
510 1 2 1 1 52 ASP HB2 . 52 . HB2 1 1
511 1 1 1 1 52 ASP H . 52 . HN 1 1
511 1 2 1 1 52 ASP HB3 . 52 . HB1 1 1
512 1 1 1 1 52 ASP H . 52 . HN 1 1
512 1 2 1 1 53 THR H . 53 . HN 1 1
513 1 1 1 1 52 ASP HB2 . 52 . HB2 1 1
513 1 2 1 1 53 THR H . 53 . HN 1 1
514 1 1 1 1 52 ASP HB3 . 52 . HB1 1 1
514 1 2 1 1 53 THR H . 53 . HN 1 1
515 1 1 1 1 54 CYS HB2 . 54 . HB1 1 1
515 1 2 1 1 57 GLN HA . 57 . HA 1 1
516 1 1 1 1 54 CYS HB2 . 54 . HB1 1 1
516 1 2 1 1 57 GLN QG . 57 . HG# 1 1
517 1 1 1 1 54 CYS HB2 . 54 . HB1 1 1
517 1 2 1 1 59 ILE HB . 59 . HB 1 1
518 1 1 1 1 55 PRO HA . 55 . HA 1 1
518 1 2 1 1 57 GLN H . 57 . HN 1 1
519 1 1 1 1 58 CYS HA . 58 . HA 1 1
519 1 2 1 1 60 HIS HD1 . 60 . HD1 1 1
520 1 1 1 1 59 ILE HA . 59 . HA 1 1
520 1 2 1 1 60 HIS H . 60 . HN 1 1
521 1 1 1 1 59 ILE QG . 59 . HG1# 1 1
521 1 2 1 1 60 HIS H . 60 . HN 1 1
522 1 1 1 1 60 HIS H . 60 . HN 1 1
522 1 2 1 1 60 HIS HD1 . 60 . HD1 1 1
523 1 1 1 1 60 HIS HA . 60 . HA 1 1
523 1 2 1 1 61 TRP H . 61 . HN 1 1
524 1 1 1 1 60 HIS HB2 . 60 . HB2 1 1
524 1 2 1 1 61 TRP H . 61 . HN 1 1
525 1 1 1 1 60 HIS HB3 . 60 . HB1 1 1
525 1 2 1 1 61 TRP H . 61 . HN 1 1
526 1 1 1 1 61 TRP H . 61 . HN 1 1
526 1 2 1 1 61 TRP HD1 . 61 . HD1 1 1
527 1 1 1 1 61 TRP HA . 61 . HA 1 1
527 1 2 1 1 61 TRP HE3 . 61 . HE3 1 1
528 1 1 1 1 61 TRP HA . 61 . HA 1 1
528 1 2 1 1 62 GLU H . 62 . HN 1 1
529 1 1 1 1 61 TRP HB2 . 61 . HB2 1 1
529 1 2 1 1 61 TRP HD1 . 61 . HD1 1 1
530 1 1 1 1 61 TRP HB2 . 61 . HB2 1 1
530 1 2 1 1 61 TRP HE3 . 61 . HE3 1 1
531 1 1 1 1 61 TRP HB2 . 61 . HB2 1 1
531 1 2 1 1 62 GLU H . 62 . HN 1 1
532 1 1 1 1 61 TRP HB3 . 61 . HB1 1 1
532 1 2 1 1 62 GLU H . 62 . HN 1 1
533 1 1 1 1 61 TRP HB3 . 61 . HB1 1 1
533 1 2 1 1 63 ASP H . 63 . HN 1 1
534 1 1 1 1 61 TRP HE3 . 61 . HE3 1 1
534 1 2 1 1 62 GLU H . 62 . HN 1 1
535 1 1 1 1 62 GLU H . 62 . HN 1 1
535 1 2 1 1 62 GLU HB2 . 62 . HB2 1 1
536 1 1 1 1 62 GLU H . 62 . HN 1 1
536 1 2 1 1 62 GLU HB3 . 62 . HB1 1 1
537 1 1 1 1 62 GLU H . 62 . HN 1 1
537 1 2 1 1 62 GLU HG2 . 62 . HG2 1 1
538 1 1 1 1 62 GLU H . 62 . HN 1 1
538 1 2 1 1 62 GLU HG3 . 62 . HG1 1 1
539 1 1 1 1 62 GLU HA . 62 . HA 1 1
539 1 2 1 1 62 GLU HG3 . 62 . HG1 1 1
540 1 1 1 1 62 GLU HA . 62 . HA 1 1
540 1 2 1 1 63 ASP H . 63 . HN 1 1
541 1 1 1 1 62 GLU HB2 . 62 . HB2 1 1
541 1 2 1 1 63 ASP H . 63 . HN 1 1
542 1 1 1 1 62 GLU HB3 . 62 . HB1 1 1
542 1 2 1 1 63 ASP H . 63 . HN 1 1
543 1 1 1 1 63 ASP H . 63 . HN 1 1
543 1 2 1 1 64 GLU H . 64 . HN 1 1
544 1 1 1 1 63 ASP H . 63 . HN 1 1
544 1 2 1 1 64 GLU QB . 64 . HB# 1 1
545 1 1 2 2 1 SF4 FE1 . 65 . FE1 1 1
545 1 2 2 2 1 SF4 FE2 . 65 . FE2 1 1
546 1 1 2 2 1 SF4 FE1 . 65 . FE1 1 1
546 1 2 2 2 1 SF4 FE3 . 65 . FE3 1 1
547 1 1 2 2 1 SF4 FE1 . 65 . FE1 1 1
547 1 2 2 2 1 SF4 FE4 . 65 . FE4 1 1
548 1 1 2 2 1 SF4 FE1 . 65 . FE1 1 1
548 1 2 2 2 1 SF4 S2 . 65 . S2 1 1
549 1 1 2 2 1 SF4 FE1 . 65 . FE1 1 1
549 1 2 2 2 1 SF4 S3 . 65 . S3 1 1
550 1 1 2 2 1 SF4 FE2 . 65 . FE2 1 1
550 1 2 2 2 1 SF4 FE3 . 65 . FE3 1 1
551 1 1 2 2 1 SF4 FE2 . 65 . FE2 1 1
551 1 2 2 2 1 SF4 FE4 . 65 . FE4 1 1
552 1 1 2 2 1 SF4 FE2 . 65 . FE2 1 1
552 1 2 2 2 1 SF4 S3 . 65 . S3 1 1
553 1 1 2 2 1 SF4 FE2 . 65 . FE2 1 1
553 1 2 2 2 1 SF4 S4 . 65 . S4 1 1
554 1 1 2 2 1 SF4 FE3 . 65 . FE3 1 1
554 1 2 2 2 1 SF4 FE4 . 65 . FE4 1 1
555 1 1 2 2 1 SF4 FE3 . 65 . FE3 1 1
555 1 2 2 2 1 SF4 S1 . 65 . S1 1 1
556 1 1 2 2 1 SF4 FE3 . 65 . FE3 1 1
556 1 2 2 2 1 SF4 S4 . 65 . S4 1 1
557 1 1 2 2 1 SF4 FE4 . 65 . FE4 1 1
557 1 2 2 2 1 SF4 S1 . 65 . S1 1 1
558 1 1 2 2 1 SF4 FE4 . 65 . FE4 1 1
558 1 2 2 2 1 SF4 S2 . 65 . S2 1 1
559 1 1 2 2 1 SF4 S1 . 65 . S1 1 1
559 1 2 2 2 1 SF4 S2 . 65 . S2 1 1
560 1 1 2 2 1 SF4 S1 . 65 . S1 1 1
560 1 2 2 2 1 SF4 S3 . 65 . S3 1 1
561 1 1 2 2 1 SF4 S1 . 65 . S1 1 1
561 1 2 2 2 1 SF4 S4 . 65 . S4 1 1
562 1 1 2 2 1 SF4 S2 . 65 . S2 1 1
562 1 2 2 2 1 SF4 S3 . 65 . S3 1 1
563 1 1 2 2 1 SF4 S2 . 65 . S2 1 1
563 1 2 2 2 1 SF4 S4 . 65 . S4 1 1
564 1 1 2 2 1 SF4 S3 . 65 . S3 1 1
564 1 2 2 2 1 SF4 S4 . 65 . S4 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 . . . . . 2.7 1.8 2.9 1 1
2 1 . . . . . 2.8 1.8 3.0 1 1
3 1 . . . . . 3.3 1.8 3.5 1 1
4 1 . . . . . 2.9 1.8 3.1 1 1
5 1 . . . . . 5.0 1.8 5.2 1 1
6 1 . . . . . 2.3 1.8 2.5 1 1
7 1 . . . . . 3.5 1.8 3.7 1 1
8 1 . . . . . 2.7 1.8 2.9 1 1
9 1 . . . . . 6.0 1.8 6.2 1 1
10 1 . . . . . 5.0 1.8 5.2 1 1
11 1 . . . . . 3.4 1.8 3.6 1 1
12 1 . . . . . 3.0 1.8 3.2 1 1
13 1 . . . . . 2.3 1.8 2.5 1 1
14 1 . . . . . 3.0 1.8 3.2 1 1
15 1 . . . . . 7.0 1.8 7.2 1 1
16 1 . . . . . 8.0 1.8 8.2 1 1
17 1 . . . . . 8.0 1.8 8.2 1 1
18 1 . . . . . 7.0 1.8 7.2 1 1
19 1 . . . . . 8.0 1.8 8.2 1 1
20 1 . . . . . 8.0 1.8 8.2 1 1
21 1 . . . . . 5.8 1.8 6.0 1 1
22 1 . . . . . 8.0 1.8 8.2 1 1
23 1 . . . . . 8.0 1.8 8.2 1 1
24 1 . . . . . 5.0 1.8 5.2 1 1
25 1 . . . . . 5.0 1.8 5.2 1 1
26 1 . . . . . 6.0 1.8 6.2 1 1
27 1 . . . . . 6.0 1.8 6.2 1 1
28 1 . . . . . 4.1 1.8 4.3 1 1
29 1 . . . . . 2.3 1.8 2.5 1 1
30 1 . . . . . 2.7 1.8 2.9 1 1
31 1 . . . . . 2.7 1.8 2.9 1 1
32 1 . . . . . 6.7 1.8 6.9 1 1
33 1 . . . . . 2.7 1.8 2.9 1 1
34 1 . . . . . 5.0 1.8 5.2 1 1
35 1 . . . . . 6.0 1.8 6.2 1 1
36 1 . . . . . 2.8 1.8 3.0 1 1
37 1 . . . . . 5.0 1.8 5.2 1 1
38 1 . . . . . 5.0 1.8 5.2 1 1
39 1 . . . . . 3.3 1.8 3.5 1 1
40 1 . . . . . 3.3 1.8 3.5 1 1
41 1 . . . . . 6.0 1.8 6.2 1 1
42 1 . . . . . 6.0 1.8 6.2 1 1
43 1 . . . . . 4.4 1.8 4.6 1 1
44 1 . . . . . 3.9 1.8 4.1 1 1
45 1 . . . . . 3.9 1.8 4.1 1 1
46 1 . . . . . 6.0 1.8 6.2 1 1
47 1 . . . . . 3.4 1.8 3.6 1 1
48 1 . . . . . 3.3 1.8 3.5 1 1
49 1 . . . . . 5.0 1.8 5.2 1 1
50 1 . . . . . 7.0 1.8 7.2 1 1
51 1 . . . . . 8.0 1.8 8.2 1 1
52 1 . . . . . 7.0 1.8 7.2 1 1
53 1 . . . . . 7.0 1.8 7.2 1 1
54 1 . . . . . 7.0 1.8 7.2 1 1
55 1 . . . . . 6.7 1.8 6.9 1 1
56 1 . . . . . 6.2 1.8 6.4 1 1
57 1 . . . . . 6.7 1.8 6.9 1 1
58 1 . . . . . 6.1 1.8 6.3 1 1
59 1 . . . . . 5.0 1.8 5.2 1 1
60 1 . . . . . 6.0 1.8 6.2 1 1
61 1 . . . . . 6.0 1.8 6.2 1 1
62 1 . . . . . 6.0 1.8 6.2 1 1
63 1 . . . . . 3.2 1.8 3.4 1 1
64 1 . . . . . 5.0 1.8 5.2 1 1
65 1 . . . . . 4.9 1.8 5.1 1 1
66 1 . . . . . 2.9 1.8 3.1 1 1
67 1 . . . . . 2.9 1.8 3.1 1 1
68 1 . . . . . 3.1 1.8 3.3 1 1
69 1 . . . . . 4.5 1.8 4.7 1 1
70 1 . . . . . 4.7 1.8 4.9 1 1
71 1 . . . . . 5.5 1.8 5.7 1 1
72 1 . . . . . 5.0 1.8 5.2 1 1
73 1 . . . . . 3.3 1.8 3.5 1 1
74 1 . . . . . 2.3 1.8 2.5 1 1
75 1 . . . . . 3.0 1.8 3.2 1 1
76 1 . . . . . 4.8 1.8 5.0 1 1
77 1 . . . . . 4.5 1.8 4.7 1 1
78 1 . . . . . 5.6 1.8 5.8 1 1
79 1 . . . . . 3.6 1.8 3.8 1 1
80 1 . . . . . 6.0 1.8 6.2 1 1
81 1 . . . . . 3.0 1.8 3.2 1 1
82 1 . . . . . 3.5 1.8 3.7 1 1
83 1 . . . . . 3.5 1.8 3.7 1 1
84 1 . . . . . 4.6 1.8 4.8 1 1
85 1 . . . . . 3.8 1.8 4.0 1 1
86 1 . . . . . 5.0 1.8 5.2 1 1
87 1 . . . . . 6.0 1.8 6.2 1 1
88 1 . . . . . 6.0 1.8 6.2 1 1
89 1 . . . . . 6.0 1.8 6.2 1 1
90 1 . . . . . 7.0 1.8 7.2 1 1
91 1 . . . . . 3.8 1.8 4.0 1 1
92 1 . . . . . 3.9 1.8 4.1 1 1
93 1 . . . . . 4.5 1.8 4.7 1 1
94 1 . . . . . 4.6 1.8 4.8 1 1
95 1 . . . . . 4.0 1.8 4.2 1 1
96 1 . . . . . 4.5 1.8 4.7 1 1
97 1 . . . . . 3.0 1.8 3.2 1 1
98 1 . . . . . 2.7 1.8 2.9 1 1
99 1 . . . . . 4.7 1.8 4.9 1 1
100 1 . . . . . 3.5 1.8 3.7 1 1
101 1 . . . . . 7.0 1.8 7.2 1 1
102 1 . . . . . 4.3 1.8 4.5 1 1
103 1 . . . . . 5.0 1.8 5.2 1 1
104 1 . . . . . 3.4 1.8 3.6 1 1
105 1 . . . . . 4.4 1.8 4.6 1 1
106 1 . . . . . 5.0 1.8 5.2 1 1
107 1 . . . . . 5.0 1.8 5.2 1 1
108 1 . . . . . 4.1 1.8 4.3 1 1
109 1 . . . . . 3.7 1.8 3.9 1 1
110 1 . . . . . 3.5 1.8 3.7 1 1
111 1 . . . . . 5.0 1.8 5.2 1 1
112 1 . . . . . 4.2 1.8 4.4 1 1
113 1 . . . . . 3.4 1.8 3.6 1 1
114 1 . . . . . 3.0 1.8 3.2 1 1
115 1 . . . . . 3.0 1.8 3.2 1 1
116 1 . . . . . 3.7 1.8 3.9 1 1
117 1 . . . . . 5.0 1.8 5.2 1 1
118 1 . . . . . 4.0 1.8 4.2 1 1
119 1 . . . . . 4.0 1.8 4.2 1 1
120 1 . . . . . 5.2 1.8 5.4 1 1
121 1 . . . . . 5.2 1.8 5.4 1 1
122 1 . . . . . 4.0 1.8 4.2 1 1
123 1 . . . . . 3.3 1.8 3.5 1 1
124 1 . . . . . 2.9 1.8 3.1 1 1
125 1 . . . . . 5.0 1.8 5.2 1 1
126 1 . . . . . 2.9 1.8 3.1 1 1
127 1 . . . . . 5.0 1.8 5.2 1 1
128 1 . . . . . 5.0 1.8 5.2 1 1
129 1 . . . . . 4.0 1.8 4.2 1 1
130 1 . . . . . 3.8 1.8 4.0 1 1
131 1 . . . . . 5.0 1.8 5.2 1 1
132 1 . . . . . 2.9 1.8 3.1 1 1
133 1 . . . . . 4.0 1.8 4.2 1 1
134 1 . . . . . 5.0 1.8 5.2 1 1
135 1 . . . . . 6.0 1.8 6.2 1 1
136 1 . . . . . 4.0 1.8 4.2 1 1
137 1 . . . . . 4.0 1.8 4.2 1 1
138 1 . . . . . 3.0 1.8 3.2 1 1
139 1 . . . . . 6.38 1.8 6.58 1 1
140 1 . . . . . 6.38 1.8 6.58 1 1
141 1 . . . . . 6.38 1.8 6.58 1 1
142 1 . . . . . 3.0 1.8 3.2 1 1
143 1 . . . . . 3.0 1.8 3.2 1 1
144 1 . . . . . 3.0 1.8 3.2 1 1
145 1 . . . . . 6.38 1.8 6.58 1 1
146 1 . . . . . 6.38 1.8 6.58 1 1
147 1 . . . . . 2.3 1.8 2.5 1 1
148 1 . . . . . 3.0 1.8 3.2 1 1
149 1 . . . . . 2.3 1.8 2.5 1 1
150 1 . . . . . 3.0 1.8 3.2 1 1
151 1 . . . . . 4.0 1.8 4.2 1 1
152 1 . . . . . 4.5 1.8 4.7 1 1
153 1 . . . . . 4.0 1.8 4.2 1 1
154 1 . . . . . 4.0 1.8 4.2 1 1
155 1 . . . . . 4.5 1.8 4.7 1 1
156 1 . . . . . 3.5 1.8 3.7 1 1
157 1 . . . . . 2.3 1.8 2.5 1 1
158 1 . . . . . 3.0 1.8 3.2 1 1
159 1 . . . . . 6.38 1.8 6.58 1 1
160 1 . . . . . 2.9 1.8 3.1 1 1
161 1 . . . . . 3.0 1.8 3.2 1 1
162 1 . . . . . 4.7 1.8 4.9 1 1
163 1 . . . . . 3.8 1.8 4.0 1 1
164 1 . . . . . 3.9 1.8 4.1 1 1
165 1 . . . . . 3.1 1.8 3.3 1 1
166 1 . . . . . 3.5 1.8 3.7 1 1
167 1 . . . . . 3.8 1.8 4.0 1 1
168 1 . . . . . 6.0 1.8 6.2 1 1
169 1 . . . . . 6.0 1.8 6.2 1 1
170 1 . . . . . 6.0 1.8 6.2 1 1
171 1 . . . . . 4.0 1.8 4.2 1 1
172 1 . . . . . 4.1 1.8 4.3 1 1
173 1 . . . . . 4.1 1.8 4.3 1 1
174 1 . . . . . 4.9 1.8 5.1 1 1
175 1 . . . . . 3.6 1.8 3.8 1 1
176 1 . . . . . 5.0 1.8 5.2 1 1
177 1 . . . . . 3.0 1.8 3.2 1 1
178 1 . . . . . 3.1 1.8 3.3 1 1
179 1 . . . . . 5.0 1.8 5.2 1 1
180 1 . . . . . 4.6 1.8 4.8 1 1
181 1 . . . . . 4.0 1.8 4.2 1 1
182 1 . . . . . 3.4 1.8 3.6 1 1
183 1 . . . . . 4.9 1.8 5.1 1 1
184 1 . . . . . 2.8 1.8 3.0 1 1
185 1 . . . . . 2.9 1.8 3.1 1 1
186 1 . . . . . 3.0 1.8 3.2 1 1
187 1 . . . . . 3.1 1.8 3.3 1 1
188 1 . . . . . 4.8 1.8 5.0 1 1
189 1 . . . . . 4.7 1.8 4.9 1 1
190 1 . . . . . 2.4 1.8 2.6 1 1
191 1 . . . . . 2.5 1.8 2.7 1 1
192 1 . . . . . 5.0 1.8 5.2 1 1
193 1 . . . . . 6.0 1.8 6.2 1 1
194 1 . . . . . 6.0 1.8 6.2 1 1
195 1 . . . . . 6.0 1.8 6.2 1 1
196 1 . . . . . 6.0 1.8 6.2 1 1
197 1 . . . . . 6.0 1.8 6.2 1 1
198 1 . . . . . 6.0 1.8 6.2 1 1
199 1 . . . . . 3.7 1.8 3.9 1 1
200 1 . . . . . 4.2 1.8 4.4 1 1
201 1 . . . . . 4.1 1.8 4.3 1 1
202 1 . . . . . 4.2 1.8 4.4 1 1
203 1 . . . . . 7.0 1.8 7.2 1 1
204 1 . . . . . 6.0 1.8 6.2 1 1
205 1 . . . . . 3.5 1.8 3.7 1 1
206 1 . . . . . 2.8 1.8 3.0 1 1
207 1 . . . . . 6.0 1.8 6.2 1 1
208 1 . . . . . 6.0 1.8 6.2 1 1
209 1 . . . . . 6.0 1.8 6.2 1 1
210 1 . . . . . 6.0 1.8 6.2 1 1
211 1 . . . . . 8.0 1.8 8.2 1 1
212 1 . . . . . 8.0 1.8 8.2 1 1
213 1 . . . . . 6.0 1.8 6.2 1 1
214 1 . . . . . 6.0 1.8 6.2 1 1
215 1 . . . . . 6.0 1.8 6.2 1 1
216 1 . . . . . 6.0 1.8 6.2 1 1
217 1 . . . . . 6.0 1.8 6.2 1 1
218 1 . . . . . 6.0 1.8 6.2 1 1
219 1 . . . . . 2.3 1.8 2.5 1 1
220 1 . . . . . 3.0 1.8 3.2 1 1
221 1 . . . . . 5.0 1.8 5.2 1 1
222 1 . . . . . 5.0 1.8 5.2 1 1
223 1 . . . . . 3.5 1.8 3.7 1 1
224 1 . . . . . 3.7 1.8 3.9 1 1
225 1 . . . . . 5.0 1.8 5.2 1 1
226 1 . . . . . 6.0 1.8 6.2 1 1
227 1 . . . . . 5.0 1.8 5.2 1 1
228 1 . . . . . 5.0 1.8 5.2 1 1
229 1 . . . . . 5.0 1.8 5.2 1 1
230 1 . . . . . 4.5 1.8 4.7 1 1
231 1 . . . . . 3.7 1.8 3.9 1 1
232 1 . . . . . 6.0 1.8 6.2 1 1
233 1 . . . . . 5.8 1.8 6.0 1 1
234 1 . . . . . 3.5 1.8 3.7 1 1
235 1 . . . . . 4.8 1.8 5.0 1 1
236 1 . . . . . 4.5 1.8 4.7 1 1
237 1 . . . . . 8.0 1.8 8.2 1 1
238 1 . . . . . 7.0 1.8 7.2 1 1
239 1 . . . . . 6.0 1.8 6.2 1 1
240 1 . . . . . 6.0 1.8 6.2 1 1
241 1 . . . . . 6.0 1.8 6.2 1 1
242 1 . . . . . 6.0 1.8 6.2 1 1
243 1 . . . . . 6.0 1.8 6.2 1 1
244 1 . . . . . 7.0 1.8 7.2 1 1
245 1 . . . . . 7.0 1.8 7.2 1 1
246 1 . . . . . 8.0 1.8 8.2 1 1
247 1 . . . . . 8.0 1.8 8.2 1 1
248 1 . . . . . 8.0 1.8 8.2 1 1
249 1 . . . . . 3.8 1.8 4.0 1 1
250 1 . . . . . 2.7 1.8 2.9 1 1
251 1 . . . . . 5.0 1.8 5.2 1 1
252 1 . . . . . 6.0 1.8 6.2 1 1
253 1 . . . . . 3.3 1.8 3.5 1 1
254 1 . . . . . 2.9 1.8 3.1 1 1
255 1 . . . . . 6.0 1.8 6.2 1 1
256 1 . . . . . 3.2 1.8 3.4 1 1
257 1 . . . . . 4.5 1.8 4.7 1 1
258 1 . . . . . 5.0 1.8 5.2 1 1
259 1 . . . . . 3.3 1.8 3.5 1 1
260 1 . . . . . 5.0 1.8 5.2 1 1
261 1 . . . . . 4.5 1.8 4.7 1 1
262 1 . . . . . 3.3 1.8 3.5 1 1
263 1 . . . . . 2.3 1.8 2.5 1 1
264 1 . . . . . 4.1 1.8 4.3 1 1
265 1 . . . . . 4.6 1.8 4.8 1 1
266 1 . . . . . 3.1 1.8 3.3 1 1
267 1 . . . . . 5.0 1.8 5.2 1 1
268 1 . . . . . 6.0 1.8 6.2 1 1
269 1 . . . . . 8.0 1.8 8.2 1 1
270 1 . . . . . 6.0 1.8 6.2 1 1
271 1 . . . . . 3.0 1.8 3.2 1 1
272 1 . . . . . 2.3 1.8 2.5 1 1
273 1 . . . . . 3.0 1.8 3.2 1 1
274 1 . . . . . 7.0 1.8 7.2 1 1
275 1 . . . . . 3.0 1.8 3.2 1 1
276 1 . . . . . 3.5 1.8 3.7 1 1
277 1 . . . . . 7.0 1.8 7.2 1 1
278 1 . . . . . 5.0 1.8 5.2 1 1
279 1 . . . . . 6.0 1.8 6.2 1 1
280 1 . . . . . 5.0 1.8 5.2 1 1
281 1 . . . . . 5.0 1.8 5.2 1 1
282 1 . . . . . 5.0 1.8 5.2 1 1
283 1 . . . . . 3.4 1.8 3.6 1 1
284 1 . . . . . 3.3 1.8 3.5 1 1
285 1 . . . . . 4.6 1.8 4.8 1 1
286 1 . . . . . 5.0 1.8 5.2 1 1
287 1 . . . . . 5.0 1.8 5.2 1 1
288 1 . . . . . 4.6 1.8 4.8 1 1
289 1 . . . . . 3.3 1.8 3.5 1 1
290 1 . . . . . 4.0 1.8 4.2 1 1
291 1 . . . . . 2.3 1.8 2.5 1 1
292 1 . . . . . 4.6 1.8 4.8 1 1
293 1 . . . . . 7.0 1.8 7.2 1 1
294 1 . . . . . 7.0 1.8 7.2 1 1
295 1 . . . . . 3.0 1.8 3.2 1 1
296 1 . . . . . 4.5 1.8 4.7 1 1
297 1 . . . . . 3.1 1.8 3.3 1 1
298 1 . . . . . 3.0 1.8 3.2 1 1
299 1 . . . . . 5.0 1.8 5.2 1 1
300 1 . . . . . 5.0 1.8 5.2 1 1
301 1 . . . . . 7.0 1.8 7.2 1 1
302 1 . . . . . 5.8 1.8 6.0 1 1
303 1 . . . . . 4.7 1.8 4.9 1 1
304 1 . . . . . 5.0 1.8 5.2 1 1
305 1 . . . . . 5.9 1.8 6.1 1 1
306 1 . . . . . 5.0 1.8 5.2 1 1
307 1 . . . . . 5.0 1.8 5.2 1 1
308 1 . . . . . 5.0 1.8 5.2 1 1
309 1 . . . . . 4.8 1.8 5.0 1 1
310 1 . . . . . 5.0 1.8 5.2 1 1
311 1 . . . . . 3.6 1.8 3.8 1 1
312 1 . . . . . 3.0 1.8 3.2 1 1
313 1 . . . . . 2.3 1.8 2.5 1 1
314 1 . . . . . 3.0 1.8 3.2 1 1
315 1 . . . . . 4.6 1.8 4.8 1 1
316 1 . . . . . 4.6 1.8 4.8 1 1
317 1 . . . . . 3.1 1.8 3.3 1 1
318 1 . . . . . 2.9 1.8 3.1 1 1
319 1 . . . . . 3.8 1.8 4.0 1 1
320 1 . . . . . 6.0 1.8 6.2 1 1
321 1 . . . . . 4.1 1.8 4.3 1 1
322 1 . . . . . 4.6 1.8 4.8 1 1
323 1 . . . . . 2.6 1.8 2.8 1 1
324 1 . . . . . 4.1 1.8 4.3 1 1
325 1 . . . . . 6.0 1.8 6.2 1 1
326 1 . . . . . 3.3 1.8 3.5 1 1
327 1 . . . . . 4.0 1.8 4.2 1 1
328 1 . . . . . 3.2 1.8 3.4 1 1
329 1 . . . . . 4.3 1.8 4.5 1 1
330 1 . . . . . 2.8 1.8 3.0 1 1
331 1 . . . . . 4.5 1.8 4.7 1 1
332 1 . . . . . 4.6 1.8 4.8 1 1
333 1 . . . . . 4.5 1.8 4.7 1 1
334 1 . . . . . 4.8 1.8 5.0 1 1
335 1 . . . . . 6.0 1.8 6.2 1 1
336 1 . . . . . 6.0 1.8 6.2 1 1
337 1 . . . . . 4.9 1.8 5.1 1 1
338 1 . . . . . 3.8 1.8 4.0 1 1
339 1 . . . . . 3.8 1.8 4.0 1 1
340 1 . . . . . 2.6 1.8 2.8 1 1
341 1 . . . . . 3.1 1.8 3.3 1 1
342 1 . . . . . 2.9 1.8 3.1 1 1
343 1 . . . . . 4.0 1.8 4.2 1 1
344 1 . . . . . 7.0 1.8 7.2 1 1
345 1 . . . . . 8.0 1.8 8.2 1 1
346 1 . . . . . 6.0 1.8 6.2 1 1
347 1 . . . . . 6.0 1.8 6.2 1 1
348 1 . . . . . 7.0 1.8 7.2 1 1
349 1 . . . . . 5.2 1.8 5.4 1 1
350 1 . . . . . 6.6 1.8 6.8 1 1
351 1 . . . . . 7.0 1.8 7.2 1 1
352 1 . . . . . 5.0 1.8 5.2 1 1
353 1 . . . . . 3.2 1.8 3.4 1 1
354 1 . . . . . 5.0 1.8 5.2 1 1
355 1 . . . . . 3.0 1.8 3.2 1 1
356 1 . . . . . 2.6 1.8 2.8 1 1
357 1 . . . . . 4.2 1.8 4.4 1 1
358 1 . . . . . 5.0 1.8 5.2 1 1
359 1 . . . . . 6.0 1.8 6.2 1 1
360 1 . . . . . 6.0 1.8 6.2 1 1
361 1 . . . . . 6.0 1.8 6.2 1 1
362 1 . . . . . 6.0 1.8 6.2 1 1
363 1 . . . . . 6.0 1.8 6.2 1 1
364 1 . . . . . 2.8 1.8 3.0 1 1
365 1 . . . . . 3.0 1.8 3.2 1 1
366 1 . . . . . 4.4 1.8 4.6 1 1
367 1 . . . . . 4.5 1.8 4.7 1 1
368 1 . . . . . 6.0 1.8 6.2 1 1
369 1 . . . . . 5.0 1.8 5.2 1 1
370 1 . . . . . 5.0 1.8 5.2 1 1
371 1 . . . . . 6.0 1.8 6.2 1 1
372 1 . . . . . 5.0 1.8 5.2 1 1
373 1 . . . . . 2.8 1.8 3.0 1 1
374 1 . . . . . 5.0 1.8 5.2 1 1
375 1 . . . . . 4.1 1.8 4.3 1 1
376 1 . . . . . 4.2 1.8 4.4 1 1
377 1 . . . . . 3.6 1.8 3.8 1 1
378 1 . . . . . 3.1 1.8 3.3 1 1
379 1 . . . . . 4.0 1.8 4.2 1 1
380 1 . . . . . 3.0 1.8 3.2 1 1
381 1 . . . . . 3.0 1.8 3.2 1 1
382 1 . . . . . 3.5 1.8 3.7 1 1
383 1 . . . . . 4.7 1.8 4.9 1 1
384 1 . . . . . 4.0 1.8 4.2 1 1
385 1 . . . . . 6.0 1.8 6.2 1 1
386 1 . . . . . 5.0 1.8 5.2 1 1
387 1 . . . . . 3.1 1.8 3.3 1 1
388 1 . . . . . 5.0 1.8 5.2 1 1
389 1 . . . . . 5.0 1.8 5.2 1 1
390 1 . . . . . 2.7 1.8 2.9 1 1
391 1 . . . . . 3.3 1.8 3.5 1 1
392 1 . . . . . 4.0 1.8 4.2 1 1
393 1 . . . . . 3.6 1.8 3.8 1 1
394 1 . . . . . 5.0 1.8 5.2 1 1
395 1 . . . . . 5.0 1.8 5.2 1 1
396 1 . . . . . 3.0 1.8 3.2 1 1
397 1 . . . . . 6.0 1.8 6.2 1 1
398 1 . . . . . 6.0 1.8 6.2 1 1
399 1 . . . . . 6.0 1.8 6.2 1 1
400 1 . . . . . 6.0 1.8 6.2 1 1
401 1 . . . . . 6.4 1.8 6.6 1 1
402 1 . . . . . 3.2 1.8 3.4 1 1
403 1 . . . . . 5.0 1.8 5.2 1 1
404 1 . . . . . 4.4 1.8 4.6 1 1
405 1 . . . . . 4.7 1.8 4.9 1 1
406 1 . . . . . 4.0 1.8 4.2 1 1
407 1 . . . . . 3.2 1.8 3.4 1 1
408 1 . . . . . 3.1 1.8 3.3 1 1
409 1 . . . . . 4.0 1.8 4.2 1 1
410 1 . . . . . 3.8 1.8 4.0 1 1
411 1 . . . . . 2.3 1.8 2.5 1 1
412 1 . . . . . 2.3 1.8 2.5 1 1
413 1 . . . . . 3.3 1.8 3.5 1 1
414 1 . . . . . 4.8 1.8 5.0 1 1
415 1 . . . . . 4.4 1.8 4.6 1 1
416 1 . . . . . 3.9 1.8 4.1 1 1
417 1 . . . . . 3.1 1.8 3.3 1 1
418 1 . . . . . 6.0 1.8 6.2 1 1
419 1 . . . . . 4.6 1.8 4.8 1 1
420 1 . . . . . 4.9 1.8 5.1 1 1
421 1 . . . . . 6.0 1.8 6.2 1 1
422 1 . . . . . 2.3 1.8 2.5 1 1
423 1 . . . . . 3.0 1.8 3.2 1 1
424 1 . . . . . 4.0 1.8 4.2 1 1
425 1 . . . . . 3.8 1.8 4.0 1 1
426 1 . . . . . 4.1 1.8 4.3 1 1
427 1 . . . . . 4.8 1.8 5.0 1 1
428 1 . . . . . 3.4 1.8 3.6 1 1
429 1 . . . . . 3.4 1.8 3.6 1 1
430 1 . . . . . 3.9 1.8 4.1 1 1
431 1 . . . . . 3.4 1.8 3.6 1 1
432 1 . . . . . 5.0 1.8 5.2 1 1
433 1 . . . . . 4.3 1.8 4.5 1 1
434 1 . . . . . 4.1 1.8 4.3 1 1
435 1 . . . . . 4.8 1.8 5.0 1 1
436 1 . . . . . 2.3 1.8 2.5 1 1
437 1 . . . . . 3.0 1.8 3.2 1 1
438 1 . . . . . 4.0 1.8 4.2 1 1
439 1 . . . . . 3.2 1.8 3.4 1 1
440 1 . . . . . 3.1 1.8 3.3 1 1
441 1 . . . . . 4.8 1.8 5.0 1 1
442 1 . . . . . 6.0 1.8 6.2 1 1
443 1 . . . . . 3.3 1.8 3.5 1 1
444 1 . . . . . 4.0 1.8 4.2 1 1
445 1 . . . . . 3.4 1.8 3.6 1 1
446 1 . . . . . 5.0 1.8 5.2 1 1
447 1 . . . . . 3.6 1.8 3.8 1 1
448 1 . . . . . 2.3 1.8 2.5 1 1
449 1 . . . . . 3.0 1.8 3.2 1 1
450 1 . . . . . 2.7 1.8 2.9 1 1
451 1 . . . . . 4.5 1.8 4.7 1 1
452 1 . . . . . 3.4 1.8 3.6 1 1
453 1 . . . . . 4.1 1.8 4.3 1 1
454 1 . . . . . 6.0 1.8 6.2 1 1
455 1 . . . . . 3.1 1.8 3.3 1 1
456 1 . . . . . 4.7 1.8 4.9 1 1
457 1 . . . . . 5.0 1.8 5.2 1 1
458 1 . . . . . 6.0 1.8 6.2 1 1
459 1 . . . . . 6.0 1.8 6.2 1 1
460 1 . . . . . 7.0 1.8 7.2 1 1
461 1 . . . . . 7.0 1.8 7.2 1 1
462 1 . . . . . 5.9 1.8 6.1 1 1
463 1 . . . . . 6.0 1.8 6.2 1 1
464 1 . . . . . 2.8 1.8 3.0 1 1
465 1 . . . . . 3.7 1.8 3.9 1 1
466 1 . . . . . 3.3 1.8 3.5 1 1
467 1 . . . . . 3.3 1.8 3.5 1 1
468 1 . . . . . 4.6 1.8 4.8 1 1
469 1 . . . . . 3.6 1.8 3.8 1 1
470 1 . . . . . 4.0 1.8 4.2 1 1
471 1 . . . . . 5.0 1.8 5.2 1 1
472 1 . . . . . 3.4 1.8 3.6 1 1
473 1 . . . . . 3.9 1.8 4.1 1 1
474 1 . . . . . 4.6 1.8 4.8 1 1
475 1 . . . . . 5.0 1.8 5.2 1 1
476 1 . . . . . 2.9 1.8 3.1 1 1
477 1 . . . . . 4.4 1.8 4.6 1 1
478 1 . . . . . 3.5 1.8 3.7 1 1
479 1 . . . . . 4.2 1.8 4.4 1 1
480 1 . . . . . 2.3 1.8 2.5 1 1
481 1 . . . . . 3.0 1.8 3.2 1 1
482 1 . . . . . 2.3 1.8 2.5 1 1
483 1 . . . . . 3.0 1.8 3.2 1 1
484 1 . . . . . 3.1 1.8 3.3 1 1
485 1 . . . . . 4.7 1.8 4.9 1 1
486 1 . . . . . 3.3 1.8 3.5 1 1
487 1 . . . . . 3.7 1.8 3.9 1 1
488 1 . . . . . 3.8 1.8 4.0 1 1
489 1 . . . . . 2.3 1.8 2.5 1 1
490 1 . . . . . 3.0 1.8 3.2 1 1
491 1 . . . . . 2.7 1.8 2.9 1 1
492 1 . . . . . 4.8 1.8 5.0 1 1
493 1 . . . . . 4.4 1.8 4.6 1 1
494 1 . . . . . 6.0 1.8 6.2 1 1
495 1 . . . . . 6.0 1.8 6.2 1 1
496 1 . . . . . 2.6 1.8 2.8 1 1
497 1 . . . . . 2.8 1.8 3.0 1 1
498 1 . . . . . 3.0 1.8 3.2 1 1
499 1 . . . . . 5.0 1.8 5.2 1 1
500 1 . . . . . 6.0 1.8 6.2 1 1
501 1 . . . . . 5.0 1.8 5.2 1 1
502 1 . . . . . 6.0 1.8 6.2 1 1
503 1 . . . . . 3.1 1.8 3.3 1 1
504 1 . . . . . 6.0 1.8 6.2 1 1
505 1 . . . . . 6.0 1.8 6.2 1 1
506 1 . . . . . 6.0 1.8 6.2 1 1
507 1 . . . . . 6.0 1.8 6.2 1 1
508 1 . . . . . 6.0 1.8 6.2 1 1
509 1 . . . . . 7.0 1.8 7.2 1 1
510 1 . . . . . 4.1 1.8 4.3 1 1
511 1 . . . . . 3.1 1.8 3.3 1 1
512 1 . . . . . 3.6 1.8 3.8 1 1
513 1 . . . . . 5.0 1.8 5.2 1 1
514 1 . . . . . 4.9 1.8 5.1 1 1
515 1 . . . . . 3.0 1.8 3.2 1 1
516 1 . . . . . 4.0 1.8 4.2 1 1
517 1 . . . . . 5.0 1.8 5.2 1 1
518 1 . . . . . 5.0 1.8 5.2 1 1
519 1 . . . . . 5.0 1.8 5.2 1 1
520 1 . . . . . 3.5 1.8 3.7 1 1
521 1 . . . . . 6.0 1.8 6.2 1 1
522 1 . . . . . 5.0 1.8 5.2 1 1
523 1 . . . . . 3.5 1.8 3.7 1 1
524 1 . . . . . 5.0 1.8 5.2 1 1
525 1 . . . . . 3.2 1.8 3.4 1 1
526 1 . . . . . 5.0 1.8 5.2 1 1
527 1 . . . . . 3.4 1.8 3.6 1 1
528 1 . . . . . 3.0 1.8 3.2 1 1
529 1 . . . . . 3.5 1.8 3.7 1 1
530 1 . . . . . 3.7 1.8 3.9 1 1
531 1 . . . . . 5.0 1.8 5.2 1 1
532 1 . . . . . 3.6 1.8 3.8 1 1
533 1 . . . . . 5.0 1.8 5.2 1 1
534 1 . . . . . 5.0 1.8 5.2 1 1
535 1 . . . . . 3.4 1.8 3.6 1 1
536 1 . . . . . 4.2 1.8 4.4 1 1
537 1 . . . . . 5.0 1.8 5.2 1 1
538 1 . . . . . 5.0 1.8 5.2 1 1
539 1 . . . . . 3.5 1.8 3.7 1 1
540 1 . . . . . 3.4 1.8 3.6 1 1
541 1 . . . . . 5.0 1.8 5.2 1 1
542 1 . . . . . 5.0 1.8 5.2 1 1
543 1 . . . . . 5.0 1.8 5.2 1 1
544 1 . . . . . 6.0 1.8 6.2 1 1
545 1 . . . . . 2.66 1.8 2.86 1 1
546 1 . . . . . 2.66 1.8 2.86 1 1
547 1 . . . . . 2.66 1.8 2.86 1 1
548 1 . . . . . 2.32 1.8 2.52 1 1
549 1 . . . . . 2.32 1.8 2.52 1 1
550 1 . . . . . 2.66 1.8 2.86 1 1
551 1 . . . . . 2.66 1.8 2.86 1 1
552 1 . . . . . 2.32 1.8 2.52 1 1
553 1 . . . . . 2.32 1.8 2.52 1 1
554 1 . . . . . 2.66 1.8 2.86 1 1
555 1 . . . . . 2.32 1.8 2.52 1 1
556 1 . . . . . 2.32 1.8 2.52 1 1
557 1 . . . . . 2.32 1.8 2.52 1 1
558 1 . . . . . 2.32 1.8 2.52 1 1
559 1 . . . . . 3.51 1.8 3.71 1 1
560 1 . . . . . 3.51 1.8 3.71 1 1
561 1 . . . . . 3.51 1.8 3.71 1 1
562 1 . . . . . 3.51 1.8 3.71 1 1
563 1 . . . . . 3.51 1.8 3.71 1 1
564 1 . . . . . 3.51 1.8 3.71 1 1
stop_
save_
save_CNS/XPLOR_dihedral_4
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID 1
_Torsion_angle_constraint_list.ID 1
_Torsion_angle_constraint_list.Constraint_file_ID .
_Torsion_angle_constraint_list.Block_ID .
loop_
_Torsion_angle_constraint.ID
_Torsion_angle_constraint.Torsion_angle_name
_Torsion_angle_constraint.Entity_assembly_ID_1
_Torsion_angle_constraint.Entity_ID_1
_Torsion_angle_constraint.Comp_index_ID_1
_Torsion_angle_constraint.Comp_ID_1
_Torsion_angle_constraint.Atom_ID_1
_Torsion_angle_constraint.Entity_assembly_ID_2
_Torsion_angle_constraint.Entity_ID_2
_Torsion_angle_constraint.Comp_index_ID_2
_Torsion_angle_constraint.Comp_ID_2
_Torsion_angle_constraint.Atom_ID_2
_Torsion_angle_constraint.Entity_assembly_ID_3
_Torsion_angle_constraint.Entity_ID_3
_Torsion_angle_constraint.Comp_index_ID_3
_Torsion_angle_constraint.Comp_ID_3
_Torsion_angle_constraint.Atom_ID_3
_Torsion_angle_constraint.Entity_assembly_ID_4
_Torsion_angle_constraint.Entity_ID_4
_Torsion_angle_constraint.Comp_index_ID_4
_Torsion_angle_constraint.Comp_ID_4
_Torsion_angle_constraint.Atom_ID_4
_Torsion_angle_constraint.Angle_lower_bound_val
_Torsion_angle_constraint.Angle_upper_bound_val
_Torsion_angle_constraint.Auth_asym_ID_1
_Torsion_angle_constraint.Auth_seq_ID_1
_Torsion_angle_constraint.Auth_comp_ID_1
_Torsion_angle_constraint.Auth_atom_ID_1
_Torsion_angle_constraint.Auth_asym_ID_2
_Torsion_angle_constraint.Auth_seq_ID_2
_Torsion_angle_constraint.Auth_comp_ID_2
_Torsion_angle_constraint.Auth_atom_ID_2
_Torsion_angle_constraint.Auth_asym_ID_3
_Torsion_angle_constraint.Auth_seq_ID_3
_Torsion_angle_constraint.Auth_comp_ID_3
_Torsion_angle_constraint.Auth_atom_ID_3
_Torsion_angle_constraint.Auth_asym_ID_4
_Torsion_angle_constraint.Auth_seq_ID_4
_Torsion_angle_constraint.Auth_comp_ID_4
_Torsion_angle_constraint.Auth_atom_ID_4
_Torsion_angle_constraint.Entry_ID
_Torsion_angle_constraint.Torsion_angle_constraint_list_ID
1 . 1 1 11 CYS CA 1 1 11 CYS CB 1 1 11 CYS SG 2 2 1 SF4 FE1 75.0 75.0 . 11 . CA . 11 . CB . 11 . SG . 65 . FE1 1 1
2 . 1 1 14 CYS CA 1 1 14 CYS CB 1 1 14 CYS SG 2 2 1 SF4 FE2 315.0 315.0 . 14 . CA . 14 . CB . 14 . SG . 65 . FE2 1 1
3 . 1 1 17 CYS CA 1 1 17 CYS CB 1 1 17 CYS SG 2 2 1 SF4 FE3 245.0 245.0 . 17 . CA . 17 . CB . 17 . SG . 65 . FE3 1 1
4 . 1 1 54 CYS CA 1 1 54 CYS CB 1 1 54 CYS SG 2 2 1 SF4 FE4 80.0 80.0 . 54 . CA . 54 . CB . 54 . SG . 65 . FE4 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 ALA C C 1.769 -1.898 0.780 1.00 . A A . 1 ALA C 1 1
1 2 1 1 1 ALA CA C 0.681 -0.835 0.616 1.00 . A A . 1 ALA CA 1 1
1 3 1 1 1 ALA CB C -0.696 -1.489 0.745 1.00 . A A . 1 ALA CB 1 1
1 4 1 1 1 ALA H1 H 1.762 -0.359 -1.100 1.00 . A A . 1 ALA H1 1 1
1 5 1 1 1 ALA H2 H 0.105 -0.618 -1.373 1.00 . A A . 1 ALA H2 1 1
1 6 1 1 1 ALA H3 H 0.634 0.822 -0.644 1.00 . A A . 1 ALA H3 1 1
1 7 1 1 1 ALA HA H 0.795 -0.082 1.382 1.00 . A A . 1 ALA HA 1 1
1 8 1 1 1 ALA HB1 H -0.834 -2.199 -0.057 1.00 . A A . 1 ALA HB1 1 1
1 9 1 1 1 ALA HB2 H -0.764 -2.001 1.694 1.00 . A A . 1 ALA HB2 1 1
1 10 1 1 1 ALA HB3 H -1.463 -0.730 0.690 1.00 . A A . 1 ALA HB3 1 1
1 11 1 1 1 ALA N N 0.805 -0.200 -0.727 1.00 . A A . 1 ALA N 1 1
1 12 1 1 1 ALA O O 2.947 -1.601 0.765 1.00 . A A . 1 ALA O 1 1
1 13 1 1 2 ARG C C 2.437 -5.075 -0.166 1.00 . A A . 2 ARG C 1 1
1 14 1 1 2 ARG CA C 2.398 -4.215 1.099 1.00 . A A . 2 ARG CA 1 1
1 15 1 1 2 ARG CB C 2.024 -5.089 2.298 1.00 . A A . 2 ARG CB 1 1
1 16 1 1 2 ARG CD C 2.433 -5.431 4.740 1.00 . A A . 2 ARG CD 1 1
1 17 1 1 2 ARG CG C 2.981 -4.802 3.457 1.00 . A A . 2 ARG CG 1 1
1 18 1 1 2 ARG CZ C 2.398 -4.819 7.084 1.00 . A A . 2 ARG CZ 1 1
1 19 1 1 2 ARG H H 0.430 -3.355 0.943 1.00 . A A . 2 ARG H 1 1
1 20 1 1 2 ARG HA H 3.370 -3.775 1.264 1.00 . A A . 2 ARG HA 1 1
1 21 1 1 2 ARG HB2 H 1.011 -4.867 2.603 1.00 . A A . 2 ARG HB2 1 1
1 22 1 1 2 ARG HB3 H 2.098 -6.130 2.022 1.00 . A A . 2 ARG HB3 1 1
1 23 1 1 2 ARG HD2 H 1.413 -5.747 4.578 1.00 . A A . 2 ARG HD2 1 1
1 24 1 1 2 ARG HD3 H 3.036 -6.285 5.008 1.00 . A A . 2 ARG HD3 1 1
1 25 1 1 2 ARG HE H 2.558 -3.473 5.632 1.00 . A A . 2 ARG HE 1 1
1 26 1 1 2 ARG HG2 H 3.951 -5.223 3.235 1.00 . A A . 2 ARG HG2 1 1
1 27 1 1 2 ARG HG3 H 3.073 -3.735 3.593 1.00 . A A . 2 ARG HG3 1 1
1 28 1 1 2 ARG HH11 H 1.686 -6.634 6.629 1.00 . A A . 2 ARG HH11 1 1
1 29 1 1 2 ARG HH12 H 1.903 -6.316 8.318 1.00 . A A . 2 ARG HH12 1 1
1 30 1 1 2 ARG HH21 H 3.092 -3.095 7.829 1.00 . A A . 2 ARG HH21 1 1
1 31 1 1 2 ARG HH22 H 2.700 -4.312 8.997 1.00 . A A . 2 ARG HH22 1 1
1 32 1 1 2 ARG N N 1.384 -3.135 0.935 1.00 . A A . 2 ARG N 1 1
1 33 1 1 2 ARG NE N 2.474 -4.427 5.841 1.00 . A A . 2 ARG NE 1 1
1 34 1 1 2 ARG NH1 N 1.962 -6.016 7.366 1.00 . A A . 2 ARG NH1 1 1
1 35 1 1 2 ARG NH2 N 2.758 -4.013 8.045 1.00 . A A . 2 ARG NH2 1 1
1 36 1 1 2 ARG O O 1.421 -5.541 -0.644 1.00 . A A . 2 ARG O 1 1
1 37 1 1 3 LYS C C 4.671 -7.284 -1.698 1.00 . A A . 3 LYS C 1 1
1 38 1 1 3 LYS CA C 3.705 -6.123 -1.945 1.00 . A A . 3 LYS CA 1 1
1 39 1 1 3 LYS CB C 4.225 -5.262 -3.098 1.00 . A A . 3 LYS CB 1 1
1 40 1 1 3 LYS CD C 2.862 -4.518 -5.057 1.00 . A A . 3 LYS CD 1 1
1 41 1 1 3 LYS CE C 1.734 -5.022 -5.959 1.00 . A A . 3 LYS CE 1 1
1 42 1 1 3 LYS CG C 3.568 -5.709 -4.406 1.00 . A A . 3 LYS CG 1 1
1 43 1 1 3 LYS H H 4.411 -4.909 -0.311 1.00 . A A . 3 LYS H 1 1
1 44 1 1 3 LYS HA H 2.730 -6.513 -2.198 1.00 . A A . 3 LYS HA 1 1
1 45 1 1 3 LYS HB2 H 3.985 -4.225 -2.910 1.00 . A A . 3 LYS HB2 1 1
1 46 1 1 3 LYS HB3 H 5.295 -5.376 -3.179 1.00 . A A . 3 LYS HB3 1 1
1 47 1 1 3 LYS HD2 H 2.451 -3.880 -4.288 1.00 . A A . 3 LYS HD2 1 1
1 48 1 1 3 LYS HD3 H 3.571 -3.958 -5.648 1.00 . A A . 3 LYS HD3 1 1
1 49 1 1 3 LYS HE2 H 1.919 -6.052 -6.226 1.00 . A A . 3 LYS HE2 1 1
1 50 1 1 3 LYS HE3 H 0.793 -4.949 -5.434 1.00 . A A . 3 LYS HE3 1 1
1 51 1 1 3 LYS HG2 H 4.324 -6.090 -5.076 1.00 . A A . 3 LYS HG2 1 1
1 52 1 1 3 LYS HG3 H 2.845 -6.484 -4.200 1.00 . A A . 3 LYS HG3 1 1
1 53 1 1 3 LYS HZ1 H 1.823 -3.192 -6.950 1.00 . A A . 3 LYS HZ1 1 1
1 54 1 1 3 LYS HZ2 H 2.425 -4.499 -7.853 1.00 . A A . 3 LYS HZ2 1 1
1 55 1 1 3 LYS HZ3 H 0.749 -4.305 -7.648 1.00 . A A . 3 LYS HZ3 1 1
1 56 1 1 3 LYS N N 3.603 -5.292 -0.712 1.00 . A A . 3 LYS N 1 1
1 57 1 1 3 LYS NZ N 1.679 -4.192 -7.196 1.00 . A A . 3 LYS NZ 1 1
1 58 1 1 3 LYS O O 4.891 -7.693 -0.576 1.00 . A A . 3 LYS O 1 1
1 59 1 1 4 PHE C C 6.458 -9.615 -3.918 1.00 . A A . 4 PHE C 1 1
1 60 1 1 4 PHE CA C 6.200 -8.952 -2.563 1.00 . A A . 4 PHE CA 1 1
1 61 1 1 4 PHE CB C 5.601 -9.977 -1.598 1.00 . A A . 4 PHE CB 1 1
1 62 1 1 4 PHE CD1 C 4.246 -11.288 -3.272 1.00 . A A . 4 PHE CD1 1 1
1 63 1 1 4 PHE CD2 C 3.085 -10.100 -1.505 1.00 . A A . 4 PHE CD2 1 1
1 64 1 1 4 PHE CE1 C 3.020 -11.743 -3.772 1.00 . A A . 4 PHE CE1 1 1
1 65 1 1 4 PHE CE2 C 1.859 -10.555 -2.005 1.00 . A A . 4 PHE CE2 1 1
1 66 1 1 4 PHE CG C 4.279 -10.467 -2.138 1.00 . A A . 4 PHE CG 1 1
1 67 1 1 4 PHE CZ C 1.827 -11.376 -3.138 1.00 . A A . 4 PHE CZ 1 1
1 68 1 1 4 PHE H H 5.059 -7.474 -3.636 1.00 . A A . 4 PHE H 1 1
1 69 1 1 4 PHE HA H 7.131 -8.581 -2.162 1.00 . A A . 4 PHE HA 1 1
1 70 1 1 4 PHE HB2 H 6.278 -10.811 -1.494 1.00 . A A . 4 PHE HB2 1 1
1 71 1 1 4 PHE HB3 H 5.446 -9.515 -0.634 1.00 . A A . 4 PHE HB3 1 1
1 72 1 1 4 PHE HD1 H 5.167 -11.570 -3.760 1.00 . A A . 4 PHE HD1 1 1
1 73 1 1 4 PHE HD2 H 3.110 -9.467 -0.630 1.00 . A A . 4 PHE HD2 1 1
1 74 1 1 4 PHE HE1 H 2.995 -12.376 -4.645 1.00 . A A . 4 PHE HE1 1 1
1 75 1 1 4 PHE HE2 H 0.938 -10.273 -1.516 1.00 . A A . 4 PHE HE2 1 1
1 76 1 1 4 PHE HZ H 0.881 -11.727 -3.524 1.00 . A A . 4 PHE HZ 1 1
1 77 1 1 4 PHE N N 5.248 -7.819 -2.739 1.00 . A A . 4 PHE N 1 1
1 78 1 1 4 PHE O O 5.883 -9.244 -4.922 1.00 . A A . 4 PHE O 1 1
1 79 1 1 5 TYR C C 8.750 -12.284 -5.027 1.00 . A A . 5 TYR C 1 1
1 80 1 1 5 TYR CA C 7.616 -11.282 -5.242 1.00 . A A . 5 TYR CA 1 1
1 81 1 1 5 TYR CB C 8.037 -10.247 -6.288 1.00 . A A . 5 TYR CB 1 1
1 82 1 1 5 TYR CD1 C 9.401 -8.692 -4.846 1.00 . A A . 5 TYR CD1 1 1
1 83 1 1 5 TYR CD2 C 10.531 -9.992 -6.554 1.00 . A A . 5 TYR CD2 1 1
1 84 1 1 5 TYR CE1 C 10.623 -8.120 -4.474 1.00 . A A . 5 TYR CE1 1 1
1 85 1 1 5 TYR CE2 C 11.752 -9.418 -6.183 1.00 . A A . 5 TYR CE2 1 1
1 86 1 1 5 TYR CG C 9.354 -9.629 -5.887 1.00 . A A . 5 TYR CG 1 1
1 87 1 1 5 TYR CZ C 11.799 -8.483 -5.142 1.00 . A A . 5 TYR CZ 1 1
1 88 1 1 5 TYR H H 7.774 -10.880 -3.132 1.00 . A A . 5 TYR H 1 1
1 89 1 1 5 TYR HA H 6.733 -11.802 -5.583 1.00 . A A . 5 TYR HA 1 1
1 90 1 1 5 TYR HB2 H 8.143 -10.730 -7.249 1.00 . A A . 5 TYR HB2 1 1
1 91 1 1 5 TYR HB3 H 7.285 -9.476 -6.354 1.00 . A A . 5 TYR HB3 1 1
1 92 1 1 5 TYR HD1 H 8.494 -8.413 -4.331 1.00 . A A . 5 TYR HD1 1 1
1 93 1 1 5 TYR HD2 H 10.494 -10.714 -7.357 1.00 . A A . 5 TYR HD2 1 1
1 94 1 1 5 TYR HE1 H 10.659 -7.397 -3.672 1.00 . A A . 5 TYR HE1 1 1
1 95 1 1 5 TYR HE2 H 12.659 -9.699 -6.697 1.00 . A A . 5 TYR HE2 1 1
1 96 1 1 5 TYR HH H 13.214 -8.217 -3.889 1.00 . A A . 5 TYR HH 1 1
1 97 1 1 5 TYR N N 7.320 -10.595 -3.953 1.00 . A A . 5 TYR N 1 1
1 98 1 1 5 TYR O O 9.024 -12.694 -3.918 1.00 . A A . 5 TYR O 1 1
1 99 1 1 5 TYR OH O 13.003 -7.918 -4.776 1.00 . A A . 5 TYR OH 1 1
1 100 1 1 6 VAL C C 11.560 -13.435 -7.024 1.00 . A A . 6 VAL C 1 1
1 101 1 1 6 VAL CA C 10.524 -13.660 -5.924 1.00 . A A . 6 VAL CA 1 1
1 102 1 1 6 VAL CB C 9.971 -15.081 -6.025 1.00 . A A . 6 VAL CB 1 1
1 103 1 1 6 VAL CG1 C 10.574 -15.939 -4.912 1.00 . A A . 6 VAL CG1 1 1
1 104 1 1 6 VAL CG2 C 8.449 -15.047 -5.877 1.00 . A A . 6 VAL CG2 1 1
1 105 1 1 6 VAL H H 9.176 -12.343 -6.966 1.00 . A A . 6 VAL H 1 1
1 106 1 1 6 VAL HA H 10.990 -13.523 -4.959 1.00 . A A . 6 VAL HA 1 1
1 107 1 1 6 VAL HB H 10.234 -15.501 -6.985 1.00 . A A . 6 VAL HB 1 1
1 108 1 1 6 VAL HG11 H 11.548 -15.556 -4.650 1.00 . A A . 6 VAL HG11 1 1
1 109 1 1 6 VAL HG12 H 9.929 -15.908 -4.045 1.00 . A A . 6 VAL HG12 1 1
1 110 1 1 6 VAL HG13 H 10.667 -16.958 -5.254 1.00 . A A . 6 VAL HG13 1 1
1 111 1 1 6 VAL HG21 H 8.045 -14.251 -6.486 1.00 . A A . 6 VAL HG21 1 1
1 112 1 1 6 VAL HG22 H 8.035 -15.991 -6.198 1.00 . A A . 6 VAL HG22 1 1
1 113 1 1 6 VAL HG23 H 8.192 -14.874 -4.843 1.00 . A A . 6 VAL HG23 1 1
1 114 1 1 6 VAL N N 9.411 -12.683 -6.078 1.00 . A A . 6 VAL N 1 1
1 115 1 1 6 VAL O O 11.348 -12.668 -7.943 1.00 . A A . 6 VAL O 1 1
1 116 1 1 7 ASP C C 14.087 -15.283 -8.577 1.00 . A A . 7 ASP C 1 1
1 117 1 1 7 ASP CA C 13.726 -13.923 -7.983 1.00 . A A . 7 ASP CA 1 1
1 118 1 1 7 ASP CB C 14.970 -13.293 -7.355 1.00 . A A . 7 ASP CB 1 1
1 119 1 1 7 ASP CG C 15.425 -12.105 -8.205 1.00 . A A . 7 ASP CG 1 1
1 120 1 1 7 ASP H H 12.830 -14.714 -6.192 1.00 . A A . 7 ASP H 1 1
1 121 1 1 7 ASP HA H 13.349 -13.281 -8.763 1.00 . A A . 7 ASP HA 1 1
1 122 1 1 7 ASP HB2 H 14.735 -12.954 -6.356 1.00 . A A . 7 ASP HB2 1 1
1 123 1 1 7 ASP HB3 H 15.762 -14.025 -7.310 1.00 . A A . 7 ASP HB3 1 1
1 124 1 1 7 ASP N N 12.678 -14.099 -6.940 1.00 . A A . 7 ASP N 1 1
1 125 1 1 7 ASP O O 15.244 -15.611 -8.750 1.00 . A A . 7 ASP O 1 1
1 126 1 1 7 ASP OD1 O 15.596 -12.287 -9.399 1.00 . A A . 7 ASP OD1 1 1
1 127 1 1 7 ASP OD2 O 15.595 -11.033 -7.647 1.00 . A A . 7 ASP OD2 1 1
1 128 1 1 8 GLN C C 14.898 -17.601 -9.626 1.00 . A A . 8 GLN C 1 1
1 129 1 1 8 GLN CA C 13.386 -17.415 -9.482 1.00 . A A . 8 GLN CA 1 1
1 130 1 1 8 GLN CB C 12.731 -17.513 -10.859 1.00 . A A . 8 GLN CB 1 1
1 131 1 1 8 GLN CD C 10.674 -16.119 -10.612 1.00 . A A . 8 GLN CD 1 1
1 132 1 1 8 GLN CG C 11.210 -17.549 -10.701 1.00 . A A . 8 GLN CG 1 1
1 133 1 1 8 GLN H H 12.178 -15.792 -8.748 1.00 . A A . 8 GLN H 1 1
1 134 1 1 8 GLN HA H 12.988 -18.182 -8.837 1.00 . A A . 8 GLN HA 1 1
1 135 1 1 8 GLN HB2 H 13.012 -16.655 -11.453 1.00 . A A . 8 GLN HB2 1 1
1 136 1 1 8 GLN HB3 H 13.063 -18.414 -11.350 1.00 . A A . 8 GLN HB3 1 1
1 137 1 1 8 GLN HE21 H 10.580 -16.127 -8.629 1.00 . A A . 8 GLN HE21 1 1
1 138 1 1 8 GLN HE22 H 10.079 -14.686 -9.373 1.00 . A A . 8 GLN HE22 1 1
1 139 1 1 8 GLN HG2 H 10.772 -18.047 -11.554 1.00 . A A . 8 GLN HG2 1 1
1 140 1 1 8 GLN HG3 H 10.954 -18.084 -9.799 1.00 . A A . 8 GLN HG3 1 1
1 141 1 1 8 GLN N N 13.104 -16.077 -8.895 1.00 . A A . 8 GLN N 1 1
1 142 1 1 8 GLN NE2 N 10.423 -15.600 -9.441 1.00 . A A . 8 GLN NE2 1 1
1 143 1 1 8 GLN O O 15.367 -18.622 -10.087 1.00 . A A . 8 GLN O 1 1
1 144 1 1 8 GLN OE1 O 10.480 -15.467 -11.618 1.00 . A A . 8 GLN OE1 1 1
1 145 1 1 9 ASP C C 17.638 -17.862 -8.448 1.00 . A A . 9 ASP C 1 1
1 146 1 1 9 ASP CA C 17.143 -16.733 -9.353 1.00 . A A . 9 ASP CA 1 1
1 147 1 1 9 ASP CB C 17.791 -15.415 -8.926 1.00 . A A . 9 ASP CB 1 1
1 148 1 1 9 ASP CG C 18.915 -15.059 -9.901 1.00 . A A . 9 ASP CG 1 1
1 149 1 1 9 ASP H H 15.260 -15.805 -8.869 1.00 . A A . 9 ASP H 1 1
1 150 1 1 9 ASP HA H 17.408 -16.950 -10.377 1.00 . A A . 9 ASP HA 1 1
1 151 1 1 9 ASP HB2 H 17.048 -14.631 -8.929 1.00 . A A . 9 ASP HB2 1 1
1 152 1 1 9 ASP HB3 H 18.200 -15.521 -7.932 1.00 . A A . 9 ASP HB3 1 1
1 153 1 1 9 ASP N N 15.661 -16.618 -9.237 1.00 . A A . 9 ASP N 1 1
1 154 1 1 9 ASP O O 18.474 -18.657 -8.831 1.00 . A A . 9 ASP O 1 1
1 155 1 1 9 ASP OD1 O 19.949 -15.705 -9.845 1.00 . A A . 9 ASP OD1 1 1
1 156 1 1 9 ASP OD2 O 18.722 -14.146 -10.688 1.00 . A A . 9 ASP OD2 1 1
1 157 1 1 10 GLU C C 16.490 -20.102 -6.254 1.00 . A A . 10 GLU C 1 1
1 158 1 1 10 GLU CA C 17.569 -19.019 -6.323 1.00 . A A . 10 GLU CA 1 1
1 159 1 1 10 GLU CB C 17.789 -18.429 -4.928 1.00 . A A . 10 GLU CB 1 1
1 160 1 1 10 GLU CD C 19.908 -19.037 -3.752 1.00 . A A . 10 GLU CD 1 1
1 161 1 1 10 GLU CG C 18.468 -19.468 -4.034 1.00 . A A . 10 GLU CG 1 1
1 162 1 1 10 GLU H H 16.454 -17.291 -6.962 1.00 . A A . 10 GLU H 1 1
1 163 1 1 10 GLU HA H 18.491 -19.450 -6.682 1.00 . A A . 10 GLU HA 1 1
1 164 1 1 10 GLU HB2 H 18.417 -17.553 -5.003 1.00 . A A . 10 GLU HB2 1 1
1 165 1 1 10 GLU HB3 H 16.837 -18.154 -4.499 1.00 . A A . 10 GLU HB3 1 1
1 166 1 1 10 GLU HG2 H 17.926 -19.551 -3.103 1.00 . A A . 10 GLU HG2 1 1
1 167 1 1 10 GLU HG3 H 18.473 -20.425 -4.534 1.00 . A A . 10 GLU HG3 1 1
1 168 1 1 10 GLU N N 17.128 -17.941 -7.250 1.00 . A A . 10 GLU N 1 1
1 169 1 1 10 GLU O O 16.256 -20.694 -5.219 1.00 . A A . 10 GLU O 1 1
1 170 1 1 10 GLU OE1 O 20.655 -18.879 -4.703 1.00 . A A . 10 GLU OE1 1 1
1 171 1 1 10 GLU OE2 O 20.238 -18.870 -2.590 1.00 . A A . 10 GLU OE2 1 1
1 172 1 1 11 CYS C C 15.300 -22.683 -8.008 1.00 . A A . 11 CYS C 1 1
1 173 1 1 11 CYS CA C 14.769 -21.411 -7.346 1.00 . A A . 11 CYS CA 1 1
1 174 1 1 11 CYS CB C 13.549 -20.901 -8.118 1.00 . A A . 11 CYS CB 1 1
1 175 1 1 11 CYS H H 16.036 -19.877 -8.174 1.00 . A A . 11 CYS H 1 1
1 176 1 1 11 CYS HA H 14.484 -21.628 -6.327 1.00 . A A . 11 CYS HA 1 1
1 177 1 1 11 CYS HB2 H 13.078 -20.105 -7.561 1.00 . A A . 11 CYS HB2 1 1
1 178 1 1 11 CYS HB3 H 13.864 -20.528 -9.081 1.00 . A A . 11 CYS HB3 1 1
1 179 1 1 11 CYS N N 15.832 -20.366 -7.350 1.00 . A A . 11 CYS N 1 1
1 180 1 1 11 CYS O O 15.669 -22.685 -9.165 1.00 . A A . 11 CYS O 1 1
1 181 1 1 11 CYS SG S 12.269 -22.171 -8.427 1.00 . A A . 11 CYS SG 1 1
1 182 1 1 12 ILE C C 14.847 -25.560 -8.900 1.00 . A A . 12 ILE C 1 1
1 183 1 1 12 ILE CA C 15.848 -25.040 -7.867 1.00 . A A . 12 ILE CA 1 1
1 184 1 1 12 ILE CB C 16.024 -26.078 -6.757 1.00 . A A . 12 ILE CB 1 1
1 185 1 1 12 ILE CD1 C 14.924 -27.178 -4.800 1.00 . A A . 12 ILE CD1 1 1
1 186 1 1 12 ILE CG1 C 14.742 -26.155 -5.922 1.00 . A A . 12 ILE CG1 1 1
1 187 1 1 12 ILE CG2 C 17.193 -25.672 -5.857 1.00 . A A . 12 ILE CG2 1 1
1 188 1 1 12 ILE H H 15.038 -23.743 -6.349 1.00 . A A . 12 ILE H 1 1
1 189 1 1 12 ILE HA H 16.799 -24.861 -8.346 1.00 . A A . 12 ILE HA 1 1
1 190 1 1 12 ILE HB H 16.228 -27.044 -7.196 1.00 . A A . 12 ILE HB 1 1
1 191 1 1 12 ILE HD11 H 15.786 -26.912 -4.205 1.00 . A A . 12 ILE HD11 1 1
1 192 1 1 12 ILE HD12 H 14.044 -27.187 -4.175 1.00 . A A . 12 ILE HD12 1 1
1 193 1 1 12 ILE HD13 H 15.071 -28.159 -5.227 1.00 . A A . 12 ILE HD13 1 1
1 194 1 1 12 ILE HG12 H 14.534 -25.184 -5.495 1.00 . A A . 12 ILE HG12 1 1
1 195 1 1 12 ILE HG13 H 13.920 -26.456 -6.552 1.00 . A A . 12 ILE HG13 1 1
1 196 1 1 12 ILE HG21 H 17.934 -25.150 -6.445 1.00 . A A . 12 ILE HG21 1 1
1 197 1 1 12 ILE HG22 H 16.834 -25.023 -5.072 1.00 . A A . 12 ILE HG22 1 1
1 198 1 1 12 ILE HG23 H 17.635 -26.555 -5.421 1.00 . A A . 12 ILE HG23 1 1
1 199 1 1 12 ILE N N 15.341 -23.767 -7.281 1.00 . A A . 12 ILE N 1 1
1 200 1 1 12 ILE O O 15.140 -25.638 -10.076 1.00 . A A . 12 ILE O 1 1
1 201 1 1 13 ALA C C 11.557 -27.181 -8.668 1.00 . A A . 13 ALA C 1 1
1 202 1 1 13 ALA CA C 12.649 -26.428 -9.431 1.00 . A A . 13 ALA CA 1 1
1 203 1 1 13 ALA CB C 13.320 -27.376 -10.428 1.00 . A A . 13 ALA CB 1 1
1 204 1 1 13 ALA H H 13.450 -25.843 -7.518 1.00 . A A . 13 ALA H 1 1
1 205 1 1 13 ALA HA H 12.208 -25.600 -9.965 1.00 . A A . 13 ALA HA 1 1
1 206 1 1 13 ALA HB1 H 14.344 -27.071 -10.581 1.00 . A A . 13 ALA HB1 1 1
1 207 1 1 13 ALA HB2 H 13.299 -28.383 -10.036 1.00 . A A . 13 ALA HB2 1 1
1 208 1 1 13 ALA HB3 H 12.789 -27.345 -11.367 1.00 . A A . 13 ALA HB3 1 1
1 209 1 1 13 ALA N N 13.667 -25.915 -8.471 1.00 . A A . 13 ALA N 1 1
1 210 1 1 13 ALA O O 10.902 -28.053 -9.204 1.00 . A A . 13 ALA O 1 1
1 211 1 1 14 CYS C C 9.017 -26.722 -6.643 1.00 . A A . 14 CYS C 1 1
1 212 1 1 14 CYS CA C 10.302 -27.554 -6.631 1.00 . A A . 14 CYS CA 1 1
1 213 1 1 14 CYS CB C 10.782 -27.745 -5.191 1.00 . A A . 14 CYS CB 1 1
1 214 1 1 14 CYS H H 11.891 -26.147 -7.004 1.00 . A A . 14 CYS H 1 1
1 215 1 1 14 CYS HA H 10.106 -28.520 -7.075 1.00 . A A . 14 CYS HA 1 1
1 216 1 1 14 CYS HB2 H 10.443 -28.703 -4.825 1.00 . A A . 14 CYS HB2 1 1
1 217 1 1 14 CYS HB3 H 11.862 -27.717 -5.168 1.00 . A A . 14 CYS HB3 1 1
1 218 1 1 14 CYS N N 11.354 -26.854 -7.420 1.00 . A A . 14 CYS N 1 1
1 219 1 1 14 CYS O O 9.052 -25.508 -6.645 1.00 . A A . 14 CYS O 1 1
1 220 1 1 14 CYS SG S 10.205 -26.496 -3.985 1.00 . A A . 14 CYS SG 1 1
1 221 1 1 15 GLU C C 6.107 -26.379 -5.249 1.00 . A A . 15 GLU C 1 1
1 222 1 1 15 GLU CA C 6.595 -26.614 -6.681 1.00 . A A . 15 GLU CA 1 1
1 223 1 1 15 GLU CB C 5.546 -27.423 -7.448 1.00 . A A . 15 GLU CB 1 1
1 224 1 1 15 GLU CD C 5.200 -28.774 -9.522 1.00 . A A . 15 GLU CD 1 1
1 225 1 1 15 GLU CG C 6.033 -27.662 -8.879 1.00 . A A . 15 GLU CG 1 1
1 226 1 1 15 GLU H H 7.876 -28.348 -6.663 1.00 . A A . 15 GLU H 1 1
1 227 1 1 15 GLU HA H 6.744 -25.664 -7.170 1.00 . A A . 15 GLU HA 1 1
1 228 1 1 15 GLU HB2 H 5.392 -28.372 -6.955 1.00 . A A . 15 GLU HB2 1 1
1 229 1 1 15 GLU HB3 H 4.617 -26.875 -7.474 1.00 . A A . 15 GLU HB3 1 1
1 230 1 1 15 GLU HG2 H 5.926 -26.754 -9.452 1.00 . A A . 15 GLU HG2 1 1
1 231 1 1 15 GLU HG3 H 7.072 -27.958 -8.862 1.00 . A A . 15 GLU HG3 1 1
1 232 1 1 15 GLU N N 7.882 -27.368 -6.660 1.00 . A A . 15 GLU N 1 1
1 233 1 1 15 GLU O O 4.973 -26.005 -5.026 1.00 . A A . 15 GLU O 1 1
1 234 1 1 15 GLU OE1 O 3.991 -28.624 -9.578 1.00 . A A . 15 GLU OE1 1 1
1 235 1 1 15 GLU OE2 O 5.787 -29.755 -9.949 1.00 . A A . 15 GLU OE2 1 1
1 236 1 1 16 SER C C 5.705 -25.085 -2.776 1.00 . A A . 16 SER C 1 1
1 237 1 1 16 SER CA C 6.525 -26.374 -2.865 1.00 . A A . 16 SER CA 1 1
1 238 1 1 16 SER CB C 7.762 -26.255 -1.972 1.00 . A A . 16 SER CB 1 1
1 239 1 1 16 SER H H 7.863 -26.891 -4.474 1.00 . A A . 16 SER H 1 1
1 240 1 1 16 SER HA H 5.923 -27.209 -2.538 1.00 . A A . 16 SER HA 1 1
1 241 1 1 16 SER HB2 H 8.482 -25.605 -2.436 1.00 . A A . 16 SER HB2 1 1
1 242 1 1 16 SER HB3 H 7.473 -25.844 -1.013 1.00 . A A . 16 SER HB3 1 1
1 243 1 1 16 SER HG H 9.102 -27.449 -1.221 1.00 . A A . 16 SER HG 1 1
1 244 1 1 16 SER N N 6.951 -26.591 -4.277 1.00 . A A . 16 SER N 1 1
1 245 1 1 16 SER O O 4.559 -25.093 -2.372 1.00 . A A . 16 SER O 1 1
1 246 1 1 16 SER OG O 8.338 -27.543 -1.795 1.00 . A A . 16 SER OG 1 1
1 247 1 1 17 CYS C C 4.370 -22.731 -4.081 1.00 . A A . 17 CYS C 1 1
1 248 1 1 17 CYS CA C 5.540 -22.687 -3.097 1.00 . A A . 17 CYS CA 1 1
1 249 1 1 17 CYS CB C 6.485 -21.546 -3.477 1.00 . A A . 17 CYS CB 1 1
1 250 1 1 17 CYS H H 7.208 -23.996 -3.478 1.00 . A A . 17 CYS H 1 1
1 251 1 1 17 CYS HA H 5.166 -22.529 -2.096 1.00 . A A . 17 CYS HA 1 1
1 252 1 1 17 CYS HB2 H 6.028 -20.600 -3.223 1.00 . A A . 17 CYS HB2 1 1
1 253 1 1 17 CYS HB3 H 7.414 -21.653 -2.938 1.00 . A A . 17 CYS HB3 1 1
1 254 1 1 17 CYS N N 6.283 -23.977 -3.154 1.00 . A A . 17 CYS N 1 1
1 255 1 1 17 CYS O O 3.239 -22.464 -3.728 1.00 . A A . 17 CYS O 1 1
1 256 1 1 17 CYS SG S 6.893 -21.486 -5.259 1.00 . A A . 17 CYS SG 1 1
1 257 1 1 18 VAL C C 2.303 -23.775 -5.682 1.00 . A A . 18 VAL C 1 1
1 258 1 1 18 VAL CA C 3.535 -23.130 -6.318 1.00 . A A . 18 VAL CA 1 1
1 259 1 1 18 VAL CB C 3.987 -23.965 -7.519 1.00 . A A . 18 VAL CB 1 1
1 260 1 1 18 VAL CG1 C 2.804 -24.184 -8.463 1.00 . A A . 18 VAL CG1 1 1
1 261 1 1 18 VAL CG2 C 5.102 -23.226 -8.261 1.00 . A A . 18 VAL CG2 1 1
1 262 1 1 18 VAL H H 5.552 -23.281 -5.578 1.00 . A A . 18 VAL H 1 1
1 263 1 1 18 VAL HA H 3.289 -22.131 -6.646 1.00 . A A . 18 VAL HA 1 1
1 264 1 1 18 VAL HB H 4.353 -24.921 -7.174 1.00 . A A . 18 VAL HB 1 1
1 265 1 1 18 VAL HG11 H 2.239 -23.267 -8.551 1.00 . A A . 18 VAL HG11 1 1
1 266 1 1 18 VAL HG12 H 3.169 -24.476 -9.437 1.00 . A A . 18 VAL HG12 1 1
1 267 1 1 18 VAL HG13 H 2.167 -24.962 -8.070 1.00 . A A . 18 VAL HG13 1 1
1 268 1 1 18 VAL HG21 H 4.752 -22.246 -8.551 1.00 . A A . 18 VAL HG21 1 1
1 269 1 1 18 VAL HG22 H 5.960 -23.125 -7.614 1.00 . A A . 18 VAL HG22 1 1
1 270 1 1 18 VAL HG23 H 5.378 -23.784 -9.144 1.00 . A A . 18 VAL HG23 1 1
1 271 1 1 18 VAL N N 4.633 -23.068 -5.313 1.00 . A A . 18 VAL N 1 1
1 272 1 1 18 VAL O O 1.189 -23.330 -5.873 1.00 . A A . 18 VAL O 1 1
1 273 1 1 19 GLU C C 0.729 -24.546 -3.229 1.00 . A A . 19 GLU C 1 1
1 274 1 1 19 GLU CA C 1.332 -25.486 -4.272 1.00 . A A . 19 GLU CA 1 1
1 275 1 1 19 GLU CB C 1.796 -26.776 -3.591 1.00 . A A . 19 GLU CB 1 1
1 276 1 1 19 GLU CD C 0.362 -28.822 -3.549 1.00 . A A . 19 GLU CD 1 1
1 277 1 1 19 GLU CG C 1.317 -27.982 -4.401 1.00 . A A . 19 GLU CG 1 1
1 278 1 1 19 GLU H H 3.401 -25.162 -4.777 1.00 . A A . 19 GLU H 1 1
1 279 1 1 19 GLU HA H 0.587 -25.719 -5.017 1.00 . A A . 19 GLU HA 1 1
1 280 1 1 19 GLU HB2 H 2.875 -26.786 -3.534 1.00 . A A . 19 GLU HB2 1 1
1 281 1 1 19 GLU HB3 H 1.383 -26.827 -2.594 1.00 . A A . 19 GLU HB3 1 1
1 282 1 1 19 GLU HG2 H 0.803 -27.639 -5.287 1.00 . A A . 19 GLU HG2 1 1
1 283 1 1 19 GLU HG3 H 2.165 -28.586 -4.686 1.00 . A A . 19 GLU HG3 1 1
1 284 1 1 19 GLU N N 2.494 -24.819 -4.921 1.00 . A A . 19 GLU N 1 1
1 285 1 1 19 GLU O O -0.451 -24.257 -3.248 1.00 . A A . 19 GLU O 1 1
1 286 1 1 19 GLU OE1 O 0.805 -29.349 -2.542 1.00 . A A . 19 GLU OE1 1 1
1 287 1 1 19 GLU OE2 O -0.797 -28.924 -3.920 1.00 . A A . 19 GLU OE2 1 1
1 288 1 1 20 ILE C C 0.487 -21.861 -1.969 1.00 . A A . 20 ILE C 1 1
1 289 1 1 20 ILE CA C 0.996 -23.131 -1.286 1.00 . A A . 20 ILE CA 1 1
1 290 1 1 20 ILE CB C 2.106 -22.769 -0.300 1.00 . A A . 20 ILE CB 1 1
1 291 1 1 20 ILE CD1 C 3.817 -24.493 0.216 1.00 . A A . 20 ILE CD1 1 1
1 292 1 1 20 ILE CG1 C 2.423 -23.965 0.559 1.00 . A A . 20 ILE CG1 1 1
1 293 1 1 20 ILE CG2 C 1.660 -21.608 0.586 1.00 . A A . 20 ILE CG2 1 1
1 294 1 1 20 ILE H H 2.479 -24.298 -2.324 1.00 . A A . 20 ILE H 1 1
1 295 1 1 20 ILE HA H 0.186 -23.607 -0.756 1.00 . A A . 20 ILE HA 1 1
1 296 1 1 20 ILE HB H 2.982 -22.499 -0.830 1.00 . A A . 20 ILE HB 1 1
1 297 1 1 20 ILE HD11 H 4.515 -23.669 0.179 1.00 . A A . 20 ILE HD11 1 1
1 298 1 1 20 ILE HD12 H 4.132 -25.197 0.972 1.00 . A A . 20 ILE HD12 1 1
1 299 1 1 20 ILE HD13 H 3.790 -24.985 -0.745 1.00 . A A . 20 ILE HD13 1 1
1 300 1 1 20 ILE HG12 H 2.394 -23.667 1.584 1.00 . A A . 20 ILE HG12 1 1
1 301 1 1 20 ILE HG13 H 1.698 -24.726 0.374 1.00 . A A . 20 ILE HG13 1 1
1 302 1 1 20 ILE HG21 H 0.589 -21.645 0.716 1.00 . A A . 20 ILE HG21 1 1
1 303 1 1 20 ILE HG22 H 2.142 -21.685 1.550 1.00 . A A . 20 ILE HG22 1 1
1 304 1 1 20 ILE HG23 H 1.934 -20.673 0.120 1.00 . A A . 20 ILE HG23 1 1
1 305 1 1 20 ILE N N 1.530 -24.059 -2.321 1.00 . A A . 20 ILE N 1 1
1 306 1 1 20 ILE O O 0.132 -20.896 -1.324 1.00 . A A . 20 ILE O 1 1
1 307 1 1 21 ALA C C -0.019 -20.929 -5.509 1.00 . A A . 21 ALA C 1 1
1 308 1 1 21 ALA CA C -0.034 -20.653 -4.004 1.00 . A A . 21 ALA CA 1 1
1 309 1 1 21 ALA CB C 0.881 -19.467 -3.694 1.00 . A A . 21 ALA CB 1 1
1 310 1 1 21 ALA H H 0.743 -22.650 -3.775 1.00 . A A . 21 ALA H 1 1
1 311 1 1 21 ALA HA H -1.041 -20.423 -3.689 1.00 . A A . 21 ALA HA 1 1
1 312 1 1 21 ALA HB1 H 1.904 -19.733 -3.921 1.00 . A A . 21 ALA HB1 1 1
1 313 1 1 21 ALA HB2 H 0.588 -18.619 -4.294 1.00 . A A . 21 ALA HB2 1 1
1 314 1 1 21 ALA HB3 H 0.799 -19.213 -2.648 1.00 . A A . 21 ALA HB3 1 1
1 315 1 1 21 ALA N N 0.450 -21.858 -3.274 1.00 . A A . 21 ALA N 1 1
1 316 1 1 21 ALA O O 0.737 -20.325 -6.244 1.00 . A A . 21 ALA O 1 1
1 317 1 1 22 PRO C C -1.653 -21.101 -8.145 1.00 . A A . 22 PRO C 1 1
1 318 1 1 22 PRO CA C -0.951 -22.208 -7.353 1.00 . A A . 22 PRO CA 1 1
1 319 1 1 22 PRO CB C -1.784 -23.489 -7.346 1.00 . A A . 22 PRO CB 1 1
1 320 1 1 22 PRO CD C -1.799 -22.604 -5.086 1.00 . A A . 22 PRO CD 1 1
1 321 1 1 22 PRO CG C -2.591 -23.419 -6.086 1.00 . A A . 22 PRO CG 1 1
1 322 1 1 22 PRO HA H 0.029 -22.405 -7.758 1.00 . A A . 22 PRO HA 1 1
1 323 1 1 22 PRO HB2 H -2.408 -23.512 -8.231 1.00 . A A . 22 PRO HB2 1 1
1 324 1 1 22 PRO HB3 H -1.128 -24.343 -7.348 1.00 . A A . 22 PRO HB3 1 1
1 325 1 1 22 PRO HD2 H -2.454 -21.943 -4.536 1.00 . A A . 22 PRO HD2 1 1
1 326 1 1 22 PRO HD3 H -1.262 -23.252 -4.412 1.00 . A A . 22 PRO HD3 1 1
1 327 1 1 22 PRO HG2 H -3.539 -22.941 -6.287 1.00 . A A . 22 PRO HG2 1 1
1 328 1 1 22 PRO HG3 H -2.751 -24.413 -5.699 1.00 . A A . 22 PRO HG3 1 1
1 329 1 1 22 PRO N N -0.860 -21.840 -5.916 1.00 . A A . 22 PRO N 1 1
1 330 1 1 22 PRO O O -2.345 -21.358 -9.110 1.00 . A A . 22 PRO O 1 1
1 331 1 1 23 GLY C C -1.159 -17.578 -8.589 1.00 . A A . 23 GLY C 1 1
1 332 1 1 23 GLY CA C -2.135 -18.749 -8.474 1.00 . A A . 23 GLY CA 1 1
1 333 1 1 23 GLY H H -0.916 -19.685 -6.965 1.00 . A A . 23 GLY H 1 1
1 334 1 1 23 GLY HA2 H -2.421 -19.081 -9.462 1.00 . A A . 23 GLY HA2 1 1
1 335 1 1 23 GLY HA3 H -3.012 -18.431 -7.932 1.00 . A A . 23 GLY HA3 1 1
1 336 1 1 23 GLY N N -1.479 -19.871 -7.745 1.00 . A A . 23 GLY N 1 1
1 337 1 1 23 GLY O O -1.149 -16.859 -9.569 1.00 . A A . 23 GLY O 1 1
1 338 1 1 24 ALA C C 2.017 -16.795 -8.042 1.00 . A A . 24 ALA C 1 1
1 339 1 1 24 ALA CA C 0.641 -16.257 -7.647 1.00 . A A . 24 ALA CA 1 1
1 340 1 1 24 ALA CB C 0.728 -15.594 -6.272 1.00 . A A . 24 ALA CB 1 1
1 341 1 1 24 ALA H H -0.360 -17.973 -6.814 1.00 . A A . 24 ALA H 1 1
1 342 1 1 24 ALA HA H 0.315 -15.530 -8.377 1.00 . A A . 24 ALA HA 1 1
1 343 1 1 24 ALA HB1 H -0.256 -15.275 -5.962 1.00 . A A . 24 ALA HB1 1 1
1 344 1 1 24 ALA HB2 H 1.120 -16.301 -5.555 1.00 . A A . 24 ALA HB2 1 1
1 345 1 1 24 ALA HB3 H 1.383 -14.737 -6.326 1.00 . A A . 24 ALA HB3 1 1
1 346 1 1 24 ALA N N -0.336 -17.381 -7.596 1.00 . A A . 24 ALA N 1 1
1 347 1 1 24 ALA O O 2.706 -16.221 -8.863 1.00 . A A . 24 ALA O 1 1
1 348 1 1 25 PHE C C 3.593 -19.528 -8.893 1.00 . A A . 25 PHE C 1 1
1 349 1 1 25 PHE CA C 3.757 -18.463 -7.807 1.00 . A A . 25 PHE CA 1 1
1 350 1 1 25 PHE CB C 4.377 -19.099 -6.560 1.00 . A A . 25 PHE CB 1 1
1 351 1 1 25 PHE CD1 C 6.723 -18.423 -7.184 1.00 . A A . 25 PHE CD1 1 1
1 352 1 1 25 PHE CD2 C 5.865 -17.780 -5.009 1.00 . A A . 25 PHE CD2 1 1
1 353 1 1 25 PHE CE1 C 7.938 -17.792 -6.891 1.00 . A A . 25 PHE CE1 1 1
1 354 1 1 25 PHE CE2 C 7.079 -17.149 -4.717 1.00 . A A . 25 PHE CE2 1 1
1 355 1 1 25 PHE CG C 5.686 -18.417 -6.243 1.00 . A A . 25 PHE CG 1 1
1 356 1 1 25 PHE CZ C 8.116 -17.155 -5.657 1.00 . A A . 25 PHE CZ 1 1
1 357 1 1 25 PHE H H 1.855 -18.339 -6.804 1.00 . A A . 25 PHE H 1 1
1 358 1 1 25 PHE HA H 4.404 -17.677 -8.169 1.00 . A A . 25 PHE HA 1 1
1 359 1 1 25 PHE HB2 H 3.700 -18.986 -5.724 1.00 . A A . 25 PHE HB2 1 1
1 360 1 1 25 PHE HB3 H 4.552 -20.148 -6.740 1.00 . A A . 25 PHE HB3 1 1
1 361 1 1 25 PHE HD1 H 6.586 -18.914 -8.136 1.00 . A A . 25 PHE HD1 1 1
1 362 1 1 25 PHE HD2 H 5.065 -17.775 -4.284 1.00 . A A . 25 PHE HD2 1 1
1 363 1 1 25 PHE HE1 H 8.738 -17.797 -7.617 1.00 . A A . 25 PHE HE1 1 1
1 364 1 1 25 PHE HE2 H 7.217 -16.658 -3.764 1.00 . A A . 25 PHE HE2 1 1
1 365 1 1 25 PHE HZ H 9.053 -16.668 -5.432 1.00 . A A . 25 PHE HZ 1 1
1 366 1 1 25 PHE N N 2.425 -17.892 -7.464 1.00 . A A . 25 PHE N 1 1
1 367 1 1 25 PHE O O 2.648 -20.292 -8.890 1.00 . A A . 25 PHE O 1 1
1 368 1 1 26 ALA C C 5.667 -20.535 -11.777 1.00 . A A . 26 ALA C 1 1
1 369 1 1 26 ALA CA C 4.409 -20.598 -10.908 1.00 . A A . 26 ALA CA 1 1
1 370 1 1 26 ALA CB C 3.179 -20.304 -11.770 1.00 . A A . 26 ALA CB 1 1
1 371 1 1 26 ALA H H 5.261 -18.958 -9.803 1.00 . A A . 26 ALA H 1 1
1 372 1 1 26 ALA HA H 4.319 -21.583 -10.475 1.00 . A A . 26 ALA HA 1 1
1 373 1 1 26 ALA HB1 H 3.251 -19.304 -12.171 1.00 . A A . 26 ALA HB1 1 1
1 374 1 1 26 ALA HB2 H 3.130 -21.016 -12.581 1.00 . A A . 26 ALA HB2 1 1
1 375 1 1 26 ALA HB3 H 2.289 -20.385 -11.164 1.00 . A A . 26 ALA HB3 1 1
1 376 1 1 26 ALA N N 4.508 -19.584 -9.821 1.00 . A A . 26 ALA N 1 1
1 377 1 1 26 ALA O O 5.905 -19.567 -12.472 1.00 . A A . 26 ALA O 1 1
1 378 1 1 27 MET C C 7.351 -21.405 -14.043 1.00 . A A . 27 MET C 1 1
1 379 1 1 27 MET CA C 7.718 -21.554 -12.566 1.00 . A A . 27 MET CA 1 1
1 380 1 1 27 MET CB C 8.473 -22.870 -12.358 1.00 . A A . 27 MET CB 1 1
1 381 1 1 27 MET CE C 7.303 -26.342 -13.844 1.00 . A A . 27 MET CE 1 1
1 382 1 1 27 MET CG C 7.487 -24.039 -12.416 1.00 . A A . 27 MET CG 1 1
1 383 1 1 27 MET H H 6.267 -22.329 -11.175 1.00 . A A . 27 MET H 1 1
1 384 1 1 27 MET HA H 8.346 -20.728 -12.266 1.00 . A A . 27 MET HA 1 1
1 385 1 1 27 MET HB2 H 9.215 -22.984 -13.135 1.00 . A A . 27 MET HB2 1 1
1 386 1 1 27 MET HB3 H 8.959 -22.858 -11.394 1.00 . A A . 27 MET HB3 1 1
1 387 1 1 27 MET HE1 H 6.976 -25.586 -14.546 1.00 . A A . 27 MET HE1 1 1
1 388 1 1 27 MET HE2 H 7.831 -27.117 -14.375 1.00 . A A . 27 MET HE2 1 1
1 389 1 1 27 MET HE3 H 6.446 -26.770 -13.343 1.00 . A A . 27 MET HE3 1 1
1 390 1 1 27 MET HG2 H 6.918 -24.074 -11.500 1.00 . A A . 27 MET HG2 1 1
1 391 1 1 27 MET HG3 H 6.817 -23.904 -13.253 1.00 . A A . 27 MET HG3 1 1
1 392 1 1 27 MET N N 6.477 -21.558 -11.743 1.00 . A A . 27 MET N 1 1
1 393 1 1 27 MET O O 6.313 -21.859 -14.482 1.00 . A A . 27 MET O 1 1
1 394 1 1 27 MET SD S 8.401 -25.588 -12.619 1.00 . A A . 27 MET SD 1 1
1 395 1 1 28 ASP C C 9.075 -21.107 -17.080 1.00 . A A . 28 ASP C 1 1
1 396 1 1 28 ASP CA C 7.890 -20.598 -16.261 1.00 . A A . 28 ASP CA 1 1
1 397 1 1 28 ASP CB C 7.664 -19.114 -16.555 1.00 . A A . 28 ASP CB 1 1
1 398 1 1 28 ASP CG C 7.018 -18.956 -17.932 1.00 . A A . 28 ASP CG 1 1
1 399 1 1 28 ASP H H 9.027 -20.413 -14.446 1.00 . A A . 28 ASP H 1 1
1 400 1 1 28 ASP HA H 7.003 -21.158 -16.516 1.00 . A A . 28 ASP HA 1 1
1 401 1 1 28 ASP HB2 H 7.014 -18.693 -15.801 1.00 . A A . 28 ASP HB2 1 1
1 402 1 1 28 ASP HB3 H 8.613 -18.597 -16.542 1.00 . A A . 28 ASP HB3 1 1
1 403 1 1 28 ASP N N 8.193 -20.772 -14.815 1.00 . A A . 28 ASP N 1 1
1 404 1 1 28 ASP O O 10.084 -21.504 -16.526 1.00 . A A . 28 ASP O 1 1
1 405 1 1 28 ASP OD1 O 5.857 -19.308 -18.063 1.00 . A A . 28 ASP OD1 1 1
1 406 1 1 28 ASP OD2 O 7.694 -18.485 -18.832 1.00 . A A . 28 ASP OD2 1 1
1 407 1 1 29 PRO C C 10.958 -20.375 -19.497 1.00 . A A . 29 PRO C 1 1
1 408 1 1 29 PRO CA C 9.979 -21.522 -19.294 1.00 . A A . 29 PRO CA 1 1
1 409 1 1 29 PRO CB C 9.230 -21.845 -20.585 1.00 . A A . 29 PRO CB 1 1
1 410 1 1 29 PRO CD C 7.738 -20.588 -19.104 1.00 . A A . 29 PRO CD 1 1
1 411 1 1 29 PRO CG C 7.983 -21.007 -20.542 1.00 . A A . 29 PRO CG 1 1
1 412 1 1 29 PRO HA H 10.475 -22.399 -18.911 1.00 . A A . 29 PRO HA 1 1
1 413 1 1 29 PRO HB2 H 9.859 -21.596 -21.430 1.00 . A A . 29 PRO HB2 1 1
1 414 1 1 29 PRO HB3 H 8.998 -22.897 -20.609 1.00 . A A . 29 PRO HB3 1 1
1 415 1 1 29 PRO HD2 H 7.660 -19.511 -19.038 1.00 . A A . 29 PRO HD2 1 1
1 416 1 1 29 PRO HD3 H 6.849 -21.051 -18.723 1.00 . A A . 29 PRO HD3 1 1
1 417 1 1 29 PRO HG2 H 8.113 -20.133 -21.164 1.00 . A A . 29 PRO HG2 1 1
1 418 1 1 29 PRO HG3 H 7.145 -21.589 -20.897 1.00 . A A . 29 PRO HG3 1 1
1 419 1 1 29 PRO N N 8.912 -21.067 -18.377 1.00 . A A . 29 PRO N 1 1
1 420 1 1 29 PRO O O 12.140 -20.569 -19.701 1.00 . A A . 29 PRO O 1 1
1 421 1 1 30 GLU C C 12.192 -17.905 -18.276 1.00 . A A . 30 GLU C 1 1
1 422 1 1 30 GLU CA C 11.354 -17.990 -19.547 1.00 . A A . 30 GLU CA 1 1
1 423 1 1 30 GLU CB C 10.512 -16.721 -19.701 1.00 . A A . 30 GLU CB 1 1
1 424 1 1 30 GLU CD C 10.408 -14.464 -20.769 1.00 . A A . 30 GLU CD 1 1
1 425 1 1 30 GLU CG C 11.188 -15.777 -20.699 1.00 . A A . 30 GLU CG 1 1
1 426 1 1 30 GLU H H 9.508 -19.055 -19.207 1.00 . A A . 30 GLU H 1 1
1 427 1 1 30 GLU HA H 11.999 -18.116 -20.405 1.00 . A A . 30 GLU HA 1 1
1 428 1 1 30 GLU HB2 H 9.529 -16.984 -20.062 1.00 . A A . 30 GLU HB2 1 1
1 429 1 1 30 GLU HB3 H 10.425 -16.227 -18.745 1.00 . A A . 30 GLU HB3 1 1
1 430 1 1 30 GLU HG2 H 12.200 -15.579 -20.378 1.00 . A A . 30 GLU HG2 1 1
1 431 1 1 30 GLU HG3 H 11.202 -16.237 -21.676 1.00 . A A . 30 GLU HG3 1 1
1 432 1 1 30 GLU N N 10.465 -19.174 -19.403 1.00 . A A . 30 GLU N 1 1
1 433 1 1 30 GLU O O 13.372 -17.619 -18.303 1.00 . A A . 30 GLU O 1 1
1 434 1 1 30 GLU OE1 O 9.333 -14.465 -21.348 1.00 . A A . 30 GLU OE1 1 1
1 435 1 1 30 GLU OE2 O 10.897 -13.479 -20.242 1.00 . A A . 30 GLU OE2 1 1
1 436 1 1 31 ILE C C 12.370 -19.628 -15.377 1.00 . A A . 31 ILE C 1 1
1 437 1 1 31 ILE CA C 12.300 -18.186 -15.870 1.00 . A A . 31 ILE CA 1 1
1 438 1 1 31 ILE CB C 11.541 -17.328 -14.857 1.00 . A A . 31 ILE CB 1 1
1 439 1 1 31 ILE CD1 C 9.279 -16.742 -13.971 1.00 . A A . 31 ILE CD1 1 1
1 440 1 1 31 ILE CG1 C 10.037 -17.571 -15.008 1.00 . A A . 31 ILE CG1 1 1
1 441 1 1 31 ILE CG2 C 11.845 -15.850 -15.110 1.00 . A A . 31 ILE CG2 1 1
1 442 1 1 31 ILE H H 10.630 -18.447 -17.189 1.00 . A A . 31 ILE H 1 1
1 443 1 1 31 ILE HA H 13.295 -17.801 -16.009 1.00 . A A . 31 ILE HA 1 1
1 444 1 1 31 ILE HB H 11.853 -17.592 -13.856 1.00 . A A . 31 ILE HB 1 1
1 445 1 1 31 ILE HD11 H 9.948 -16.019 -13.529 1.00 . A A . 31 ILE HD11 1 1
1 446 1 1 31 ILE HD12 H 8.460 -16.227 -14.451 1.00 . A A . 31 ILE HD12 1 1
1 447 1 1 31 ILE HD13 H 8.894 -17.393 -13.201 1.00 . A A . 31 ILE HD13 1 1
1 448 1 1 31 ILE HG12 H 9.725 -17.282 -16.001 1.00 . A A . 31 ILE HG12 1 1
1 449 1 1 31 ILE HG13 H 9.825 -18.618 -14.854 1.00 . A A . 31 ILE HG13 1 1
1 450 1 1 31 ILE HG21 H 12.874 -15.743 -15.421 1.00 . A A . 31 ILE HG21 1 1
1 451 1 1 31 ILE HG22 H 11.194 -15.477 -15.887 1.00 . A A . 31 ILE HG22 1 1
1 452 1 1 31 ILE HG23 H 11.682 -15.288 -14.204 1.00 . A A . 31 ILE HG23 1 1
1 453 1 1 31 ILE N N 11.576 -18.194 -17.165 1.00 . A A . 31 ILE N 1 1
1 454 1 1 31 ILE O O 12.656 -19.898 -14.228 1.00 . A A . 31 ILE O 1 1
1 455 1 1 32 GLU C C 12.133 -22.103 -14.350 1.00 . A A . 32 GLU C 1 1
1 456 1 1 32 GLU CA C 12.123 -21.992 -15.872 1.00 . A A . 32 GLU CA 1 1
1 457 1 1 32 GLU CB C 13.374 -22.657 -16.448 1.00 . A A . 32 GLU CB 1 1
1 458 1 1 32 GLU CD C 14.418 -23.596 -18.516 1.00 . A A . 32 GLU CD 1 1
1 459 1 1 32 GLU CG C 13.176 -22.909 -17.944 1.00 . A A . 32 GLU CG 1 1
1 460 1 1 32 GLU H H 11.859 -20.304 -17.173 1.00 . A A . 32 GLU H 1 1
1 461 1 1 32 GLU HA H 11.239 -22.477 -16.262 1.00 . A A . 32 GLU HA 1 1
1 462 1 1 32 GLU HB2 H 14.226 -22.009 -16.300 1.00 . A A . 32 GLU HB2 1 1
1 463 1 1 32 GLU HB3 H 13.545 -23.598 -15.946 1.00 . A A . 32 GLU HB3 1 1
1 464 1 1 32 GLU HG2 H 12.313 -23.542 -18.091 1.00 . A A . 32 GLU HG2 1 1
1 465 1 1 32 GLU HG3 H 13.023 -21.967 -18.450 1.00 . A A . 32 GLU HG3 1 1
1 466 1 1 32 GLU N N 12.094 -20.556 -16.256 1.00 . A A . 32 GLU N 1 1
1 467 1 1 32 GLU O O 12.864 -22.883 -13.774 1.00 . A A . 32 GLU O 1 1
1 468 1 1 32 GLU OE1 O 14.757 -24.662 -18.030 1.00 . A A . 32 GLU OE1 1 1
1 469 1 1 32 GLU OE2 O 15.007 -23.043 -19.430 1.00 . A A . 32 GLU OE2 1 1
1 470 1 1 33 LYS C C 9.958 -20.757 -11.723 1.00 . A A . 33 LYS C 1 1
1 471 1 1 33 LYS CA C 11.275 -21.364 -12.210 1.00 . A A . 33 LYS CA 1 1
1 472 1 1 33 LYS CB C 12.447 -20.566 -11.636 1.00 . A A . 33 LYS CB 1 1
1 473 1 1 33 LYS CD C 14.900 -20.858 -12.022 1.00 . A A . 33 LYS CD 1 1
1 474 1 1 33 LYS CE C 15.933 -21.945 -12.321 1.00 . A A . 33 LYS CE 1 1
1 475 1 1 33 LYS CG C 13.643 -21.496 -11.425 1.00 . A A . 33 LYS CG 1 1
1 476 1 1 33 LYS H H 10.748 -20.700 -14.193 1.00 . A A . 33 LYS H 1 1
1 477 1 1 33 LYS HA H 11.342 -22.390 -11.878 1.00 . A A . 33 LYS HA 1 1
1 478 1 1 33 LYS HB2 H 12.718 -19.780 -12.327 1.00 . A A . 33 LYS HB2 1 1
1 479 1 1 33 LYS HB3 H 12.160 -20.132 -10.691 1.00 . A A . 33 LYS HB3 1 1
1 480 1 1 33 LYS HD2 H 14.642 -20.343 -12.936 1.00 . A A . 33 LYS HD2 1 1
1 481 1 1 33 LYS HD3 H 15.316 -20.154 -11.316 1.00 . A A . 33 LYS HD3 1 1
1 482 1 1 33 LYS HE2 H 15.843 -22.737 -11.592 1.00 . A A . 33 LYS HE2 1 1
1 483 1 1 33 LYS HE3 H 15.760 -22.344 -13.309 1.00 . A A . 33 LYS HE3 1 1
1 484 1 1 33 LYS HG2 H 13.790 -21.659 -10.367 1.00 . A A . 33 LYS HG2 1 1
1 485 1 1 33 LYS HG3 H 13.456 -22.441 -11.912 1.00 . A A . 33 LYS HG3 1 1
1 486 1 1 33 LYS HZ1 H 17.255 -20.343 -12.456 1.00 . A A . 33 LYS HZ1 1 1
1 487 1 1 33 LYS HZ2 H 17.695 -21.507 -11.300 1.00 . A A . 33 LYS HZ2 1 1
1 488 1 1 33 LYS HZ3 H 17.915 -21.829 -12.951 1.00 . A A . 33 LYS HZ3 1 1
1 489 1 1 33 LYS N N 11.324 -21.319 -13.699 1.00 . A A . 33 LYS N 1 1
1 490 1 1 33 LYS NZ N 17.303 -21.362 -12.252 1.00 . A A . 33 LYS NZ 1 1
1 491 1 1 33 LYS O O 9.225 -20.152 -12.479 1.00 . A A . 33 LYS O 1 1
1 492 1 1 34 ALA C C 8.534 -18.838 -9.736 1.00 . A A . 34 ALA C 1 1
1 493 1 1 34 ALA CA C 8.381 -20.349 -9.928 1.00 . A A . 34 ALA CA 1 1
1 494 1 1 34 ALA CB C 8.058 -21.004 -8.584 1.00 . A A . 34 ALA CB 1 1
1 495 1 1 34 ALA H H 10.256 -21.407 -9.871 1.00 . A A . 34 ALA H 1 1
1 496 1 1 34 ALA HA H 7.579 -20.544 -10.624 1.00 . A A . 34 ALA HA 1 1
1 497 1 1 34 ALA HB1 H 8.419 -22.022 -8.583 1.00 . A A . 34 ALA HB1 1 1
1 498 1 1 34 ALA HB2 H 8.539 -20.452 -7.789 1.00 . A A . 34 ALA HB2 1 1
1 499 1 1 34 ALA HB3 H 6.989 -21.000 -8.428 1.00 . A A . 34 ALA HB3 1 1
1 500 1 1 34 ALA N N 9.651 -20.915 -10.464 1.00 . A A . 34 ALA N 1 1
1 501 1 1 34 ALA O O 9.513 -18.367 -9.193 1.00 . A A . 34 ALA O 1 1
1 502 1 1 35 TYR C C 6.311 -16.058 -9.529 1.00 . A A . 35 TYR C 1 1
1 503 1 1 35 TYR CA C 7.655 -16.597 -10.020 1.00 . A A . 35 TYR CA 1 1
1 504 1 1 35 TYR CB C 7.997 -15.960 -11.369 1.00 . A A . 35 TYR CB 1 1
1 505 1 1 35 TYR CD1 C 6.003 -17.213 -12.271 1.00 . A A . 35 TYR CD1 1 1
1 506 1 1 35 TYR CD2 C 6.508 -15.018 -13.172 1.00 . A A . 35 TYR CD2 1 1
1 507 1 1 35 TYR CE1 C 4.901 -17.311 -13.128 1.00 . A A . 35 TYR CE1 1 1
1 508 1 1 35 TYR CE2 C 5.405 -15.116 -14.028 1.00 . A A . 35 TYR CE2 1 1
1 509 1 1 35 TYR CG C 6.808 -16.066 -12.293 1.00 . A A . 35 TYR CG 1 1
1 510 1 1 35 TYR CZ C 4.602 -16.263 -14.007 1.00 . A A . 35 TYR CZ 1 1
1 511 1 1 35 TYR H H 6.789 -18.478 -10.611 1.00 . A A . 35 TYR H 1 1
1 512 1 1 35 TYR HA H 8.425 -16.355 -9.301 1.00 . A A . 35 TYR HA 1 1
1 513 1 1 35 TYR HB2 H 8.248 -14.920 -11.221 1.00 . A A . 35 TYR HB2 1 1
1 514 1 1 35 TYR HB3 H 8.839 -16.475 -11.807 1.00 . A A . 35 TYR HB3 1 1
1 515 1 1 35 TYR HD1 H 6.234 -18.021 -11.594 1.00 . A A . 35 TYR HD1 1 1
1 516 1 1 35 TYR HD2 H 7.128 -14.134 -13.189 1.00 . A A . 35 TYR HD2 1 1
1 517 1 1 35 TYR HE1 H 4.282 -18.195 -13.111 1.00 . A A . 35 TYR HE1 1 1
1 518 1 1 35 TYR HE2 H 5.174 -14.309 -14.707 1.00 . A A . 35 TYR HE2 1 1
1 519 1 1 35 TYR HH H 3.841 -16.382 -15.754 1.00 . A A . 35 TYR HH 1 1
1 520 1 1 35 TYR N N 7.569 -18.076 -10.177 1.00 . A A . 35 TYR N 1 1
1 521 1 1 35 TYR O O 5.262 -16.477 -9.978 1.00 . A A . 35 TYR O 1 1
1 522 1 1 35 TYR OH O 3.515 -16.360 -14.851 1.00 . A A . 35 TYR OH 1 1
1 523 1 1 36 VAL C C 4.482 -13.585 -9.117 1.00 . A A . 36 VAL C 1 1
1 524 1 1 36 VAL CA C 5.053 -14.568 -8.094 1.00 . A A . 36 VAL CA 1 1
1 525 1 1 36 VAL CB C 5.312 -13.839 -6.774 1.00 . A A . 36 VAL CB 1 1
1 526 1 1 36 VAL CG1 C 5.358 -12.330 -7.022 1.00 . A A . 36 VAL CG1 1 1
1 527 1 1 36 VAL CG2 C 4.186 -14.157 -5.787 1.00 . A A . 36 VAL CG2 1 1
1 528 1 1 36 VAL H H 7.187 -14.806 -8.261 1.00 . A A . 36 VAL H 1 1
1 529 1 1 36 VAL HA H 4.346 -15.368 -7.930 1.00 . A A . 36 VAL HA 1 1
1 530 1 1 36 VAL HB H 6.257 -14.165 -6.363 1.00 . A A . 36 VAL HB 1 1
1 531 1 1 36 VAL HG11 H 6.118 -12.110 -7.757 1.00 . A A . 36 VAL HG11 1 1
1 532 1 1 36 VAL HG12 H 4.398 -11.995 -7.387 1.00 . A A . 36 VAL HG12 1 1
1 533 1 1 36 VAL HG13 H 5.590 -11.820 -6.100 1.00 . A A . 36 VAL HG13 1 1
1 534 1 1 36 VAL HG21 H 4.089 -15.229 -5.686 1.00 . A A . 36 VAL HG21 1 1
1 535 1 1 36 VAL HG22 H 4.417 -13.724 -4.825 1.00 . A A . 36 VAL HG22 1 1
1 536 1 1 36 VAL HG23 H 3.259 -13.745 -6.155 1.00 . A A . 36 VAL HG23 1 1
1 537 1 1 36 VAL N N 6.331 -15.132 -8.610 1.00 . A A . 36 VAL N 1 1
1 538 1 1 36 VAL O O 4.594 -12.384 -8.970 1.00 . A A . 36 VAL O 1 1
1 539 1 1 37 LYS C C 1.919 -12.690 -10.734 1.00 . A A . 37 LYS C 1 1
1 540 1 1 37 LYS CA C 3.296 -13.179 -11.190 1.00 . A A . 37 LYS CA 1 1
1 541 1 1 37 LYS CB C 3.155 -13.937 -12.512 1.00 . A A . 37 LYS CB 1 1
1 542 1 1 37 LYS CD C 1.081 -15.053 -13.347 1.00 . A A . 37 LYS CD 1 1
1 543 1 1 37 LYS CE C 0.317 -16.378 -13.360 1.00 . A A . 37 LYS CE 1 1
1 544 1 1 37 LYS CG C 2.214 -15.127 -12.321 1.00 . A A . 37 LYS CG 1 1
1 545 1 1 37 LYS H H 3.792 -15.057 -10.257 1.00 . A A . 37 LYS H 1 1
1 546 1 1 37 LYS HA H 3.950 -12.331 -11.329 1.00 . A A . 37 LYS HA 1 1
1 547 1 1 37 LYS HB2 H 2.752 -13.275 -13.265 1.00 . A A . 37 LYS HB2 1 1
1 548 1 1 37 LYS HB3 H 4.124 -14.293 -12.827 1.00 . A A . 37 LYS HB3 1 1
1 549 1 1 37 LYS HD2 H 0.408 -14.251 -13.082 1.00 . A A . 37 LYS HD2 1 1
1 550 1 1 37 LYS HD3 H 1.494 -14.869 -14.327 1.00 . A A . 37 LYS HD3 1 1
1 551 1 1 37 LYS HE2 H 1.007 -17.191 -13.534 1.00 . A A . 37 LYS HE2 1 1
1 552 1 1 37 LYS HE3 H -0.174 -16.519 -12.409 1.00 . A A . 37 LYS HE3 1 1
1 553 1 1 37 LYS HG2 H 2.764 -16.047 -12.457 1.00 . A A . 37 LYS HG2 1 1
1 554 1 1 37 LYS HG3 H 1.797 -15.101 -11.325 1.00 . A A . 37 LYS HG3 1 1
1 555 1 1 37 LYS HZ1 H -0.346 -15.788 -15.244 1.00 . A A . 37 LYS HZ1 1 1
1 556 1 1 37 LYS HZ2 H -0.895 -17.322 -14.765 1.00 . A A . 37 LYS HZ2 1 1
1 557 1 1 37 LYS HZ3 H -1.582 -15.928 -14.088 1.00 . A A . 37 LYS HZ3 1 1
1 558 1 1 37 LYS N N 3.871 -14.085 -10.156 1.00 . A A . 37 LYS N 1 1
1 559 1 1 37 LYS NZ N -0.704 -16.352 -14.446 1.00 . A A . 37 LYS NZ 1 1
1 560 1 1 37 LYS O O 1.535 -11.565 -10.985 1.00 . A A . 37 LYS O 1 1
1 561 1 1 38 ASP C C -0.171 -12.984 -8.069 1.00 . A A . 38 ASP C 1 1
1 562 1 1 38 ASP CA C -0.176 -13.109 -9.595 1.00 . A A . 38 ASP CA 1 1
1 563 1 1 38 ASP CB C -1.209 -14.156 -10.019 1.00 . A A . 38 ASP CB 1 1
1 564 1 1 38 ASP CG C -2.598 -13.726 -9.546 1.00 . A A . 38 ASP CG 1 1
1 565 1 1 38 ASP H H 1.502 -14.430 -9.872 1.00 . A A . 38 ASP H 1 1
1 566 1 1 38 ASP HA H -0.431 -12.155 -10.033 1.00 . A A . 38 ASP HA 1 1
1 567 1 1 38 ASP HB2 H -1.205 -14.248 -11.096 1.00 . A A . 38 ASP HB2 1 1
1 568 1 1 38 ASP HB3 H -0.958 -15.108 -9.576 1.00 . A A . 38 ASP HB3 1 1
1 569 1 1 38 ASP N N 1.174 -13.526 -10.064 1.00 . A A . 38 ASP N 1 1
1 570 1 1 38 ASP O O -0.294 -13.960 -7.357 1.00 . A A . 38 ASP O 1 1
1 571 1 1 38 ASP OD1 O -2.789 -12.541 -9.330 1.00 . A A . 38 ASP OD1 1 1
1 572 1 1 38 ASP OD2 O -3.449 -14.590 -9.408 1.00 . A A . 38 ASP OD2 1 1
1 573 1 1 39 VAL C C -1.395 -11.940 -5.513 1.00 . A A . 39 VAL C 1 1
1 574 1 1 39 VAL CA C -0.016 -11.603 -6.085 1.00 . A A . 39 VAL CA 1 1
1 575 1 1 39 VAL CB C 0.329 -10.148 -5.758 1.00 . A A . 39 VAL CB 1 1
1 576 1 1 39 VAL CG1 C 1.754 -9.843 -6.226 1.00 . A A . 39 VAL CG1 1 1
1 577 1 1 39 VAL CG2 C -0.653 -9.218 -6.476 1.00 . A A . 39 VAL CG2 1 1
1 578 1 1 39 VAL H H 0.067 -11.015 -8.156 1.00 . A A . 39 VAL H 1 1
1 579 1 1 39 VAL HA H 0.724 -12.255 -5.647 1.00 . A A . 39 VAL HA 1 1
1 580 1 1 39 VAL HB H 0.260 -9.993 -4.691 1.00 . A A . 39 VAL HB 1 1
1 581 1 1 39 VAL HG11 H 2.248 -10.764 -6.498 1.00 . A A . 39 VAL HG11 1 1
1 582 1 1 39 VAL HG12 H 1.718 -9.186 -7.082 1.00 . A A . 39 VAL HG12 1 1
1 583 1 1 39 VAL HG13 H 2.300 -9.364 -5.427 1.00 . A A . 39 VAL HG13 1 1
1 584 1 1 39 VAL HG21 H -1.618 -9.697 -6.543 1.00 . A A . 39 VAL HG21 1 1
1 585 1 1 39 VAL HG22 H -0.745 -8.296 -5.923 1.00 . A A . 39 VAL HG22 1 1
1 586 1 1 39 VAL HG23 H -0.286 -9.008 -7.470 1.00 . A A . 39 VAL HG23 1 1
1 587 1 1 39 VAL N N -0.030 -11.790 -7.564 1.00 . A A . 39 VAL N 1 1
1 588 1 1 39 VAL O O -1.530 -12.284 -4.356 1.00 . A A . 39 VAL O 1 1
1 589 1 1 40 GLU C C -4.018 -13.671 -5.866 1.00 . A A . 40 GLU C 1 1
1 590 1 1 40 GLU CA C -3.789 -12.158 -5.816 1.00 . A A . 40 GLU CA 1 1
1 591 1 1 40 GLU CB C -4.826 -11.458 -6.697 1.00 . A A . 40 GLU CB 1 1
1 592 1 1 40 GLU CD C -5.989 -9.294 -7.155 1.00 . A A . 40 GLU CD 1 1
1 593 1 1 40 GLU CG C -4.976 -10.002 -6.253 1.00 . A A . 40 GLU CG 1 1
1 594 1 1 40 GLU H H -2.290 -11.565 -7.245 1.00 . A A . 40 GLU H 1 1
1 595 1 1 40 GLU HA H -3.889 -11.812 -4.798 1.00 . A A . 40 GLU HA 1 1
1 596 1 1 40 GLU HB2 H -4.503 -11.491 -7.728 1.00 . A A . 40 GLU HB2 1 1
1 597 1 1 40 GLU HB3 H -5.778 -11.960 -6.602 1.00 . A A . 40 GLU HB3 1 1
1 598 1 1 40 GLU HG2 H -5.319 -9.972 -5.229 1.00 . A A . 40 GLU HG2 1 1
1 599 1 1 40 GLU HG3 H -4.021 -9.503 -6.328 1.00 . A A . 40 GLU HG3 1 1
1 600 1 1 40 GLU N N -2.421 -11.844 -6.316 1.00 . A A . 40 GLU N 1 1
1 601 1 1 40 GLU O O -4.947 -14.187 -5.277 1.00 . A A . 40 GLU O 1 1
1 602 1 1 40 GLU OE1 O -7.160 -9.629 -7.072 1.00 . A A . 40 GLU OE1 1 1
1 603 1 1 40 GLU OE2 O -5.578 -8.431 -7.912 1.00 . A A . 40 GLU OE2 1 1
1 604 1 1 41 GLY C C -3.015 -16.501 -5.303 1.00 . A A . 41 GLY C 1 1
1 605 1 1 41 GLY CA C -3.350 -15.863 -6.653 1.00 . A A . 41 GLY CA 1 1
1 606 1 1 41 GLY H H -2.436 -13.950 -7.034 1.00 . A A . 41 GLY H 1 1
1 607 1 1 41 GLY HA2 H -4.373 -16.090 -6.915 1.00 . A A . 41 GLY HA2 1 1
1 608 1 1 41 GLY HA3 H -2.688 -16.258 -7.408 1.00 . A A . 41 GLY HA3 1 1
1 609 1 1 41 GLY N N -3.179 -14.384 -6.565 1.00 . A A . 41 GLY N 1 1
1 610 1 1 41 GLY O O -3.439 -17.599 -5.003 1.00 . A A . 41 GLY O 1 1
1 611 1 1 42 ALA C C -2.153 -15.355 -2.066 1.00 . A A . 42 ALA C 1 1
1 612 1 1 42 ALA CA C -1.893 -16.394 -3.159 1.00 . A A . 42 ALA CA 1 1
1 613 1 1 42 ALA CB C -0.412 -16.779 -3.156 1.00 . A A . 42 ALA CB 1 1
1 614 1 1 42 ALA H H -1.921 -14.939 -4.747 1.00 . A A . 42 ALA H 1 1
1 615 1 1 42 ALA HA H -2.493 -17.273 -2.971 1.00 . A A . 42 ALA HA 1 1
1 616 1 1 42 ALA HB1 H -0.015 -16.689 -4.156 1.00 . A A . 42 ALA HB1 1 1
1 617 1 1 42 ALA HB2 H 0.129 -16.121 -2.493 1.00 . A A . 42 ALA HB2 1 1
1 618 1 1 42 ALA HB3 H -0.307 -17.799 -2.816 1.00 . A A . 42 ALA HB3 1 1
1 619 1 1 42 ALA N N -2.254 -15.823 -4.487 1.00 . A A . 42 ALA N 1 1
1 620 1 1 42 ALA O O -1.603 -14.272 -2.083 1.00 . A A . 42 ALA O 1 1
1 621 1 1 43 SER C C -2.059 -14.592 0.897 1.00 . A A . 43 SER C 1 1
1 622 1 1 43 SER CA C -3.279 -14.711 -0.020 1.00 . A A . 43 SER CA 1 1
1 623 1 1 43 SER CB C -4.478 -15.206 0.789 1.00 . A A . 43 SER CB 1 1
1 624 1 1 43 SER H H -3.416 -16.558 -1.118 1.00 . A A . 43 SER H 1 1
1 625 1 1 43 SER HA H -3.505 -13.744 -0.445 1.00 . A A . 43 SER HA 1 1
1 626 1 1 43 SER HB2 H -4.165 -15.440 1.794 1.00 . A A . 43 SER HB2 1 1
1 627 1 1 43 SER HB3 H -5.233 -14.432 0.821 1.00 . A A . 43 SER HB3 1 1
1 628 1 1 43 SER HG H -5.902 -16.499 0.497 1.00 . A A . 43 SER HG 1 1
1 629 1 1 43 SER N N -2.984 -15.679 -1.114 1.00 . A A . 43 SER N 1 1
1 630 1 1 43 SER O O -1.189 -15.440 0.902 1.00 . A A . 43 SER O 1 1
1 631 1 1 43 SER OG O -5.005 -16.376 0.179 1.00 . A A . 43 SER OG 1 1
1 632 1 1 44 GLN C C -0.590 -14.676 3.360 1.00 . A A . 44 GLN C 1 1
1 633 1 1 44 GLN CA C -0.823 -13.378 2.586 1.00 . A A . 44 GLN CA 1 1
1 634 1 1 44 GLN CB C -1.103 -12.239 3.568 1.00 . A A . 44 GLN CB 1 1
1 635 1 1 44 GLN CD C -1.919 -9.877 3.577 1.00 . A A . 44 GLN CD 1 1
1 636 1 1 44 GLN CG C -1.070 -10.903 2.824 1.00 . A A . 44 GLN CG 1 1
1 637 1 1 44 GLN H H -2.700 -12.873 1.656 1.00 . A A . 44 GLN H 1 1
1 638 1 1 44 GLN HA H 0.057 -13.145 2.005 1.00 . A A . 44 GLN HA 1 1
1 639 1 1 44 GLN HB2 H -2.078 -12.380 4.014 1.00 . A A . 44 GLN HB2 1 1
1 640 1 1 44 GLN HB3 H -0.350 -12.237 4.341 1.00 . A A . 44 GLN HB3 1 1
1 641 1 1 44 GLN HE21 H -0.451 -8.548 3.709 1.00 . A A . 44 GLN HE21 1 1
1 642 1 1 44 GLN HE22 H -1.922 -8.075 4.410 1.00 . A A . 44 GLN HE22 1 1
1 643 1 1 44 GLN HG2 H -0.049 -10.551 2.762 1.00 . A A . 44 GLN HG2 1 1
1 644 1 1 44 GLN HG3 H -1.466 -11.035 1.829 1.00 . A A . 44 GLN HG3 1 1
1 645 1 1 44 GLN N N -1.988 -13.547 1.673 1.00 . A A . 44 GLN N 1 1
1 646 1 1 44 GLN NE2 N -1.387 -8.739 3.928 1.00 . A A . 44 GLN NE2 1 1
1 647 1 1 44 GLN O O 0.527 -15.132 3.501 1.00 . A A . 44 GLN O 1 1
1 648 1 1 44 GLN OE1 O -3.079 -10.114 3.848 1.00 . A A . 44 GLN OE1 1 1
1 649 1 1 45 GLU C C -0.932 -17.630 3.680 1.00 . A A . 45 GLU C 1 1
1 650 1 1 45 GLU CA C -1.463 -16.548 4.622 1.00 . A A . 45 GLU CA 1 1
1 651 1 1 45 GLU CB C -2.809 -16.989 5.198 1.00 . A A . 45 GLU CB 1 1
1 652 1 1 45 GLU CD C -2.320 -16.127 7.492 1.00 . A A . 45 GLU CD 1 1
1 653 1 1 45 GLU CG C -3.247 -16.002 6.281 1.00 . A A . 45 GLU CG 1 1
1 654 1 1 45 GLU H H -2.529 -14.898 3.736 1.00 . A A . 45 GLU H 1 1
1 655 1 1 45 GLU HA H -0.758 -16.394 5.427 1.00 . A A . 45 GLU HA 1 1
1 656 1 1 45 GLU HB2 H -3.547 -17.013 4.409 1.00 . A A . 45 GLU HB2 1 1
1 657 1 1 45 GLU HB3 H -2.709 -17.974 5.629 1.00 . A A . 45 GLU HB3 1 1
1 658 1 1 45 GLU HG2 H -3.199 -14.995 5.891 1.00 . A A . 45 GLU HG2 1 1
1 659 1 1 45 GLU HG3 H -4.261 -16.224 6.582 1.00 . A A . 45 GLU HG3 1 1
1 660 1 1 45 GLU N N -1.634 -15.279 3.861 1.00 . A A . 45 GLU N 1 1
1 661 1 1 45 GLU O O -0.075 -18.414 4.039 1.00 . A A . 45 GLU O 1 1
1 662 1 1 45 GLU OE1 O -2.244 -17.212 8.045 1.00 . A A . 45 GLU OE1 1 1
1 663 1 1 45 GLU OE2 O -1.703 -15.135 7.844 1.00 . A A . 45 GLU OE2 1 1
1 664 1 1 46 GLU C C 0.423 -18.278 0.977 1.00 . A A . 46 GLU C 1 1
1 665 1 1 46 GLU CA C -0.947 -18.701 1.509 1.00 . A A . 46 GLU CA 1 1
1 666 1 1 46 GLU CB C -1.934 -18.816 0.346 1.00 . A A . 46 GLU CB 1 1
1 667 1 1 46 GLU CD C -4.291 -19.432 -0.220 1.00 . A A . 46 GLU CD 1 1
1 668 1 1 46 GLU CG C -3.355 -18.962 0.896 1.00 . A A . 46 GLU CG 1 1
1 669 1 1 46 GLU H H -2.115 -17.030 2.204 1.00 . A A . 46 GLU H 1 1
1 670 1 1 46 GLU HA H -0.862 -19.655 2.008 1.00 . A A . 46 GLU HA 1 1
1 671 1 1 46 GLU HB2 H -1.874 -17.928 -0.267 1.00 . A A . 46 GLU HB2 1 1
1 672 1 1 46 GLU HB3 H -1.691 -19.683 -0.250 1.00 . A A . 46 GLU HB3 1 1
1 673 1 1 46 GLU HG2 H -3.357 -19.686 1.698 1.00 . A A . 46 GLU HG2 1 1
1 674 1 1 46 GLU HG3 H -3.695 -18.008 1.270 1.00 . A A . 46 GLU HG3 1 1
1 675 1 1 46 GLU N N -1.429 -17.675 2.475 1.00 . A A . 46 GLU N 1 1
1 676 1 1 46 GLU O O 1.426 -18.906 1.253 1.00 . A A . 46 GLU O 1 1
1 677 1 1 46 GLU OE1 O -3.824 -19.571 -1.339 1.00 . A A . 46 GLU OE1 1 1
1 678 1 1 46 GLU OE2 O -5.457 -19.648 0.064 1.00 . A A . 46 GLU OE2 1 1
1 679 1 1 47 VAL C C 2.847 -16.883 0.777 1.00 . A A . 47 VAL C 1 1
1 680 1 1 47 VAL CA C 1.785 -16.754 -0.315 1.00 . A A . 47 VAL CA 1 1
1 681 1 1 47 VAL CB C 1.674 -15.291 -0.749 1.00 . A A . 47 VAL CB 1 1
1 682 1 1 47 VAL CG1 C 2.769 -14.471 -0.066 1.00 . A A . 47 VAL CG1 1 1
1 683 1 1 47 VAL CG2 C 1.840 -15.194 -2.267 1.00 . A A . 47 VAL CG2 1 1
1 684 1 1 47 VAL H H -0.342 -16.720 0.014 1.00 . A A . 47 VAL H 1 1
1 685 1 1 47 VAL HA H 2.062 -17.363 -1.164 1.00 . A A . 47 VAL HA 1 1
1 686 1 1 47 VAL HB H 0.706 -14.905 -0.465 1.00 . A A . 47 VAL HB 1 1
1 687 1 1 47 VAL HG11 H 3.730 -14.928 -0.251 1.00 . A A . 47 VAL HG11 1 1
1 688 1 1 47 VAL HG12 H 2.767 -13.466 -0.461 1.00 . A A . 47 VAL HG12 1 1
1 689 1 1 47 VAL HG13 H 2.585 -14.440 0.997 1.00 . A A . 47 VAL HG13 1 1
1 690 1 1 47 VAL HG21 H 2.529 -15.956 -2.603 1.00 . A A . 47 VAL HG21 1 1
1 691 1 1 47 VAL HG22 H 0.882 -15.339 -2.744 1.00 . A A . 47 VAL HG22 1 1
1 692 1 1 47 VAL HG23 H 2.228 -14.220 -2.526 1.00 . A A . 47 VAL HG23 1 1
1 693 1 1 47 VAL N N 0.475 -17.215 0.223 1.00 . A A . 47 VAL N 1 1
1 694 1 1 47 VAL O O 3.946 -17.346 0.539 1.00 . A A . 47 VAL O 1 1
1 695 1 1 48 GLU C C 3.832 -18.037 3.353 1.00 . A A . 48 GLU C 1 1
1 696 1 1 48 GLU CA C 3.484 -16.570 3.085 1.00 . A A . 48 GLU CA 1 1
1 697 1 1 48 GLU CB C 2.803 -15.965 4.298 1.00 . A A . 48 GLU CB 1 1
1 698 1 1 48 GLU CD C 3.670 -14.801 6.327 1.00 . A A . 48 GLU CD 1 1
1 699 1 1 48 GLU CG C 3.617 -14.781 4.799 1.00 . A A . 48 GLU CG 1 1
1 700 1 1 48 GLU H H 1.642 -16.111 2.160 1.00 . A A . 48 GLU H 1 1
1 701 1 1 48 GLU HA H 4.378 -16.013 2.851 1.00 . A A . 48 GLU HA 1 1
1 702 1 1 48 GLU HB2 H 1.815 -15.626 4.016 1.00 . A A . 48 GLU HB2 1 1
1 703 1 1 48 GLU HB3 H 2.715 -16.704 5.061 1.00 . A A . 48 GLU HB3 1 1
1 704 1 1 48 GLU HG2 H 4.616 -14.843 4.397 1.00 . A A . 48 GLU HG2 1 1
1 705 1 1 48 GLU HG3 H 3.149 -13.868 4.465 1.00 . A A . 48 GLU HG3 1 1
1 706 1 1 48 GLU N N 2.526 -16.480 1.977 1.00 . A A . 48 GLU N 1 1
1 707 1 1 48 GLU O O 4.961 -18.455 3.194 1.00 . A A . 48 GLU O 1 1
1 708 1 1 48 GLU OE1 O 2.981 -15.618 6.915 1.00 . A A . 48 GLU OE1 1 1
1 709 1 1 48 GLU OE2 O 4.401 -13.999 6.885 1.00 . A A . 48 GLU OE2 1 1
1 710 1 1 49 GLU C C 4.061 -20.820 2.942 1.00 . A A . 49 GLU C 1 1
1 711 1 1 49 GLU CA C 3.149 -20.258 4.035 1.00 . A A . 49 GLU CA 1 1
1 712 1 1 49 GLU CB C 1.834 -21.041 4.055 1.00 . A A . 49 GLU CB 1 1
1 713 1 1 49 GLU CD C 0.439 -22.448 5.577 1.00 . A A . 49 GLU CD 1 1
1 714 1 1 49 GLU CG C 1.386 -21.249 5.503 1.00 . A A . 49 GLU CG 1 1
1 715 1 1 49 GLU H H 1.964 -18.465 3.882 1.00 . A A . 49 GLU H 1 1
1 716 1 1 49 GLU HA H 3.639 -20.352 4.993 1.00 . A A . 49 GLU HA 1 1
1 717 1 1 49 GLU HB2 H 1.078 -20.486 3.519 1.00 . A A . 49 GLU HB2 1 1
1 718 1 1 49 GLU HB3 H 1.979 -22.001 3.584 1.00 . A A . 49 GLU HB3 1 1
1 719 1 1 49 GLU HG2 H 2.250 -21.432 6.124 1.00 . A A . 49 GLU HG2 1 1
1 720 1 1 49 GLU HG3 H 0.873 -20.365 5.851 1.00 . A A . 49 GLU HG3 1 1
1 721 1 1 49 GLU N N 2.870 -18.821 3.759 1.00 . A A . 49 GLU N 1 1
1 722 1 1 49 GLU O O 5.039 -21.485 3.217 1.00 . A A . 49 GLU O 1 1
1 723 1 1 49 GLU OE1 O -0.342 -22.620 4.656 1.00 . A A . 49 GLU OE1 1 1
1 724 1 1 49 GLU OE2 O 0.512 -23.175 6.554 1.00 . A A . 49 GLU OE2 1 1
1 725 1 1 50 ALA C C 6.014 -20.516 0.731 1.00 . A A . 50 ALA C 1 1
1 726 1 1 50 ALA CA C 4.596 -21.077 0.592 1.00 . A A . 50 ALA CA 1 1
1 727 1 1 50 ALA CB C 4.006 -20.639 -0.750 1.00 . A A . 50 ALA CB 1 1
1 728 1 1 50 ALA H H 2.954 -20.019 1.501 1.00 . A A . 50 ALA H 1 1
1 729 1 1 50 ALA HA H 4.628 -22.156 0.637 1.00 . A A . 50 ALA HA 1 1
1 730 1 1 50 ALA HB1 H 3.390 -19.764 -0.603 1.00 . A A . 50 ALA HB1 1 1
1 731 1 1 50 ALA HB2 H 4.806 -20.404 -1.436 1.00 . A A . 50 ALA HB2 1 1
1 732 1 1 50 ALA HB3 H 3.405 -21.438 -1.157 1.00 . A A . 50 ALA HB3 1 1
1 733 1 1 50 ALA N N 3.748 -20.558 1.702 1.00 . A A . 50 ALA N 1 1
1 734 1 1 50 ALA O O 6.989 -21.215 0.537 1.00 . A A . 50 ALA O 1 1
1 735 1 1 51 MET C C 8.277 -19.418 2.277 1.00 . A A . 51 MET C 1 1
1 736 1 1 51 MET CA C 7.487 -18.654 1.211 1.00 . A A . 51 MET CA 1 1
1 737 1 1 51 MET CB C 7.345 -17.190 1.634 1.00 . A A . 51 MET CB 1 1
1 738 1 1 51 MET CE C 8.201 -14.151 1.007 1.00 . A A . 51 MET CE 1 1
1 739 1 1 51 MET CG C 8.721 -16.627 1.995 1.00 . A A . 51 MET CG 1 1
1 740 1 1 51 MET H H 5.334 -18.715 1.213 1.00 . A A . 51 MET H 1 1
1 741 1 1 51 MET HA H 8.011 -18.707 0.269 1.00 . A A . 51 MET HA 1 1
1 742 1 1 51 MET HB2 H 6.924 -16.619 0.818 1.00 . A A . 51 MET HB2 1 1
1 743 1 1 51 MET HB3 H 6.695 -17.125 2.493 1.00 . A A . 51 MET HB3 1 1
1 744 1 1 51 MET HE1 H 8.362 -14.868 0.215 1.00 . A A . 51 MET HE1 1 1
1 745 1 1 51 MET HE2 H 7.176 -13.806 0.984 1.00 . A A . 51 MET HE2 1 1
1 746 1 1 51 MET HE3 H 8.862 -13.311 0.868 1.00 . A A . 51 MET HE3 1 1
1 747 1 1 51 MET HG2 H 9.170 -17.239 2.763 1.00 . A A . 51 MET HG2 1 1
1 748 1 1 51 MET HG3 H 9.352 -16.628 1.120 1.00 . A A . 51 MET HG3 1 1
1 749 1 1 51 MET N N 6.134 -19.260 1.063 1.00 . A A . 51 MET N 1 1
1 750 1 1 51 MET O O 9.454 -19.674 2.125 1.00 . A A . 51 MET O 1 1
1 751 1 1 51 MET SD S 8.537 -14.932 2.604 1.00 . A A . 51 MET SD 1 1
1 752 1 1 52 ASP C C 8.606 -21.969 3.970 1.00 . A A . 52 ASP C 1 1
1 753 1 1 52 ASP CA C 8.355 -20.529 4.427 1.00 . A A . 52 ASP CA 1 1
1 754 1 1 52 ASP CB C 7.505 -20.539 5.699 1.00 . A A . 52 ASP CB 1 1
1 755 1 1 52 ASP CG C 8.419 -20.557 6.926 1.00 . A A . 52 ASP CG 1 1
1 756 1 1 52 ASP H H 6.688 -19.567 3.460 1.00 . A A . 52 ASP H 1 1
1 757 1 1 52 ASP HA H 9.301 -20.048 4.630 1.00 . A A . 52 ASP HA 1 1
1 758 1 1 52 ASP HB2 H 6.885 -19.655 5.724 1.00 . A A . 52 ASP HB2 1 1
1 759 1 1 52 ASP HB3 H 6.879 -21.419 5.707 1.00 . A A . 52 ASP HB3 1 1
1 760 1 1 52 ASP N N 7.639 -19.783 3.355 1.00 . A A . 52 ASP N 1 1
1 761 1 1 52 ASP O O 9.375 -22.694 4.567 1.00 . A A . 52 ASP O 1 1
1 762 1 1 52 ASP OD1 O 9.415 -19.852 6.907 1.00 . A A . 52 ASP OD1 1 1
1 763 1 1 52 ASP OD2 O 8.108 -21.274 7.862 1.00 . A A . 52 ASP OD2 1 1
1 764 1 1 53 THR C C 9.404 -23.830 1.528 1.00 . A A . 53 THR C 1 1
1 765 1 1 53 THR CA C 8.163 -23.779 2.422 1.00 . A A . 53 THR CA 1 1
1 766 1 1 53 THR CB C 6.937 -24.218 1.618 1.00 . A A . 53 THR CB 1 1
1 767 1 1 53 THR CG2 C 6.875 -25.746 1.571 1.00 . A A . 53 THR CG2 1 1
1 768 1 1 53 THR H H 7.344 -21.786 2.447 1.00 . A A . 53 THR H 1 1
1 769 1 1 53 THR HA H 8.298 -24.442 3.264 1.00 . A A . 53 THR HA 1 1
1 770 1 1 53 THR HB H 7.009 -23.834 0.612 1.00 . A A . 53 THR HB 1 1
1 771 1 1 53 THR HG1 H 5.777 -23.973 3.160 1.00 . A A . 53 THR HG1 1 1
1 772 1 1 53 THR HG21 H 7.849 -26.137 1.316 1.00 . A A . 53 THR HG21 1 1
1 773 1 1 53 THR HG22 H 6.579 -26.124 2.538 1.00 . A A . 53 THR HG22 1 1
1 774 1 1 53 THR HG23 H 6.157 -26.054 0.827 1.00 . A A . 53 THR HG23 1 1
1 775 1 1 53 THR N N 7.961 -22.387 2.915 1.00 . A A . 53 THR N 1 1
1 776 1 1 53 THR O O 9.965 -24.881 1.291 1.00 . A A . 53 THR O 1 1
1 777 1 1 53 THR OG1 O 5.761 -23.713 2.236 1.00 . A A . 53 THR OG1 1 1
1 778 1 1 54 CYS C C 12.284 -22.998 0.992 1.00 . A A . 54 CYS C 1 1
1 779 1 1 54 CYS CA C 11.041 -22.692 0.153 1.00 . A A . 54 CYS CA 1 1
1 780 1 1 54 CYS CB C 11.188 -21.313 -0.494 1.00 . A A . 54 CYS CB 1 1
1 781 1 1 54 CYS H H 9.370 -21.866 1.235 1.00 . A A . 54 CYS H 1 1
1 782 1 1 54 CYS HA H 10.932 -23.442 -0.615 1.00 . A A . 54 CYS HA 1 1
1 783 1 1 54 CYS HB2 H 10.231 -20.991 -0.874 1.00 . A A . 54 CYS HB2 1 1
1 784 1 1 54 CYS HB3 H 11.540 -20.606 0.242 1.00 . A A . 54 CYS HB3 1 1
1 785 1 1 54 CYS N N 9.836 -22.704 1.031 1.00 . A A . 54 CYS N 1 1
1 786 1 1 54 CYS O O 12.353 -22.646 2.153 1.00 . A A . 54 CYS O 1 1
1 787 1 1 54 CYS SG S 12.367 -21.261 -1.893 1.00 . A A . 54 CYS SG 1 1
1 788 1 1 55 PRO C C 15.381 -22.772 1.236 1.00 . A A . 55 PRO C 1 1
1 789 1 1 55 PRO CA C 14.492 -24.008 1.065 1.00 . A A . 55 PRO CA 1 1
1 790 1 1 55 PRO CB C 15.143 -25.024 0.128 1.00 . A A . 55 PRO CB 1 1
1 791 1 1 55 PRO CD C 13.214 -24.100 -1.026 1.00 . A A . 55 PRO CD 1 1
1 792 1 1 55 PRO CG C 14.581 -24.718 -1.228 1.00 . A A . 55 PRO CG 1 1
1 793 1 1 55 PRO HA H 14.284 -24.464 2.020 1.00 . A A . 55 PRO HA 1 1
1 794 1 1 55 PRO HB2 H 16.218 -24.901 0.164 1.00 . A A . 55 PRO HB2 1 1
1 795 1 1 55 PRO HB3 H 14.886 -26.021 0.445 1.00 . A A . 55 PRO HB3 1 1
1 796 1 1 55 PRO HD2 H 13.076 -23.266 -1.702 1.00 . A A . 55 PRO HD2 1 1
1 797 1 1 55 PRO HD3 H 12.441 -24.837 -1.172 1.00 . A A . 55 PRO HD3 1 1
1 798 1 1 55 PRO HG2 H 15.231 -24.023 -1.741 1.00 . A A . 55 PRO HG2 1 1
1 799 1 1 55 PRO HG3 H 14.489 -25.628 -1.798 1.00 . A A . 55 PRO HG3 1 1
1 800 1 1 55 PRO N N 13.230 -23.646 0.368 1.00 . A A . 55 PRO N 1 1
1 801 1 1 55 PRO O O 15.787 -22.434 2.329 1.00 . A A . 55 PRO O 1 1
1 802 1 1 56 VAL C C 15.665 -19.643 0.418 1.00 . A A . 56 VAL C 1 1
1 803 1 1 56 VAL CA C 16.547 -20.884 0.263 1.00 . A A . 56 VAL CA 1 1
1 804 1 1 56 VAL CB C 17.395 -20.753 -1.003 1.00 . A A . 56 VAL CB 1 1
1 805 1 1 56 VAL CG1 C 18.862 -21.037 -0.668 1.00 . A A . 56 VAL CG1 1 1
1 806 1 1 56 VAL CG2 C 16.909 -21.761 -2.047 1.00 . A A . 56 VAL CG2 1 1
1 807 1 1 56 VAL H H 15.347 -22.385 -0.712 1.00 . A A . 56 VAL H 1 1
1 808 1 1 56 VAL HA H 17.194 -20.975 1.123 1.00 . A A . 56 VAL HA 1 1
1 809 1 1 56 VAL HB H 17.303 -19.752 -1.395 1.00 . A A . 56 VAL HB 1 1
1 810 1 1 56 VAL HG11 H 19.079 -20.677 0.328 1.00 . A A . 56 VAL HG11 1 1
1 811 1 1 56 VAL HG12 H 19.042 -22.100 -0.714 1.00 . A A . 56 VAL HG12 1 1
1 812 1 1 56 VAL HG13 H 19.497 -20.532 -1.379 1.00 . A A . 56 VAL HG13 1 1
1 813 1 1 56 VAL HG21 H 15.856 -21.609 -2.231 1.00 . A A . 56 VAL HG21 1 1
1 814 1 1 56 VAL HG22 H 17.460 -21.620 -2.966 1.00 . A A . 56 VAL HG22 1 1
1 815 1 1 56 VAL HG23 H 17.071 -22.765 -1.682 1.00 . A A . 56 VAL HG23 1 1
1 816 1 1 56 VAL N N 15.686 -22.096 0.162 1.00 . A A . 56 VAL N 1 1
1 817 1 1 56 VAL O O 16.129 -18.581 0.780 1.00 . A A . 56 VAL O 1 1
1 818 1 1 57 GLN C C 13.905 -17.509 -0.713 1.00 . A A . 57 GLN C 1 1
1 819 1 1 57 GLN CA C 13.484 -18.598 0.277 1.00 . A A . 57 GLN CA 1 1
1 820 1 1 57 GLN CB C 13.562 -18.049 1.703 1.00 . A A . 57 GLN CB 1 1
1 821 1 1 57 GLN CD C 12.326 -17.823 3.863 1.00 . A A . 57 GLN CD 1 1
1 822 1 1 57 GLN CG C 12.206 -18.221 2.391 1.00 . A A . 57 GLN CG 1 1
1 823 1 1 57 GLN H H 14.039 -20.636 -0.145 1.00 . A A . 57 GLN H 1 1
1 824 1 1 57 GLN HA H 12.470 -18.904 0.064 1.00 . A A . 57 GLN HA 1 1
1 825 1 1 57 GLN HB2 H 14.318 -18.587 2.255 1.00 . A A . 57 GLN HB2 1 1
1 826 1 1 57 GLN HB3 H 13.816 -17.000 1.672 1.00 . A A . 57 GLN HB3 1 1
1 827 1 1 57 GLN HE21 H 12.570 -19.688 4.496 1.00 . A A . 57 GLN HE21 1 1
1 828 1 1 57 GLN HE22 H 12.588 -18.504 5.710 1.00 . A A . 57 GLN HE22 1 1
1 829 1 1 57 GLN HG2 H 11.474 -17.592 1.905 1.00 . A A . 57 GLN HG2 1 1
1 830 1 1 57 GLN HG3 H 11.896 -19.252 2.324 1.00 . A A . 57 GLN HG3 1 1
1 831 1 1 57 GLN N N 14.395 -19.770 0.144 1.00 . A A . 57 GLN N 1 1
1 832 1 1 57 GLN NE2 N 12.509 -18.748 4.765 1.00 . A A . 57 GLN NE2 1 1
1 833 1 1 57 GLN O O 14.233 -16.402 -0.332 1.00 . A A . 57 GLN O 1 1
1 834 1 1 57 GLN OE1 O 12.251 -16.656 4.197 1.00 . A A . 57 GLN OE1 1 1
1 835 1 1 58 CYS C C 13.155 -15.793 -3.186 1.00 . A A . 58 CYS C 1 1
1 836 1 1 58 CYS CA C 14.297 -16.793 -2.995 1.00 . A A . 58 CYS CA 1 1
1 837 1 1 58 CYS CB C 14.595 -17.486 -4.325 1.00 . A A . 58 CYS CB 1 1
1 838 1 1 58 CYS H H 13.629 -18.710 -2.270 1.00 . A A . 58 CYS H 1 1
1 839 1 1 58 CYS HA H 15.179 -16.272 -2.654 1.00 . A A . 58 CYS HA 1 1
1 840 1 1 58 CYS HB2 H 14.293 -16.846 -5.141 1.00 . A A . 58 CYS HB2 1 1
1 841 1 1 58 CYS HB3 H 15.653 -17.685 -4.399 1.00 . A A . 58 CYS HB3 1 1
1 842 1 1 58 CYS HG H 14.275 -19.753 -4.148 1.00 . A A . 58 CYS HG 1 1
1 843 1 1 58 CYS N N 13.898 -17.812 -1.982 1.00 . A A . 58 CYS N 1 1
1 844 1 1 58 CYS O O 12.991 -15.218 -4.244 1.00 . A A . 58 CYS O 1 1
1 845 1 1 58 CYS SG S 13.681 -19.046 -4.413 1.00 . A A . 58 CYS SG 1 1
1 846 1 1 59 ILE C C 11.412 -13.483 -1.289 1.00 . A A . 59 ILE C 1 1
1 847 1 1 59 ILE CA C 11.231 -14.621 -2.295 1.00 . A A . 59 ILE CA 1 1
1 848 1 1 59 ILE CB C 9.914 -15.347 -2.012 1.00 . A A . 59 ILE CB 1 1
1 849 1 1 59 ILE CD1 C 7.430 -15.130 -2.182 1.00 . A A . 59 ILE CD1 1 1
1 850 1 1 59 ILE CG1 C 8.751 -14.360 -2.136 1.00 . A A . 59 ILE CG1 1 1
1 851 1 1 59 ILE CG2 C 9.944 -15.925 -0.596 1.00 . A A . 59 ILE CG2 1 1
1 852 1 1 59 ILE H H 12.511 -16.057 -1.326 1.00 . A A . 59 ILE H 1 1
1 853 1 1 59 ILE HA H 11.210 -14.217 -3.296 1.00 . A A . 59 ILE HA 1 1
1 854 1 1 59 ILE HB H 9.786 -16.149 -2.725 1.00 . A A . 59 ILE HB 1 1
1 855 1 1 59 ILE HD11 H 7.630 -16.190 -2.138 1.00 . A A . 59 ILE HD11 1 1
1 856 1 1 59 ILE HD12 H 6.818 -14.844 -1.339 1.00 . A A . 59 ILE HD12 1 1
1 857 1 1 59 ILE HD13 H 6.910 -14.898 -3.100 1.00 . A A . 59 ILE HD13 1 1
1 858 1 1 59 ILE HG12 H 8.752 -13.695 -1.284 1.00 . A A . 59 ILE HG12 1 1
1 859 1 1 59 ILE HG13 H 8.862 -13.784 -3.042 1.00 . A A . 59 ILE HG13 1 1
1 860 1 1 59 ILE HG21 H 10.166 -15.138 0.109 1.00 . A A . 59 ILE HG21 1 1
1 861 1 1 59 ILE HG22 H 8.982 -16.356 -0.363 1.00 . A A . 59 ILE HG22 1 1
1 862 1 1 59 ILE HG23 H 10.705 -16.689 -0.534 1.00 . A A . 59 ILE HG23 1 1
1 863 1 1 59 ILE N N 12.362 -15.582 -2.170 1.00 . A A . 59 ILE N 1 1
1 864 1 1 59 ILE O O 11.957 -13.669 -0.218 1.00 . A A . 59 ILE O 1 1
1 865 1 1 60 HIS C C 9.911 -10.213 -0.849 1.00 . A A . 60 HIS C 1 1
1 866 1 1 60 HIS CA C 11.107 -11.156 -0.687 1.00 . A A . 60 HIS CA 1 1
1 867 1 1 60 HIS CB C 12.399 -10.400 -1.003 1.00 . A A . 60 HIS CB 1 1
1 868 1 1 60 HIS CD2 C 14.476 -11.927 -0.490 1.00 . A A . 60 HIS CD2 1 1
1 869 1 1 60 HIS CE1 C 14.745 -12.767 -2.469 1.00 . A A . 60 HIS CE1 1 1
1 870 1 1 60 HIS CG C 13.500 -11.385 -1.289 1.00 . A A . 60 HIS CG 1 1
1 871 1 1 60 HIS H H 10.524 -12.177 -2.492 1.00 . A A . 60 HIS H 1 1
1 872 1 1 60 HIS HA H 11.142 -11.522 0.329 1.00 . A A . 60 HIS HA 1 1
1 873 1 1 60 HIS HB2 H 12.245 -9.771 -1.867 1.00 . A A . 60 HIS HB2 1 1
1 874 1 1 60 HIS HB3 H 12.675 -9.789 -0.156 1.00 . A A . 60 HIS HB3 1 1
1 875 1 1 60 HIS HD1 H 13.138 -11.746 -3.371 1.00 . A A . 60 HIS HD1 1 1
1 876 1 1 60 HIS HD2 H 14.614 -11.711 0.558 1.00 . A A . 60 HIS HD2 1 1
1 877 1 1 60 HIS HE1 H 15.127 -13.339 -3.302 1.00 . A A . 60 HIS HE1 1 1
1 878 1 1 60 HIS N N 10.960 -12.306 -1.624 1.00 . A A . 60 HIS N 1 1
1 879 1 1 60 HIS ND1 N 13.691 -11.935 -2.546 1.00 . A A . 60 HIS ND1 1 1
1 880 1 1 60 HIS NE2 N 15.261 -12.800 -1.238 1.00 . A A . 60 HIS NE2 1 1
1 881 1 1 60 HIS O O 9.549 -9.839 -1.946 1.00 . A A . 60 HIS O 1 1
1 882 1 1 61 TRP C C 8.589 -7.541 -0.364 1.00 . A A . 61 TRP C 1 1
1 883 1 1 61 TRP CA C 8.127 -8.909 0.142 1.00 . A A . 61 TRP CA 1 1
1 884 1 1 61 TRP CB C 7.486 -8.753 1.521 1.00 . A A . 61 TRP CB 1 1
1 885 1 1 61 TRP CD1 C 7.585 -11.141 2.355 1.00 . A A . 61 TRP CD1 1 1
1 886 1 1 61 TRP CD2 C 5.490 -10.419 2.001 1.00 . A A . 61 TRP CD2 1 1
1 887 1 1 61 TRP CE2 C 5.381 -11.750 2.458 1.00 . A A . 61 TRP CE2 1 1
1 888 1 1 61 TRP CE3 C 4.316 -9.718 1.700 1.00 . A A . 61 TRP CE3 1 1
1 889 1 1 61 TRP CG C 6.891 -10.055 1.944 1.00 . A A . 61 TRP CG 1 1
1 890 1 1 61 TRP CH2 C 2.975 -11.658 2.308 1.00 . A A . 61 TRP CH2 1 1
1 891 1 1 61 TRP CZ2 C 4.140 -12.369 2.613 1.00 . A A . 61 TRP CZ2 1 1
1 892 1 1 61 TRP CZ3 C 3.063 -10.334 1.852 1.00 . A A . 61 TRP CZ3 1 1
1 893 1 1 61 TRP H H 9.605 -10.139 1.113 1.00 . A A . 61 TRP H 1 1
1 894 1 1 61 TRP HA H 7.401 -9.321 -0.545 1.00 . A A . 61 TRP HA 1 1
1 895 1 1 61 TRP HB2 H 8.229 -8.449 2.236 1.00 . A A . 61 TRP HB2 1 1
1 896 1 1 61 TRP HB3 H 6.709 -8.004 1.472 1.00 . A A . 61 TRP HB3 1 1
1 897 1 1 61 TRP HD1 H 8.660 -11.210 2.433 1.00 . A A . 61 TRP HD1 1 1
1 898 1 1 61 TRP HE1 H 6.937 -13.072 2.994 1.00 . A A . 61 TRP HE1 1 1
1 899 1 1 61 TRP HE3 H 4.383 -8.699 1.350 1.00 . A A . 61 TRP HE3 1 1
1 900 1 1 61 TRP HH2 H 2.009 -12.127 2.423 1.00 . A A . 61 TRP HH2 1 1
1 901 1 1 61 TRP HZ2 H 4.080 -13.389 2.963 1.00 . A A . 61 TRP HZ2 1 1
1 902 1 1 61 TRP HZ3 H 2.162 -9.785 1.617 1.00 . A A . 61 TRP HZ3 1 1
1 903 1 1 61 TRP N N 9.297 -9.827 0.236 1.00 . A A . 61 TRP N 1 1
1 904 1 1 61 TRP NE1 N 6.688 -12.151 2.662 1.00 . A A . 61 TRP NE1 1 1
1 905 1 1 61 TRP O O 9.732 -7.163 -0.205 1.00 . A A . 61 TRP O 1 1
1 906 1 1 62 GLU C C 7.243 -4.380 -0.810 1.00 . A A . 62 GLU C 1 1
1 907 1 1 62 GLU CA C 8.096 -5.453 -1.489 1.00 . A A . 62 GLU CA 1 1
1 908 1 1 62 GLU CB C 7.870 -5.403 -3.002 1.00 . A A . 62 GLU CB 1 1
1 909 1 1 62 GLU CD C 8.303 -3.892 -4.945 1.00 . A A . 62 GLU CD 1 1
1 910 1 1 62 GLU CG C 7.888 -3.948 -3.474 1.00 . A A . 62 GLU CG 1 1
1 911 1 1 62 GLU H H 6.790 -7.119 -1.092 1.00 . A A . 62 GLU H 1 1
1 912 1 1 62 GLU HA H 9.139 -5.272 -1.275 1.00 . A A . 62 GLU HA 1 1
1 913 1 1 62 GLU HB2 H 8.654 -5.955 -3.501 1.00 . A A . 62 GLU HB2 1 1
1 914 1 1 62 GLU HB3 H 6.913 -5.843 -3.238 1.00 . A A . 62 GLU HB3 1 1
1 915 1 1 62 GLU HG2 H 6.902 -3.520 -3.360 1.00 . A A . 62 GLU HG2 1 1
1 916 1 1 62 GLU HG3 H 8.595 -3.386 -2.881 1.00 . A A . 62 GLU HG3 1 1
1 917 1 1 62 GLU N N 7.707 -6.796 -0.974 1.00 . A A . 62 GLU N 1 1
1 918 1 1 62 GLU O O 6.063 -4.256 -1.069 1.00 . A A . 62 GLU O 1 1
1 919 1 1 62 GLU OE1 O 9.488 -4.009 -5.211 1.00 . A A . 62 GLU OE1 1 1
1 920 1 1 62 GLU OE2 O 7.429 -3.734 -5.781 1.00 . A A . 62 GLU OE2 1 1
1 921 1 1 63 ASP C C 7.030 -1.276 -0.113 1.00 . A A . 63 ASP C 1 1
1 922 1 1 63 ASP CA C 7.054 -2.538 0.752 1.00 . A A . 63 ASP CA 1 1
1 923 1 1 63 ASP CB C 7.711 -2.222 2.098 1.00 . A A . 63 ASP CB 1 1
1 924 1 1 63 ASP CG C 6.628 -2.021 3.160 1.00 . A A . 63 ASP CG 1 1
1 925 1 1 63 ASP H H 8.785 -3.719 0.253 1.00 . A A . 63 ASP H 1 1
1 926 1 1 63 ASP HA H 6.043 -2.880 0.917 1.00 . A A . 63 ASP HA 1 1
1 927 1 1 63 ASP HB2 H 8.352 -3.043 2.385 1.00 . A A . 63 ASP HB2 1 1
1 928 1 1 63 ASP HB3 H 8.297 -1.320 2.009 1.00 . A A . 63 ASP HB3 1 1
1 929 1 1 63 ASP N N 7.832 -3.602 0.058 1.00 . A A . 63 ASP N 1 1
1 930 1 1 63 ASP O O 6.044 -0.568 -0.168 1.00 . A A . 63 ASP O 1 1
1 931 1 1 63 ASP OD1 O 6.002 -0.975 3.148 1.00 . A A . 63 ASP OD1 1 1
1 932 1 1 63 ASP OD2 O 6.446 -2.917 3.968 1.00 . A A . 63 ASP OD2 1 1
1 933 1 1 64 GLU C C 8.093 -0.187 -3.120 1.00 . A A . 64 GLU C 1 1
1 934 1 1 64 GLU CA C 8.148 0.227 -1.648 1.00 . A A . 64 GLU CA 1 1
1 935 1 1 64 GLU CB C 9.442 1.000 -1.382 1.00 . A A . 64 GLU CB 1 1
1 936 1 1 64 GLU CD C 10.189 3.331 -0.875 1.00 . A A . 64 GLU CD 1 1
1 937 1 1 64 GLU CG C 9.232 2.479 -1.711 1.00 . A A . 64 GLU CG 1 1
1 938 1 1 64 GLU H H 8.894 -1.572 -0.729 1.00 . A A . 64 GLU H 1 1
1 939 1 1 64 GLU HA H 7.300 0.858 -1.420 1.00 . A A . 64 GLU HA 1 1
1 940 1 1 64 GLU HB2 H 9.716 0.897 -0.342 1.00 . A A . 64 GLU HB2 1 1
1 941 1 1 64 GLU HB3 H 10.232 0.605 -2.003 1.00 . A A . 64 GLU HB3 1 1
1 942 1 1 64 GLU HG2 H 9.424 2.645 -2.761 1.00 . A A . 64 GLU HG2 1 1
1 943 1 1 64 GLU HG3 H 8.214 2.757 -1.484 1.00 . A A . 64 GLU HG3 1 1
1 944 1 1 64 GLU N N 8.109 -0.988 -0.788 1.00 . A A . 64 GLU N 1 1
1 945 1 1 64 GLU O O 7.059 0.015 -3.734 1.00 . A A . 64 GLU O 1 1
1 946 1 1 64 GLU OXT O 9.088 -0.699 -3.608 1.00 . A A . 64 GLU OXT 1 1
1 947 1 1 64 GLU OE1 O 9.955 3.454 0.316 1.00 . A A . 64 GLU OE1 1 1
1 948 1 1 64 GLU OE2 O 11.140 3.845 -1.440 1.00 . A A . 64 GLU OE2 1 1
1 949 2 2 1 SF4 FE1 FE 11.313 -22.432 -6.488 1.00 . B A . 65 SF4 FE1 1 1
1 950 2 2 1 SF4 FE2 FE 10.459 -24.533 -4.900 1.00 . B A . 65 SF4 FE2 1 1
1 951 2 2 1 SF4 FE3 FE 9.024 -21.937 -5.316 1.00 . B A . 65 SF4 FE3 1 1
1 952 2 2 1 SF4 FE4 FE 11.289 -22.052 -3.613 1.00 . B A . 65 SF4 FE4 1 1
1 953 2 2 1 SF4 S1 S 9.377 -23.064 -3.138 1.00 . B A . 65 SF4 S1 1 1
1 954 2 2 1 SF4 S2 S 10.714 -20.535 -5.527 1.00 . B A . 65 SF4 S2 1 1
1 955 2 2 1 SF4 S3 S 12.538 -23.771 -4.828 1.00 . B A . 65 SF4 S3 1 1
1 956 2 2 1 SF4 S4 S 9.589 -23.373 -6.895 1.00 . B A . 65 SF4 S4 1 1
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